Acta Crystallographica Section A

Foundations of Crystallography

Volume 56, Supplement (August 2000)


Abstracts of the Nineteenth European Crystallographic Meeting

Nancy, France, 25-31 August 2000

Cover illustration

abstracts



Acta Cryst. (2000). A56 (Supplement), s1

Decoding the genetic information on the ribosome at close to atomic resolution

A. Yonath



Acta Cryst. (2000). A56 (Supplement), s2

Information transfer in proteins: combining crystallographic and genomic approaches

L. Moulinet, O. Poch, J. C. Thierry and D. Moras



Acta Cryst. (2000). A56 (Supplement), s3

Ab Initio Prediction of Crystal Structures

B. P. van Eijck



Acta Cryst. (2000). A56 (Supplement), s4

Structural Phase Transitions of Simple Metals under Pressure

K. Syassen



Acta Cryst. (2000). A56 (Supplement), s5

Structural Features and Instabilities in Low Dimensional Conductors

J.-P. Pouget



Acta Cryst. (2000). A56 (Supplement), s6

The Probabilistic Theory of the Structure Invariants Assuming a Substructure to be Known

H. Hauptman and H. Xu



Acta Cryst. (2000). A56 (Supplement), s7

X-ray diffraction, an efficient tool for industry: the case of Cosmetic Research

J. L. Lévêque



Acta Cryst. (2000). A56 (Supplement), s8

Femtosecond imaging of biomolecules by X-rays

R. Neutze, R. Wouts, D. van der Spoel, E. Weckert and J. Hajdu



Acta Cryst. (2000). A56 (Supplement), s9

Modular aspects in mineral and inorganic structures

G. Ferraris



Acta Cryst. (2000). A56 (Supplement), s10

The phase problem at medium resolution

P. Main, J. Wilson and G. Reynolds



Acta Cryst. (2000). A56 (Supplement), s11

State of the art of structure analysis using powder diffraction data

L. B. McCusker



Acta Cryst. (2000). A56 (Supplement), s12

The structure of a bacterial 30S ribosomal subunit

V. Ramakrishnan, D. Brodersen, A. P. Carter, W. M. Clemons Jr, R. Morgan-Warren and B. T. Wimberly



Acta Cryst. (2000). A56 (Supplement), s13

Intermolecular interactions involving halogen substituents

I. Csöregh



Acta Cryst. (2000). A56 (Supplement), s14

Superspace Description of Incommensurate and Commensurate Structures beyond the Perturbative /Modulation Approach

J. M. Perez-Mato



Acta Cryst. (2000). A56 (Supplement), s14

Aperiodicities in 2201 and 2212 cuprates, ferrites and cobaltites: differences and similarities

D. Grebille, O. Pérez, N. Jakubowicz and H. Leligny



Acta Cryst. (2000). A56 (Supplement), s15

Refinement of Modulated Structures against Powder Diffraction Data with JANA

M. Wunschel, R. E. Dinnebier, S. van Smaalen, M. Dusek and V. Petricek



Acta Cryst. (2000). A56 (Supplement), s15

The crystal geometry of modulation waves and the thermal expansion anomalies in IC phases

V. Shekhtman and B. Bagautdinov



Acta Cryst. (2000). A56 (Supplement), s16

Cluster covering of dodecagonal and related structures

S. I. Ben-Abraham, P. Gummelt, R. Lück and F. Gähler



Acta Cryst. (2000). A56 (Supplement), s17

DFT calculations on KTiOPO4 (KTP) used in nonlinear optics

K. Schwarz, P. Blaha, P. Delarue, C. Lecomte, V. Jennings and P. A. Thomas



Acta Cryst. (2000). A56 (Supplement), s17

Experimental charge densities of novel thermoelectric clathrate materials

B. B. Iversen



Acta Cryst. (2000). A56 (Supplement), s18

Charge density analysis in semiconducting charge transfer complexes: a comparison between experiment and DFT calculations

C. Katan, P. Rabiller, L. Toupet, M. Souhassou, N. Hansen and C. Lecomte



Acta Cryst. (2000). A56 (Supplement), s18

Spin densities in new molecular magnetic compounds

B. Gillon and J. A. Stride



Acta Cryst. (2000). A56 (Supplement), s19

Electron density distribution in stishovite, SiO2: a high energy synchrotron radiation study

A. Kirfel and T. Lippmann



Acta Cryst. (2000). A56 (Supplement), s20

Making use of experimental charge densities

M. A. Spackman



Acta Cryst. (2000). A56 (Supplement), s20

Exploiting the theoretical electron and spin densities

C. Gatti



Acta Cryst. (2000). A56 (Supplement), s21

Application of the theory of atoms in molecules in the critical analysis of the experimental charge density model

A. Volkov, Yu. Abramov and P. Coppens



Acta Cryst. (2000). A56 (Supplement), s21

A Charge Density Study on Vitamin B12

B. Dittrich, A. Wagner, P. Luger, T. Koritsánsky, H. G. Krane and H. Schmidt



Acta Cryst. (2000). A56 (Supplement), s22

Electron correlation effects through analysis of electron densities

S. Ragot, P. J. Becker and J. M. Gillet



Acta Cryst. (2000). A56 (Supplement), s23

Ab Initio Crystal Structures Solution of Macromolecules

M. C. Burla, M. Camalli, B. Carrozzini, G. Cascarano, C. Giacovazzo, G. Polidori and R. Spagna



Acta Cryst. (2000). A56 (Supplement), s23

Refinement of Twinned Structures with SHELXL-97

R. Herbst-Irmer



Acta Cryst. (2000). A56 (Supplement), s24

Structure Validation: A Moving Target

D. J. Watkin, R. Cooper and C. K. Prout



Acta Cryst. (2000). A56 (Supplement), s24

Structure Solution with PATSEE: Where are the limits?

K. Wagner, S. Rühl and E. Egert



Acta Cryst. (2000). A56 (Supplement), s25

Twinning in Chemical Crystallography: How to Discover what is Disguised

M. Bolte



Acta Cryst. (2000). A56 (Supplement), s26

Modelling and Refinement in Crystallography: An Overview

S. Parsons



Acta Cryst. (2000). A56 (Supplement), s26

Incommensurate structures: modeling beyond the 3rd dimension

G. Chapuis



Acta Cryst. (2000). A56 (Supplement), s27

From modeling and refinement to refinement with modeling

D. Turk



Acta Cryst. (2000). A56 (Supplement), s27

From maps to molecules in minutes

T. J. Oldfield



Acta Cryst. (2000). A56 (Supplement), s28

ARP/wARP: Procedures for automated model building and refinement

A. Perrakis, R. Morris and V. Lamzin



Acta Cryst. (2000). A56 (Supplement), s29

Interference phenomena in X-ray Scattering. Physics, Methodology, Application to phase - sensitive measurements

M. V. Kovalchuk and S. Zheludeva



Acta Cryst. (2000). A56 (Supplement), s29

Focused X-ray Beams: A Renaissance in Laboratory-Based Diffraction Experiments

B. K. Tanner, M. Taylor, J. Wall, N. Loxley, L. Pina and D. K. Bowen



Acta Cryst. (2000). A56 (Supplement), s30

Basics and Modern Applications of 2-D Bent Crystals

E. Förster, I. Uschmann and O. Wehrhan



Acta Cryst. (2000). A56 (Supplement), s30

Imaging using Bragg and Fresnel diffraction of hard X-rays

P. Cloetens, W. Ludwig, J. P. Guigay, P. Rejmánková-Pernot, J. Baruchel and M. Schlenker



Acta Cryst. (2000). A56 (Supplement), s31

Short and long-range order at surfaces probed by surface X-ray diffuse scattering

M. Sauvage-Simkin, Y. Garreau, K. Aïd, N. Jedrecy and R. Pinchaux



Acta Cryst. (2000). A56 (Supplement), s32

HRTEM contribution to the reactivity of rock-forming silicates

A. Baronnet



Acta Cryst. (2000). A56 (Supplement), s32

Structure determination from electron diffraction intensities: practical applications in materials science

J. Gjonnes, V. Hansen and K. Gjonnes



Acta Cryst. (2000). A56 (Supplement), s33

Microstructures of Polygonal Serpentines from HRTEM Imaging, Electron Diffraction, and Simulation Data

B. Devouard and A. Baronnet



Acta Cryst. (2000). A56 (Supplement), s33

The investigation of structural defects in rare-earth yttrium aluminium garnets

S. A. Smirnova



Acta Cryst. (2000). A56 (Supplement), s34

The new electron diffraction method for investigation of crystals with low symmetry

M. G. Kyazumov



Acta Cryst. (2000). A56 (Supplement), s35

Strain and Morphology in Nano-Patterned Semiconductors

T. Baumbach, D. Lübbert, C. Giannini and J. Eymery



Acta Cryst. (2000). A56 (Supplement), s35

Detection and chemical analysis of nanophases at grain boundaries by high resolution and energy filtered electron microscopy

J. M. Pénisson, M. Bacia and T. Vystavel



Acta Cryst. (2000). A56 (Supplement), s36

The new analytical high-resolution electron microscopes - the perfect tool for nanoscience

L. R. Wallenberg



Acta Cryst. (2000). A56 (Supplement), s36

Total external fluorescence and XRSW study of multilayer nanostructures

S. Zheludeva



Acta Cryst. (2000). A56 (Supplement), s37

Characterization of binary and ternary fuel cell catalysts by XRD and TEM

C. Roth, N. Martz and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s38

Crystal Structure and Morphology of Polymers

B. Lotz



Acta Cryst. (2000). A56 (Supplement), s38

Electron Crystallography on small organic molecules with high NLO activity

U. Kolb, G. Nosova and I. G. Voigt-Martin



Acta Cryst. (2000). A56 (Supplement), s39

Solving and Refining Crystal Structures Using Electron Diffraction Data

C. J. Gilmore and A. Stewart



Acta Cryst. (2000). A56 (Supplement), s39

Electron Powder Diffraction - An old topic rediscovered for structure determination of nanocrystalline materials

T. E. Weirich



Acta Cryst. (2000). A56 (Supplement), s40

TEM investigations on microcrystalline SiO2

C. Wahl, G. Miehe and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s41

Recent developments in the realization of a practical pressure scale for extreme conditions

W. B. Holzapfel



Acta Cryst. (2000). A56 (Supplement), s41

Advances in high-pressure experiments combining XAS, temperature scans, and ESXD

A. Filipponi, P. Itiè and A. Di Cicco



Acta Cryst. (2000). A56 (Supplement), s42

Structural transitions related to magnetic phenomena under high pressure

G. Kh. Rozenberg and M. P. Pasternak



Acta Cryst. (2000). A56 (Supplement), s42

Low temperature structural studies of molecular crystals under pressure. X-ray diffraction equipment for (P+T) phase diagram investigations

Y. Barrans, J. Gaultier, D. Le Pevelen, P. Guionneau and D. Chasseau



Acta Cryst. (2000). A56 (Supplement), s43

Structure of Liquids at High Pressure Probed by X-ray Diffraction

M. Mezouar, S. Bauchau and G. Blattman



Acta Cryst. (2000). A56 (Supplement), s44

High-Pressure powder crystallography using synchrotron- and neutron-radiation

M. Kunz



Acta Cryst. (2000). A56 (Supplement), s44

The chemical bond under high pressure and at high temperature: semiconductor to metal transition in covalent systems

J.-P. Gaspard and J.-Y. Raty



Acta Cryst. (2000). A56 (Supplement), s45

Structural and Thermodynamic Properties of Hydrogen-Bonded Solids

A. Katrusiak



Acta Cryst. (2000). A56 (Supplement), s45

Neutron Diffraction Study of ND4I and ND4Br Structure at High Pressure and Low Temperature

D. P. Kozlenko, B. N. Savenko, V. P. Glazkov, V. A. Somenkov and S. Hull



Acta Cryst. (2000). A56 (Supplement), s46

High-pressure synthesis of the high-Tc mercury cuprates: an in-situ synchrotron diffraction study

P. Bordet, S. LeFloch, C. Bougerol-Chaillout, M. F. Gorius, A. Prat and M. Mezouar



Acta Cryst. (2000). A56 (Supplement), s47

Technical Advances for Time Resolved Studies in Materials Sciences

H. Graafsma



Acta Cryst. (2000). A56 (Supplement), s48

Picosecond time-resolved X-ray diffraction of the short living excited states of electron-transfer compounds

S. Techert, F. Schotte, H. Staerk, K. A. Zachariasse and M. Wulff



Acta Cryst. (2000). A56 (Supplement), s49

In situ studies of zeolite dehydration reactions

K. Ståhl



Acta Cryst. (2000). A56 (Supplement), s50

X-ray microbeam diffraction: Rapid multilength- scale characterization spanning micrometers to millimeters

S. R. Stock



Acta Cryst. (2000). A56 (Supplement), s50

Application of electron back-scatter diffraction to grain boundary surfaces

V. Randle, H. Davies, R. Wilson and I. Pearce



Acta Cryst. (2000). A56 (Supplement), s51

Local Structural Characterization within Polycrystalline Bulk Materials by High Energy Synchrotron Radiation

U. Lienert, H. F. Poulsen, D. Juul Jensen, E. M. Lauridsen, S. F. Nielsen and L. Margulies



Acta Cryst. (2000). A56 (Supplement), s51

Structural and analytical characterization of semiconductor quantum structures by TEM

W. Neumann, R. Schneider and H. Kirmse



Acta Cryst. (2000). A56 (Supplement), s52

TEM investigation of catalysts for the direct oxidation of methanol in membrane fuel cells

N. Martz, C. Roth and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s53

Overview of Internet technologies and remote use of applications

V. Casarosa



Acta Cryst. (2000). A56 (Supplement), s53

Using the WWW to construct Graphic User Inter-faces to Remote Applications

A. W. Hewat



Acta Cryst. (2000). A56 (Supplement), s54

The Genetic Diversity of available Crystallographic software freely obtainable via the internet

L. M. D. Cranswick



Acta Cryst. (2000). A56 (Supplement), s54

Maud: a Rietveld analysis program designed for the internet and experiment integration

L. Lutterotti



Acta Cryst. (2000). A56 (Supplement), s55

Teaching Diffraction Using Computer Simulations over the Internet

Th. Proffen and R. B. Neder



Acta Cryst. (2000). A56 (Supplement), s56

How much have systematic studies on protein crystallization influenced current practices in protein crystallography

M. Budayova-Spano and J. C. Fontecilla-Camps



Acta Cryst. (2000). A56 (Supplement), s56

Novel Cryo-cooling techniques

S. Panjikar, A. Riboldi-Tunnicliffe and R. Hilgenfeld



Acta Cryst. (2000). A56 (Supplement), s57

Gearing Up for Structural Genomics: The Challenge of Hundreds of Proteins and Hundreds of Thousands of Crystallization Experiments Per Year

J. R. Luft, J. Wolfley, R. Collins, M. Bianca, D. Weeks, I. Jurisica, P. Rogers, J. Glasgow, S. Fortier and G. T. DeTitta



Acta Cryst. (2000). A56 (Supplement), s57

Crystallization of Aldose Reductase leading to Single Wavelength (0.66  Å) and MAD (0.9  Å) subatomic resolution studies

E. I. Howard, R. Cachau, A. Mitschler, P. Barth, B. Chevrier, V. Lamour, A. Joachimiak, R. Sanishvili, M. Van Zandt, D. Moras and A. Podjarny



Acta Cryst. (2000). A56 (Supplement), s58

A novel, fusion protein strategy for membrane protein crystallization

B. Byrne, M. Jormakka, J. Abramson and S. Iwata



Acta Cryst. (2000). A56 (Supplement), s59

Round-Table Discussion: Crystallography in Africa

J. Boyens, A. Thalal, F. Allen, L. Aslanov and G. Kamau



Acta Cryst. (2000). A56 (Supplement), s59

Moroccan crystallography situation

A. Thalal, B. Tanouti and N. Bouhmaida



Acta Cryst. (2000). A56 (Supplement), s60

Synthesis, structure and electrochemistry of substituted heteropolyanions

I. M. Mbomekalle, E. Ngameni, S. Ponou and Y. A. Mbiangue



Acta Cryst. (2000). A56 (Supplement), s61

Anomalous Diffraction with Soft X-ray Synchrotron Radiation

P. Carpentier, C. Berthet-Colominas, M. Capitan, M.-L. Chesne, E. Fanchon, R. Kahn, S. Lequien, H. Stuhrmann, D. Thiaudière, J. Vicat and P. Zielinski



Acta Cryst. (2000). A56 (Supplement), s61

A combined anomalous scattering and direct methods approach to solve apocrustacyanin proteins (C1 and A1)

A. Olczak, M. Cianci, J. Raftery, P. J. Rizkallah, D. Moorcroft, E. J. Gordon, S. McSweeney, N. E. Chayen, P. Zagalsky and J. R. Helliwell



Acta Cryst. (2000). A56 (Supplement), s62

Anomalous Dispersion Experiments in Microporous Materials Crystallography

V. Kaucic, N. Zabukovec Logar, M. Helliwell and J. R. Helliwell



Acta Cryst. (2000). A56 (Supplement), s62

Use of map connectivity properties in macromolecular ab-initio phasing

N. L. Lunina, V. Y. Lunin and A. G. Urzhumtsev



Acta Cryst. (2000). A56 (Supplement), s63

Thermal Neutron Laue Diffraction Using the Diffractometer LADI at the ILL

J. A. Cowan, G. J. McIntyre, C. Wilkinson, D. D. A. Myles and J. A. K. Howard



Acta Cryst. (2000). A56 (Supplement), s64

Resonant X-ray Scattering: Applications to the study of magnetism

C. Vettier



Acta Cryst. (2000). A56 (Supplement), s64

Anisotropy of resonance X-ray scattering and forbidden reflections in crystals and incommensurate structures

V. E. Dmitrienko and E. N. Ovchinnikova



Acta Cryst. (2000). A56 (Supplement), s65

Diffraction Anomalous Fine Structure for probing local structure: strain, ordering, low dimensionality effects

M. G. Proietti, H. Renevier, S. Grenier, G. Subias, L. Gonzalez, J. M. Garcia, J. L. Hodeau and J. Garcia



Acta Cryst. (2000). A56 (Supplement), s65

Multiple Scattering approach to DAFS: Surface and Interface applications

R. Felici, M. Benfatto and V. Formoso



Acta Cryst. (2000). A56 (Supplement), s66

Applications of resonant X-ray scattering in the hard- and soft-X-ray regime

U. Staub



Acta Cryst. (2000). A56 (Supplement), s67

State-of-the-art in time-of-flight neutron diffraction

C. C. Wilson



Acta Cryst. (2000). A56 (Supplement), s67

The use of neutron polarimetry for general antiferro-magnetic structure determination and the measurement of antiferro-magnetic density

F. Tasset



Acta Cryst. (2000). A56 (Supplement), s68

Neutron diffraction studies in the 50  GPa pressure range: recent results on magnetic structures and phase transitions

I. N. Goncharenko, I. Mirebeau, J.-M. Mignot, A. Ochiai and S. Carlson



Acta Cryst. (2000). A56 (Supplement), s68

Fast Powder Diffraction with a New PSD at the High Intensity Neutron Diffractometer D20

T. C. Hansen and P. Convert



Acta Cryst. (2000). A56 (Supplement), s69

Hole and Electron Doping in Bi1-xCaxMnO3 (0<=x<=1) Investigated by Neutron and Synchrotron X-ray Diffraction

J. L. García-Muñoz, M. A. G. Aranda, A. Llobet, C. Frontera, J. A. Alonso and C. Ritter



Acta Cryst. (2000). A56 (Supplement), s70

Hierarchical structure of bone and wood studied by scanning X-ray scattering

P. Fratzl, P. Roschger, I. Zizak, H. Lichtenegger, O. Paris and K. Klaushofer



Acta Cryst. (2000). A56 (Supplement), s70

X-ray diffraction: an excellent tool in studying the skin structure

J. A. Bouwstra, G. S. Gooris and M. Ponec



Acta Cryst. (2000). A56 (Supplement), s71

Muscle contraction studied with interference X-ray diffraction

M. Reconditi, M. Linari, L. Lucii, G. Piazzesi, P. Bösecke, T. Narayanan, M. Irving and V. Lombardi



Acta Cryst. (2000). A56 (Supplement), s71

About X-ray damage on Crystalline Biological Samples

R. B. G. Ravelli and S. M. McSweeney



Acta Cryst. (2000). A56 (Supplement), s72

SAXS and shape determination studies of Escherichia coli L-asparaginase II in solution

M. Kozak, D. Svergun, M. Malfois, M. H. J. Koch and S. Jurga



Acta Cryst. (2000). A56 (Supplement), s73

The Study of Light-Induced Transient Species by Crystallographic Methods

P. Coppens



Acta Cryst. (2000). A56 (Supplement), s73

Electric field driven structural changes in DKDP

S. J. van Reeuwijk, A. Puig-Molina and H. Graafsma



Acta Cryst. (2000). A56 (Supplement), s74

X-ray diffraction imaging of LiNbO3 crystals with electric field induced modifications

P. Pernot-Rejmánková, J. Baruchel and W. Laprus



Acta Cryst. (2000). A56 (Supplement), s74

Macroscopic and microscopic polarization in dielectrics

R. Resta



Acta Cryst. (2000). A56 (Supplement), s75

Cooperative electron transfer at thermo- and photo-induced neutral-ionic phase transformations

E. Collet, M. H. Lemée-Cailleau, M. Buron, H. Cailleau, T. Luty, S. Koshihara, S. Techert, M. Wulf and F. Moussa



Acta Cryst. (2000). A56 (Supplement), s76

The Structure of a new intermediate on the Rotary Catalytic Cycle of F1-ATPase

A. G. W. Leslie, R. I. Menz and J. E. Walker



Acta Cryst. (2000). A56 (Supplement), s76

The RNA-dependent RNA polymerase of hepatitis C virus: 3D structure and implications for viral replication

S. Bressanelli, L. Tomei, A. Roussel, I. Incitti, R.-L. Vitale, M. Mathieu, R. De Francesco and F. A. Rey



Acta Cryst. (2000). A56 (Supplement), s77

Structural basis for the oxygenation of flavonols by flavonol 2,3-dioxygenase

R. A. Steiner, P. I. van Noort, M. R. Egmond and B. W. Dijkstra



Acta Cryst. (2000). A56 (Supplement), s77

Crystallographic studies of the interaction between the Ferredoxin:NADP+:Reductase and Ferredoxin

R. Morales, M. H. Charon and M. Frey



Acta Cryst. (2000). A56 (Supplement), s78

Crystal Structure and Enzyme Mechanism of ?5-3 Ketosteroid Isomerase

B.-H. Oh, H.-S. Cho, G. Choi and K. Y. Choi



Acta Cryst. (2000). A56 (Supplement), s79

Roundtable on Structural Genomics

G. G. Dodson and U. Heinemann



Acta Cryst. (2000). A56 (Supplement), s80

The structure of the 50S ribosomal subunit at 2.7 Å resolution

P. Nissen, N. Ban, J. Hansen, P. B. Moore and T. A. Steitz



Acta Cryst. (2000). A56 (Supplement), s80

New crystal Structures of Ribosomal Proteins Associated with Peptide Bond Formation and GTPase Activation

M. C. Wahl



Acta Cryst. (2000). A56 (Supplement), s81

Functional implications of tRNA Mimicry. Crystal Structure of Ribosome Recycling Factor

M. Selmer, S. Al-Karadaghi, G. Hirokawa, A. Kaji and A. Liljas



Acta Cryst. (2000). A56 (Supplement), s81

Proofreading mechanism hypothesis based on the structure of the Methionyl-tRNA synthetase liganded to L-methionine

L. Serre, G. Verdon, T. Choinowski, N. Hervouet, J. L. Risler and C. Zelwer



Acta Cryst. (2000). A56 (Supplement), s82

tRNAArg recognition by yeast Arginyl-tRNA synthetase: crystal structure of the yeast arginyl-tRNA synthetase-yeast tRNAArg complex at 2.2 Å

B. Delagoutte, D. Moras and J. Cavarelli



Acta Cryst. (2000). A56 (Supplement), s83

3D Crystallization and Structural Studies of Integral Membrane Proteins in Lipidic Cubic phases

P. Nollert, M. L. Chiu, M. C. Loewen, A. Royant, H. Behrhali, K. Edman, J. Hajdu, R. Neutze, E. Pebay-Peyroula and E. M. Landau



Acta Cryst. (2000). A56 (Supplement), s83

Crystal structure at 2.2 Å resolution of fumarate reductase, a respiratory membrane protein complex from Wolinella succinogenes

C. R. D. Lancaster



Acta Cryst. (2000). A56 (Supplement), s84

Structure and Regulation of Outer Membrane Phospholipase A

H. J. Snijder, J. H. van Eerde, R. L. Kingma, I. Ubarretxena, K. H. Kalk, H. M. Verheij, M. R. Egmond, N. Dekker and B. W. Dijkstra



Acta Cryst. (2000). A56 (Supplement), s84

The structure of the haem-copper oxidase from Escherichia coli and binding site for ubiquinone

J. Abramson, S. Riistama, G. Larsson, A. Jasaitis, M. Svensson-Ek, L. Laakkonen, A. Puustinen, S. Iwata and M. Wikström



Acta Cryst. (2000). A56 (Supplement), s85

Crystallization of the reaction center of photosystem ii and of reaction center components

N. Adir, R. Anati, V. Cheredman, Y. Dobrovetzki and N. Lerner



Acta Cryst. (2000). A56 (Supplement), s86

The Molecular Mechanism of Muscle Contraction

K. C. Holmes



Acta Cryst. (2000). A56 (Supplement), s86

Rotary mechanism of ATP synthase

J. E. Walker



Acta Cryst. (2000). A56 (Supplement), s87

Cutting complexity down to size: Structural and mutational studies of the eukaryotic 20S proteasome

M. Groll, R. Huber, M. Glickman, C. Crews, G. Bourenkow, H. Bartunik and D. Finley



Acta Cryst. (2000). A56 (Supplement), s87

Crystal structure of a gamma-herpes virus cyclin/cdk complex

G. L. Card, P. Knowles and N. Q. McDonald



Acta Cryst. (2000). A56 (Supplement), s88

The striking similarity between the bacterial cell division protein FtsA and actin

F. M. I. van den Ent and J. Löwe



Acta Cryst. (2000). A56 (Supplement), s89

Crystallographic dissection of the spliceosomal snRNP structures

K. Nagai, C. Kambach, S. Walke, R. Young, C. Oubridge, S. Price, P. Evans and J. Li



Acta Cryst. (2000). A56 (Supplement), s89

Structural studies of Sm-related proteins from archaea

I. Törõ, C. Mayer, S. Thore, J. Basquin, H. Dreher, M. Dreher, B. Séraphin and D. Suck



Acta Cryst. (2000). A56 (Supplement), s90

Bacterial conjugation machinery

X. Gomis-Rueth, G. Moncalian, A. Guasch, F. de la Cruz and M. Coll



Acta Cryst. (2000). A56 (Supplement), s90

Crystal structure of the E. coli DNA mismatch repair protein MutS in complex with a GT mismatch

M. Lamers, A. Perrakis, J. Enzlin, H. Winterwerp, N. de Wind and T. K. Sixma



Acta Cryst. (2000). A56 (Supplement), s91

Crystal structure of the S15-rRNA complex at 2.8  Å resolution

A. Nikulin, A. Serganov, E. Ennifar, S. Tishchenko, N. Nevskaya, W. Shepard, C. Portier, M. Garber, B. Ehresmann, C. Ehresmann, S. Nikonov and P. Dumas



Acta Cryst. (2000). A56 (Supplement), s92

Recent Advances in Metalloprotein Crystallography

A. Messerschmidt



Acta Cryst. (2000). A56 (Supplement), s92

A Novel Type of Catalytic Copper Cluster in Nitrous Oxide Reductase

K. Brown, M. Tegoni, M. Prudêncio, A. Pereira, S. Besson, J. Moura, I. Moura and C. Cambillau



Acta Cryst. (2000). A56 (Supplement), s93

Dioxygen reduction in strict anaerobes. Crystal structure of rubredoxin: oxygen oxidoredutase (ROO) from Desulfovibrio gigas

C. Frazão, G. Silva, C. M. Gomes, P. Matias, R. Coelho, L. Sieker, S. Macedo, M. Y. Liu, S. Oliveira, M. Teixeira, A. V. Xavier, C. Rodrigues-Pousada, M. A. Carrondo and J. Le Gall



Acta Cryst. (2000). A56 (Supplement), s93

Zinc ion mediated amino acid recognition by threonyl-tRNA synthetase

R. Sankaranarayanan, A.-C. Dock Bregeon, B. Rees, M. Bovee, J. Caillet, P. Romby, C. Francklyn and D. Moras



Acta Cryst. (2000). A56 (Supplement), s94

Structure of the reduced form of the Iron-only Hydrogenase from Desulfovibrio desulfuricans ATCC 7757

Y. Nicolet, X. Vernede, C. E. Hatchikian and J. C. Fontecilla-Camps



Acta Cryst. (2000). A56 (Supplement), s95

Protein Crystallography and Structure Based Drug Design

L. N. Johnson, M. E. M. Noble, J. A. Endicott, K. A. Watson and N. G. Oikonomakos



Acta Cryst. (2000). A56 (Supplement), s95

Dihydropyrimidine dehydrogenase - a target for improved cancer therapy

G. Schneider



Acta Cryst. (2000). A56 (Supplement), s96

Design of Inhibitors of the Hepatitis C Virus Serine Protease: Modelling and Experimental Results

U. Koch, C. Gardelli, F. Narjes, V. G. Matassa and C. Steinkühler



Acta Cryst. (2000). A56 (Supplement), s96

Towards understanding bacterial virulence:The first crystal structure of a Legionella protein

R. Hilgenfeld, A. Vogel, J. Hacker, R. Köhler, G. Fischer, B. König and A. Riboldi-Tunnicliffe



Acta Cryst. (2000). A56 (Supplement), s97

X-ray structures of complexes of SH2-Grb2 domain with high affinity inhibitors

P. Nioche, W. Q. Liu, I. Broutin, M. Vidal, C. Garbay and A. Ducruix



Acta Cryst. (2000). A56 (Supplement), s98

Structural Plasticity in the major capsid protein VP6 of rotaviruses revealed by combined X-ray crystallography and electron cryo-microscopy analyses

M. Mathieu, I. Petipas, J. Lepault, I. Erk, J. Navaza, V. Prasad, J. Cohen and F. A. Rey



Acta Cryst. (2000). A56 (Supplement), s98

Self recognition in the immune system: structure of a Natural Killer receptor bound to its MHC class I ligand

J. Tormo, K. Natarajan, D. H. Margulies and R. A. Mariuzza



Acta Cryst. (2000). A56 (Supplement), s99

The architecture and function of the polymerase of a dsRNA virus

J. M. Grimes, S. Butcher, E. Makeyev, D. Bamford and D. I. Stuart



Acta Cryst. (2000). A56 (Supplement), s99

[beta]2-Glycoprotein I, a protein and membrane-adhesion molecule in human plasma

P. Gros, B. Bouma, Ph. G. de Groot and J. Kroon



Acta Cryst. (2000). A56 (Supplement), s100

Structural studies of influenza virus neutralization by antibodies

M. Knossow, C. Barbey-Martin, B. Gigant, T. Bizebard and J. J. Skehel



Acta Cryst. (2000). A56 (Supplement), s101

Novel types of interactions of the small GTPase Ran with its effectors

I. R. Vetter, C. Nowak, T. Nishimoto, J. Kuhlmann, A. Arndt, U. Kutay, D. Görlich and A. Wittinghofer



Acta Cryst. (2000). A56 (Supplement), s101

Socialize your proteins and make them happy! - Coexpression as a tool to improve and study protein behaviour

C. Kambach



Acta Cryst. (2000). A56 (Supplement), s102

Molecular recognition in the action of protein kinases: the basis for affinity and specificity

M. Noble, S. Arold, N. Brown, I. Campbell, J. A. Endicott, J. Gruber, L. Johnson, J. Ladbury, J. Tucker and T. Ulmer



Acta Cryst. (2000). A56 (Supplement), s102

Structure of Human TRAIL and its complex with a receptor

M.-S. Kim



Acta Cryst. (2000). A56 (Supplement), s103

The BMP-2:BMP receptor IA complex: structural evidence for type I/type II receptor discrimination

T. Kirsch, J. Nickel, W. Sebald and M. Dreyer



Acta Cryst. (2000). A56 (Supplement), s104

Benefits of high quality data and how this can be achieved

C. Nave



Acta Cryst. (2000). A56 (Supplement), s104

Choices in Data collection and Processing

P. R. Evans



Acta Cryst. (2000). A56 (Supplement), s105

Global Indicators of X-ray Data Quality

M. S. Weiss and R. Hilgenfeld



Acta Cryst. (2000). A56 (Supplement), s105

Macromolecular Structure Determination by MAD and OAS

S. M. McSweeney



Acta Cryst. (2000). A56 (Supplement), s106

A direct comparison of data collections from current 'state of the art' difractometers

S. Coles, S. Parsons, M. Thornton-Pett and S. Teat



Acta Cryst. (2000). A56 (Supplement), s107

An Automated Structure Determination System Incorporating SHARP, ARP/wARP and BUSTER/TNT

E. Blanc, C. Vonrhein, P. Roversi and G. Bricogne



Acta Cryst. (2000). A56 (Supplement), s107

Phasing by Three-Beam Diffraction. Present State and Future Prospects

E. Weckert, R. Müller and J. Zellner



Acta Cryst. (2000). A56 (Supplement), s108

Density constraints and direct phasing

A. Urzhumtsev, V. Y. Lunin and N. Lunina



Acta Cryst. (2000). A56 (Supplement), s108

Determining the Structure of a Metalloproteinase at Atomic Resolution

K. E. McAuley, J.-X. Yao, E. J. Dodson, K. S. Wilson and M. M. Woolfson



Acta Cryst. (2000). A56 (Supplement), s109

Constraining and Restraining Parameters for Protein Phasing at Very Low Resolution

K. M. Andersson and C. J. Gilmore



Acta Cryst. (2000). A56 (Supplement), s110

Structural systematics in molecular inorganic chemistry

A. G. Orpen



Acta Cryst. (2000). A56 (Supplement), s110

Recognition of spatial motifs in protein structures

D. Madsen and G. J. Kleywegt



Acta Cryst. (2000). A56 (Supplement), s111

Predicting function from protein structure comparison

R. B. Russell



Acta Cryst. (2000). A56 (Supplement), s111

Systematics of Aromatic Hydrogen Bonds in Proteins

T. Steiner and G. Koellner



Acta Cryst. (2000). A56 (Supplement), s112

The method for comparing crystal structures by means of the graph theory

V. A. Blatov



Acta Cryst. (2000). A56 (Supplement), s113

Protein Crystals: Growth Dynamics, Impurity Incorporation and Imperfections

A. A. Chernov and B. R. Thomas



Acta Cryst. (2000). A56 (Supplement), s113

Nucleation of protein crystals: structures, dynamics, and control pathways

P. G. Vekilov, O. Galkin and S.-T. Yau



Acta Cryst. (2000). A56 (Supplement), s114

On the growth of macromolecular crystals in gels

J. M. García-Ruiz



Acta Cryst. (2000). A56 (Supplement), s114

The Crystallization of BPTI at acidic pH: a Decamer Story

C. Hamiaux, J. Pérez, T. Prangé, M. Riès-Kautt, S. Veesler and P. Vachette



Acta Cryst. (2000). A56 (Supplement), s115

Surface Processes and Growth Kinetics in the Crystallization of Virus and Protein Crystals

A. J. Malkin, Yu. G. Kuznetsov and A. McPherson



Acta Cryst. (2000). A56 (Supplement), s116

Hydrogen Bonding in the Last Quarter of the Century: New Methods, New Results, New Ideas

G. Gilli and Th. Steiner



Acta Cryst. (2000). A56 (Supplement), s116

Energetic properties of the hydrogen bond interaction: a straight representation in terms of the electron density distribution

E. Espinosa, E. Molins and C. Lecomte



Acta Cryst. (2000). A56 (Supplement), s117

The Attractive H[equivalent to]H Interaction: A New Type of Hydrogen Bond

T. F. Koetzle



Acta Cryst. (2000). A56 (Supplement), s117

Interanionic O-H...O Interactions: the Charge Density Point of View

P. Macchi, B. B. Iversen, A. Sironi, B. C. Chakoumakos and F. K. Larsen



Acta Cryst. (2000). A56 (Supplement), s118

Structure and Properties of Alkyloxamides

K. Clou, B. Rousseau, H. O. Desseyn and A. T. H. Lenstra



Acta Cryst. (2000). A56 (Supplement), s119

Structure and Reactivity of Supramolecular Compounds: Mise en Scene

L. R. Nassimbeni and E. Weber



Acta Cryst. (2000). A56 (Supplement), s119

Effect of pressure on the intramolecular reactions in solid coordination compounds

E. V. Boldyreva



Acta Cryst. (2000). A56 (Supplement), s120

Dynamic Aspect of Lattice Inclusion Complexation Involving Phase Change

Y. Aoyama



Acta Cryst. (2000). A56 (Supplement), s120

A Study of Molecular Motions in a Cyclic Hexanuclear Nickel Thiolate by NMR and X-ray Diffraction Techniques

A. H. Mahmoudkhani and V. Langer



Acta Cryst. (2000). A56 (Supplement), s121

Reaction Pathways by Structure Correlation Methods: SN1 Addition of Nucleophilic Ligands to Penta-coordinated V(IV) Oxo-Complexes

V. Ferretti, V. Bertolasi, P. Gilli and G. Gilli



Acta Cryst. (2000). A56 (Supplement), s122

Crystal Engineering of Metalloporphyrin Molecular Sieves and Zeolite Analogues

I. Goldberg



Acta Cryst. (2000). A56 (Supplement), s122

Crystal Engineering Low Symmetry Structures

P. D. Prince, G. S. McGrady and J. W. Steed



Acta Cryst. (2000). A56 (Supplement), s123

Weak interactions in oxazolidine derivatives

J. F. Gallagher



Acta Cryst. (2000). A56 (Supplement), s123

Crystal structures and intermolecular interactions in new fullerene derivatives

I. S. Neretin, K. D. Lyssenko and Yu. L. Slovokhotov



Acta Cryst. (2000). A56 (Supplement), s124

Structure of Copper(II), Cobalt(II) and Zinc(II) Complexes with o-Phthalic Acid

Yu. A. Simonov, M. Gdaniec, P. N. Bourosh, I. Filipova, N. V. Gerbeleu, S. G. Baca and G. A. Timco



Acta Cryst. (2000). A56 (Supplement), s125

Multistabilities, Metastabilities, Phase Transformations and Chemical Reactions in Molecular Solids - an overview

T. Luty



Acta Cryst. (2000). A56 (Supplement), s125

Solid state polymerization reactions leading to biomaterials

M. Epple, O. Herzberg, K. Schwarz and M. Siedler



Acta Cryst. (2000). A56 (Supplement), s126

Molecular Packing and Photoluminescence Efficiency in Thiophene-Based Oligomers

G. Barbarella, L. Favaretto, G. Sotgiu, M. Zambianchi, L. Antolini, E. Tedesco, G. Gigli and R. Cingolani



Acta Cryst. (2000). A56 (Supplement), s126

Methyl and ammonia rotation in molecular crystals

P. Schiebel



Acta Cryst. (2000). A56 (Supplement), s127

Investigation of molecular magnetism by high resolution X-ray diffraction: application to several organic and organometallic compounds

S. Pillet, M. Souhassou, C. Lecomte, Y. Pontillon, C. Mathonière, P. Rabu and C. Massobrio



Acta Cryst. (2000). A56 (Supplement), s128

Forces, Frustration and Fun - A View on the Dimensions of the Packing Problem

P. Erk



Acta Cryst. (2000). A56 (Supplement), s128

Achievements and challenges in molecular crystal structure prediction

F. J. J. Leusen and M. A. Neumann



Acta Cryst. (2000). A56 (Supplement), s129

Crystal Structure Predictions, and Their Use for Solving Crystal Structures from Powder Data

M. U. Schmidt, R. E. Dinnebier and H. Kalkhof



Acta Cryst. (2000). A56 (Supplement), s129

A Knowledge-Based Costfunction for Selection from Low-Energy Crystal Structures in Crystal Structure Prediction

J. P. M. Lommerse



Acta Cryst. (2000). A56 (Supplement), s130

Polymorph Prediction of Long-Chain Compounds

J. van de Streek and P. Verwer



Acta Cryst. (2000). A56 (Supplement), s131

New Aspects of Direct Space Structure Solution from Powder Diffraction Data

K. D. M. Harris, E. Tedesco, R. L. Johnston, G. W. Turner and B. M. Kariuki



Acta Cryst. (2000). A56 (Supplement), s131

Sructure solution from powder data with accidental overlap

J. Rius, X. Torrelles and C. Miravitlles



Acta Cryst. (2000). A56 (Supplement), s132

Potentialities of Grid Search Method

V. V. Chernyshev



Acta Cryst. (2000). A56 (Supplement), s132

Direct space method and high-resolution X-ray powder diffraction: a modern approach to pharmaceutical crystal structure determination

J. Giovannini, M.-A. Perrin, D. Louër and F. Leveiller



Acta Cryst. (2000). A56 (Supplement), s133

Monte Carlo techniques in EXPO

A. Altomare, M. C. Burla, C. Giacovazzo, A. Guagliardi, A. G. G. Moliterni, G. Polidori and R. Rizzi



Acta Cryst. (2000). A56 (Supplement), s134

Investigating Nanocrystalline Materials with Diffraction Line Profile Analysis

D. Louër



Acta Cryst. (2000). A56 (Supplement), s134

Investigation of mesoscale microstructures with diffraction techniques

P. Klimanek



Acta Cryst. (2000). A56 (Supplement), s135

Evidence from HRTEM Image Processing Analysis of Nanocrystalline Iron-Titanium Oxide Powders

A. M. Tonejc, I. Djerdj and A. Tonejc



Acta Cryst. (2000). A56 (Supplement), s135

Residual Stress Analysis of Thin Films

J.-D. Kamminga, M. Leoni, L. J. Seijbel, U. Welzel, P. Lamparter and E. J. Mittemeijer



Acta Cryst. (2000). A56 (Supplement), s136

Grazing excidence diffraction versus grazing incidence diffraction for strain/stress evaluation in thin films

A. Njah, T. Wieder and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s137

On the correlation of optical constants with the crystal structure

R. X. Fischer and R. D. Shannon



Acta Cryst. (2000). A56 (Supplement), s137

Phase transitions in minerals: Correlation of spectroscopic and diffraction data

E. Libowitzky



Acta Cryst. (2000). A56 (Supplement), s138

Crystal-chemistry of the Si-P replacement in minerals

F. Brunet, C. Chopin, G. Chazot and R. Miletich



Acta Cryst. (2000). A56 (Supplement), s138

Harmonic and anharmonic aspects of the dynamics of silica polymorphs at extreme temperatures

E. Bourova, S. C. Parker and P. Richet



Acta Cryst. (2000). A56 (Supplement), s139

Pentaborates and hexaborates crystal chemistry on the base of OD-theory

E. L. Belokoneva, T. A. Korchemkina and O. V. Dimitrova



Acta Cryst. (2000). A56 (Supplement), s140

Ab Initio Simulations as a Tool in Mineral Crystallography

M. Catti



Acta Cryst. (2000). A56 (Supplement), s140

Atomistic modelling of the structure and reactivity of mineral surfaces

S. C. Parker, N. H. deLeeuw, D. J. Cooke and S. E. Redfern



Acta Cryst. (2000). A56 (Supplement), s141

First principles elasticity of major silicate and oxide phases of the lower mantle and geophysical implications

B. B. Karki



Acta Cryst. (2000). A56 (Supplement), s141

Electronic structure and electric field gradient calculations of Al2SiO5 polymorphs

P. Blaha, M. Iglesias, K. Schwarz and D. Baldomir



Acta Cryst. (2000). A56 (Supplement), s142

Simulating Phase Transitions and Thermoelasticity of Mantle Minerals

A. R. Oganov, J. P. Brodholt and G. D. Price



Acta Cryst. (2000). A56 (Supplement), s143

Crystal engineering of organic-inorganic materials for quadratic nonlinear optics

R. Masse



Acta Cryst. (2000). A56 (Supplement), s143

Photorefractivity of Sn2P2S6

S. Odoulov, A. Shume-lyuk, S. Pavlyuk and D. Barilov



Acta Cryst. (2000). A56 (Supplement), s144

Micro-structured ferroelectrics for advanced optical applications

F. Laurell, V. Pasiskevicius, H. Karlsson, R. Clemens, J. Hellström and S. Wang



Acta Cryst. (2000). A56 (Supplement), s144

PSEUDO - a program for a pseudosymmetry search

E. Kroumova, M. I. Aroyo, J. M. Pérez-Mato, J. M. Igartua and S. Ivantchev



Acta Cryst. (2000). A56 (Supplement), s145

Computational simulations of novel a-site substituted perovskites

V. L. Jennings and P. A. Thomas



Acta Cryst. (2000). A56 (Supplement), s146

The crystallography of perovskites: past, present and future

P. G. Radaelli



Acta Cryst. (2000). A56 (Supplement), s146

Perovskites as ionic conductors

S. García-Martín, A. Morata, E. Morán and M. A. Alario-Franco



Acta Cryst. (2000). A56 (Supplement), s147

Structures and phase transitions of Elpasolite type perovskites - Any connections with relaxor compounds?

Ph. Sciau and M. Bonin



Acta Cryst. (2000). A56 (Supplement), s147

Evidence of Charge Transfer in YBa2Fe3O8 from a Bond Valence Analysis of the Structure

I. Natali, A. Santoro and Q. Huang



Acta Cryst. (2000). A56 (Supplement), s148

Structure transformations in fluorinated complex copper oxides

A. M. Abakumov, M. G. Rozova, B. Ph. Pavlyuk, R. V. Shpanchenko, E. V. Antipov, J. Hadermann, O. I. Lebedev and G. Van Tendeloo



Acta Cryst. (2000). A56 (Supplement), s149

In-situ studies of hydrothermal synthesis of microporous materials

P. Norby



Acta Cryst. (2000). A56 (Supplement), s149

The Influence of Fluoride Ions on the Structure, Symmetry and Thermal Properties of Siliceous Zeolites

R. E. Morris



Acta Cryst. (2000). A56 (Supplement), s150

Structure Solution of the Highly Disordered Layer Silicate H-RUB-18

M. Borowski, H. Gies and B. Marler



Acta Cryst. (2000). A56 (Supplement), s150

Structures of the K+ and NH4+ Forms of Linde J

R. W. Broach and R. M. Kirchner



Acta Cryst. (2000). A56 (Supplement), s151

Determination of preferential substitution sites in Fe-silicalite catalysts: a synchrotron radiation diffraction study

D. Viterbo, M. Milanesio, C. Lamberti, R. Aiello, F. Testa and G. L. Marra



Acta Cryst. (2000). A56 (Supplement), s152

Symmetry relations between twin domains and experimental methods of their determination

H. Klapper, Ch. Scherf, Th. Hahn, G. Heger and N. R. Ivanov



Acta Cryst. (2000). A56 (Supplement), s152

Anomalous structure states in real ferroic crystals

I. M. Shmytko



Acta Cryst. (2000). A56 (Supplement), s153

Twinning by syngonic, metric and selective merohedry, and their effect on the diffraction pattern

M. Nespolo and G. Ferraris



Acta Cryst. (2000). A56 (Supplement), s153

Tensor Calculus of Twinning

V. Kopský



Acta Cryst. (2000). A56 (Supplement), s154

Crystal growth and properties of K3Nb3B2O12 single crystals and their solid solutions

E. P. Kharitonova, V. I. Voronkova and V. K. Yanovskii



Acta Cryst. (2000). A56 (Supplement), s155

Structural aspects of low-dimensional magnetic and electronic crystals

S. van Smaalen and J. Lüdecke



Acta Cryst. (2000). A56 (Supplement), s155

The field induced soliton lattice in CuGeO

H. M. Rønnow, M. Enderle, D. F. McMorrow and L.-P. Regnault



Acta Cryst. (2000). A56 (Supplement), s156

X-ray diffraction studies on charge-density-wave deformation by carrier injection in the quasi-one-dimensional compound NbSe3

H. Requardt, F. Ya. Nad, D. Rideau, P. Monceau, R. Currat, J. E. Lorenzo, D. Smilgies and G. Grübel



Acta Cryst. (2000). A56 (Supplement), s156

Anomalous diffraction study of quasi-1D compound (TaSe4)2I

V. Favre-Nicolin, S. Bos, E. Lorenzo, J.-F. Berar, J.-L. Hodeau and R. Currat



Acta Cryst. (2000). A56 (Supplement), s157

Structure-conductivity correlations in monoclinic bronze phases HxMoO3

S. Adams



Acta Cryst. (2000). A56 (Supplement), s158

Strain and Residual Stress Analysis on Technical Components using X-rays, Synchrotron X-Rays and Neutrons

A. Pyzalla



Acta Cryst. (2000). A56 (Supplement), s158

Ceramic Compounds obtained from Common Minerals

X. Turrillas



Acta Cryst. (2000). A56 (Supplement), s159

Tricalcium Silicate Ca3SiO5: the major compound of anhydrous Portland cement revisited

M. N. de Noirfontaine, M. Courtial, F. Dunstetter, G. Gasecki and M. Signes Frehel



Acta Cryst. (2000). A56 (Supplement), s160

Polymorphs of paracetamol - theoretical investigations on an over-the-counter drug

T. Beyer and S. L. Price



Acta Cryst. (2000). A56 (Supplement), s161

Low-dimensional conducting forms of carbon

L. Forró



Acta Cryst. (2000). A56 (Supplement), s161

Structural modification of fullerenes and carbon nanotubes by high pressure treatment

B. Sundqvist



Acta Cryst. (2000). A56 (Supplement), s162

Structural characterization of carbon nanotubes

Ph. Lambin



Acta Cryst. (2000). A56 (Supplement), s162

Crystal structure and properties of a sodium peroxide based graphite intercalation compound

C. Hérold, A. Hérold and P. Lagrange



Acta Cryst. (2000). A56 (Supplement), s163

Single-crystal study of the polymer layer stacking in the high-pressure two-dimensional C60 polymers

R. Moret, P. Launois, T. Wågberg and B. Sundqvist



Acta Cryst. (2000). A56 (Supplement), s164

Current Trends in Surface Crystallography

R. Feidenhans`l



Acta Cryst. (2000). A56 (Supplement), s164

The transition from a metal to an oxide surface on atomic scale

H. Over, Y. D. Kim, S. Wendt, E. Lundgren, M. Schmid, P. Varga, M. Wiklund, J. N. Andersen, A. P. Seitsonen and G. Ertl



Acta Cryst. (2000). A56 (Supplement), s165

Real-time in situ study of the morphology of growing metal/oxide interfaces by small-angle grazing incidence synchrotron X-ray scattering

G. Renaud, A. Barbier, M. Noblet, Y. Borenstzein, R. Lazzari, J. Jupille and C. R. Henry



Acta Cryst. (2000). A56 (Supplement), s165

Surface magnetization of single-crystal FeNi3

V. N. Petrov, M. S. Galaktionov, K. N. Komlev, F. Schedin and G. Thornton



Acta Cryst. (2000). A56 (Supplement), s166

Unusual multilayer Al3Li(100) surface alloy

A. Mikkelsen, J. H. Petersen and D. L. Adams



Acta Cryst. (2000). A56 (Supplement), s167

From 2D to 3D oxides: Layered Double Hydroxides

V. Rives



Acta Cryst. (2000). A56 (Supplement), s167

Potential of industrial development of products based on high temperature superconducting materials

M. Decroux and L. Antognazza



Acta Cryst. (2000). A56 (Supplement), s168

The lithium layered oxides: from an intercalation reaction to a lithium-ion battery

C. Delmas



Acta Cryst. (2000). A56 (Supplement), s168

Crystal packing of intercalated layered structures

P. Capková and H. Schenk



Acta Cryst. (2000). A56 (Supplement), s169

Structural and thermal properties of carboxylates protecting metals against aqueous corrosion

F. Lacouture, J. Peultier, M. François and J. Steinmetz



Acta Cryst. (2000). A56 (Supplement), s170

Diffuse scattering in quasicrystals

M. de Boissieu, A. Létoublon and M. Boudard



Acta Cryst. (2000). A56 (Supplement), s170

Diffuse Scattering Studies at Beamline F1, HASYLAB/DESY: Recent Developments and Applications

C. Paulmann and U. Bismayer



Acta Cryst. (2000). A56 (Supplement), s171

Modulations and Disorder in a Perhydrotriphenylene Inclusion Compound

Th. Weber and H. B. Bürgi



Acta Cryst. (2000). A56 (Supplement), s171

Diffuse X-ray Scattering and Strain Effects in Disordered Crystals

T. R. Welberry



Acta Cryst. (2000). A56 (Supplement), s172

Diffuse scattering of the plastic phase of solid Oxygen: from experiments to molecular dynamics

O. B. M. Hardouin Duparc, F. Dunstetter, C. Clément and O. Condat



Acta Cryst. (2000). A56 (Supplement), s173

Teaching Crystallography to Reluctant Physicists

A. M. Glazer



Acta Cryst. (2000). A56 (Supplement), s173

Electron Crystallography - Teaching and Imagination

U. Kolb



Acta Cryst. (2000). A56 (Supplement), s174

Integrating biocrystallography into traditional biology and chemistry curricula

M. Jaskolski



Acta Cryst. (2000). A56 (Supplement), s174

Training in Laboratories as a Part of Teaching Crystal Growth for Students-Crystallographers

N. I. Leonyuk



Acta Cryst. (2000). A56 (Supplement), s175

X-ray Diffraction Analysis: From High School Through Graduate School: A Powerful Tool for Understanding Molecular Structure and Bonding

A. D. Hunter and S. J. DiMuzio



Acta Cryst. (2000). A56 (Supplement), s176

Invariants of Automorphisms of the d-Dimensional Tori as a Criterion of Commensurability and Incommensurability of Crystal Structures

J. Warczewski and P. Gusin



Acta Cryst. (2000). A56 (Supplement), s176

Magnetic Modulated Structures in Terms of the Language of the Fibre Bundles

P. Gusin and J. Warczewski



Acta Cryst. (2000). A56 (Supplement), s177

Quininium (R)-mandelate, an incommensurately modulated structure in superspace

A. Schönleber and G. Chapuis



Acta Cryst. (2000). A56 (Supplement), s177

The crystal structure of the tetragonal approximant Mn3Ga5

M. Boström



Acta Cryst. (2000). A56 (Supplement), s178

Analysis of the Weissenberg diffraction images from Bi2212, using Fuji imaging plate and Synchrotron X-ray

T. J. Lee, T. S. Khor, W. Chen, L. Yang, Z. H. Wan and H. F. Fang



Acta Cryst. (2000). A56 (Supplement), s178

Ab initio study of incommensurately modulated crystals

R. Caracas and X. Gonze



Acta Cryst. (2000). A56 (Supplement), s179

The incommensurate modulated structure of Sr14-xCaxCu24O41 as a function of temperature and composition

C. Bougerol-Chaillout, P. Bordet, J. F. Bérar, C. Darie and S. Pachot



Acta Cryst. (2000). A56 (Supplement), s179

A multidisciplinary approach to the structures and properties of some chalcogenide misfit layered compounds

W. Depmeier



Acta Cryst. (2000). A56 (Supplement), s180

Structure of the octane+urea inclusion compound at 293  K

I. Peral, G. Madariaga and T. Breczewski



Acta Cryst. (2000). A56 (Supplement), s180

Average Lattices of The Quasicrystalline Structures

I. V. Lebedyuk



Acta Cryst. (2000). A56 (Supplement), s181

LiBx - An Incommensurate Composite Structure at Low Temperatures

M. Wörle, R. Nesper and T. Chatterji



Acta Cryst. (2000). A56 (Supplement), s181

New incommensurate misfit layer oxides in the system (Bi, Ca, Co, O)

S. Lambert, H. Leligny and D. Grebille



Acta Cryst. (2000). A56 (Supplement), s182

Crystal structure of [Li(L-proH)(H2O)]Cl - a high resolution study

M. Lutz and A. L. Spek



Acta Cryst. (2000). A56 (Supplement), s182

Changes in structure and electron distribution between the high and low temperature phase of V6O13

J. Höwing, T. Gustafsson and J. O. Thomas



Acta Cryst. (2000). A56 (Supplement), s183

Xylitol and Ribitol: Integrated properties of the charge density

A. Ø. Madsen and S. Larsen



Acta Cryst. (2000). A56 (Supplement), s183

High-resolution charge density studies of the amino acids DL-lysine.HCl, DL-serine and DL-valine

R. Flaig, T. Koritsanszky and P. Luger



Acta Cryst. (2000). A56 (Supplement), s184

Experimental Charge Density of a Trinuclear Mixed-Valence Iron Compound

J. Overgaard, B. B. Iversen, F. K. Larsen, S. P. Palii, G. A. Timco and G. Wu



Acta Cryst. (2000). A56 (Supplement), s184

Topological Analysis of Experimental Charge Densities of Organometallic Carbene Complexes

M. A. Tafipolsky, W. Scherer, K. Öfele and F. J. Kohl



Acta Cryst. (2000). A56 (Supplement), s185

Investigation of low-temperature superstructure and electron density of a'-NaV2O5

S. Geupel, J. Luedecke and S. van Smaalen



Acta Cryst. (2000). A56 (Supplement), s185

Preliminary Results for a Charge Density Study of Estrone

D. Parrish, N. Wu, E. Zhurova and A. A. Pinkerton



Acta Cryst. (2000). A56 (Supplement), s186

Influence of Cation on Molecular and Electronic Structures of Meisenheimer Complexes. Theoretical Topological Analysis of Electron Density Function

O. Ya. Borbulevych, M. Yu. Antipin and O. V. Shishkin



Acta Cryst. (2000). A56 (Supplement), s186

Topological analysis on intermolecular interaction of two ferromagnetic organic radical molecules

J.-J. Lee and Y. Wang



Acta Cryst. (2000). A56 (Supplement), s187

Experimental Charge Density Studies of Polydentate Diazine Ligands

C. Wilson, S. Dahaoui, D. S. Yufit, J. A. K. Howard and L. K. Thompson



Acta Cryst. (2000). A56 (Supplement), s187

LAPW Study of the Existence of Non Nuclear Maxima in the Electron Density

G. K. H. Madsen, P. Blaha, K. Schwarz, O. Sofo and C. Gatti



Acta Cryst. (2000). A56 (Supplement), s188

Fluorine the difficult atom in charge density analysis

H. O. Sørensen and S. Larsen



Acta Cryst. (2000). A56 (Supplement), s188

Ferrimagnetic Ordering in a 'Ferromagnetic' Molecular Magnet

J. A. Stride, B. Gillon, A. Gukasov, J. Larionova and O. Kahn



Acta Cryst. (2000). A56 (Supplement), s189

Contribution to the charge density studies of Cuii-complexes. (II)

J. Kozisek, H. Fuess and N. K. Hansen



Acta Cryst. (2000). A56 (Supplement), s189

Comparison of the Charge Density Distribution in Compounds Containing Elements of Group 15 and 16

D. Leusser and D. Stalke



Acta Cryst. (2000). A56 (Supplement), s190

Determination of atomic domains and coordinations from a procrystal electron density calculation

T. Balic-Zunic



Acta Cryst. (2000). A56 (Supplement), s190

Topological Analysis of the Electron Density Distribution of Two Nickel Complex

I.-J. Hsu, C.-C. Wang and Y. Wang



Acta Cryst. (2000). A56 (Supplement), s191

Charge density and electrostatic potentials in Na10(N3H3V18O44): a joint X-ray diffraction and ab initio-MO study

M.-M. Rohmer, M. Bénard and V. Pichon



Acta Cryst. (2000). A56 (Supplement), s191

Diffraction Studies of the Experimental Charge Density in 1,2-dihydro-1-methyl-2- nitriminopyridine at 90  K

J. Zaleski



Acta Cryst. (2000). A56 (Supplement), s192

Topological properties of the electron density distribution in amino-acid phosphates

W. Maniukiewicz, E. Molins and R. H. Blessing



Acta Cryst. (2000). A56 (Supplement), s192

Electron density analysis of L-histidinium dihydrogen orthophosphate orthophosphoric acid from X-ray and neutron diffraction data

I. Mata, E. Espinosa, W. Maniuckiewicz, E. Molins, S. Veintemillas, A. Cousson, W. Paulus and C. Lecomte



Acta Cryst. (2000). A56 (Supplement), s193

Electron Density Distribution in CaNi2Si2 using Synchrotron X-ray Diffraction and First Principles Calculations

N. K. Hansen, G. Gavoille, R. Welter, B. Malaman, P. Herzig and H.-G. Krane



Acta Cryst. (2000). A56 (Supplement), s193

3D magnetic interactions in copper hydroxinitrate: contribution of accurate electron density study

S. Pillet, M. Souhassou, C. Lecomte, P. Rabu and C. Massobrio



Acta Cryst. (2000). A56 (Supplement), s194

Can we observe the position of protons from high resolution X-ray diffraction in the oxovanadate Na10[N3[subset of]H3V18O44], 30H2O?

N. Claiser, V. Pichon-Pesme, C. Lecomte, M.-M. Rohmer, M. Bénard and T. B. Pedersen



Acta Cryst. (2000). A56 (Supplement), s194

Electrostatic properties of zeolites from charge density modelling: Success after pitfalls?

F. Porcher, E. Aubert, M. Souhassou, Y. Dusausoy and C. Lecomte



Acta Cryst. (2000). A56 (Supplement), s195

Development of Vacuum Camera Imaging Plate method (VCIP) for the measurements of Electron density distribution in metal complexes

K. Tanaka, S. Takagi, Y. Takenaka and V. V. Zhurov



Acta Cryst. (2000). A56 (Supplement), s195

Atomic properties from experimental electron densities: Program Newprop-int

M. Souhassou



Acta Cryst. (2000). A56 (Supplement), s196

MarchingCubeELD - electron density visualization program for small molecules and its application on cyclosporins structures investigation

M. Husák and J. Cejka



Acta Cryst. (2000). A56 (Supplement), s196

Comparing Polymorphs of Crystal Structures of Small Organic Molecules

J. P. M. Lommerse



Acta Cryst. (2000). A56 (Supplement), s197

Bond-valence models for correlations between structure and conductivity of solid electrolytes

St. Adams and J. Swenson



Acta Cryst. (2000). A56 (Supplement), s197

General formalism for phase combination and phase refinement: Mean-Field optimization and Simulated Annealing in reciprocal space

M. Delarue



Acta Cryst. (2000). A56 (Supplement), s198

CALCRYS, a new program in the Tcl/tk based crystallographic package

L. Urzhumtseva and A. Urzhumtsev



Acta Cryst. (2000). A56 (Supplement), s198

Ab initio DFT Calculations on NAD+ and NADP+

N. Muzet, B. Guillot, C. Jelsch and C. Lecomte



Acta Cryst. (2000). A56 (Supplement), s199

Multipolar refinement of aldose reductase at subatomic resolution

B. Guillot, C. Jelsch, N. Muzet, C. Lecomte, E. Howard, B. Chevrier, A. Mitschler, A. Podjarny, A. Cousson, R. Sanishvili and A. Joachimiak



Acta Cryst. (2000). A56 (Supplement), s200

Determination of twinned structure of copper(II) complex with protonated 6-(3-chlorobenzylamino)purine (H+L), [Cu(H+L)2Cl3]Cl.2.5H2O, by KM4-CCD diffractometer

Z. Trávnícek, J. Marek and M. Malon



Acta Cryst. (2000). A56 (Supplement), s200

Predictive abilities of bond valence method: experimental study by neutron diffraction

M. Yu. Avdeev



Acta Cryst. (2000). A56 (Supplement), s201

Maximal Likelihood refinement. It works, but why?

V. Y. Lunin and A. G. Urzhumtsev



Acta Cryst. (2000). A56 (Supplement), s201

Use of collective variables to model anisotropic displacements; implementation in the macromolecular refinement program REFMAC

M. D. Winn, M. Isupov and G. N. Murshudov



Acta Cryst. (2000). A56 (Supplement), s202

Refinement of proteins at subatomic resolution

C. Jelsch, B. Guillot, R. Guillot, C. Lecomte and L. Viry



Acta Cryst. (2000). A56 (Supplement), s203

Influence of ultrasonic vibrations on X-ray fluorescence under dynamical diffraction conditions

S. A. Grigoryan, M. V. Kovalchuk and V. L. Nosik



Acta Cryst. (2000). A56 (Supplement), s203

Polarization Suppression of X-ray Umweg Multiple Waves in Crystals

Y. P. Stetsko, H. J. Juretschke, Y.-S. Huang, C.-H. Chao, Y.-R. Lee, C.-K. Chen, C.-Y. Hung, J.-H. Chin, G.-Y. Lin, Z.-C. Lin and S.-L. Chang



Acta Cryst. (2000). A56 (Supplement), s204

The factors of polarization transformation of X-ray scattering in Laue-case for dislocation crystals

N. M. Olekhnovich and A. V. Pushkarev



Acta Cryst. (2000). A56 (Supplement), s204

Femto-second pulsed Radiation: Comparison between X-ray and electron scattering

P. Daniels, J. Hajdu, R. Neutze, D. van der Spoel, E. Weckert and A. Zuev



Acta Cryst. (2000). A56 (Supplement), s205

Standing wave formed close to rectangular surface grating by the grazing-angle incidence X-rays

P. A. Bezirganyan Jr, A. P. Bezirganyan, S. E. Bezirganyan and H. A. Bezirganyan Jr



Acta Cryst. (2000). A56 (Supplement), s205

High brightness X-ray sources - implementation and benefits

M. Taylor, G. Fraser, N. Loxley, J. Wall, L. Pina, R. Hudec and A. Inneman



Acta Cryst. (2000). A56 (Supplement), s206

Significant improvement in contrast and information value of images of defects in crystals

A. A. Zholudev, V. N. Trushin, Y. V. Chuprunov and A. F. Khokhlov



Acta Cryst. (2000). A56 (Supplement), s206

X-ray dynamical diffraction: the concept of locally plane wave

Y. Epelboin and V. Mocella



Acta Cryst. (2000). A56 (Supplement), s207

Orientation relationships of hematite layers on ceramic substrates investigated by TEM

J. Dehn, V. Buschmann, P. Reynders and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s207

Identification of forbidden reflections from microdiffraction, CBED and LACBED patterns

J. P. Morniroli



Acta Cryst. (2000). A56 (Supplement), s208

Crystal structure of Ti45Se16 Redetermined from Electron Diffraction Data

T. E. Weirich



Acta Cryst. (2000). A56 (Supplement), s208

Electronic Structure CBN / C, Al, Mg, Si - Systems

V. V. Ilyasov



Acta Cryst. (2000). A56 (Supplement), s209

The Electron Crystallography Forum - A new Corner for Electron Crystallographers at the Web

T. E. Weirich, K. Gjønnes, J. Jansen and U. Kolb



Acta Cryst. (2000). A56 (Supplement), s209

Study of morphology of crystals of synthetic mullite

E. G. Iarotskaia, E. V. Polianski and I. P. Hadgy



Acta Cryst. (2000). A56 (Supplement), s210

Structural investigation of MOCVD grown GaSb islands by TEM

H. Kirmse, W. Neumann, L. Müller-Kirsch, U. W. Pohl and D. Bimberg



Acta Cryst. (2000). A56 (Supplement), s210

Nanostructured thin metallic films in the Renaissance Italian pottery

I. Borgia, B. Brunetti, I. Mariani, M. Mellini, A. Sgamellotti and C. Viti



Acta Cryst. (2000). A56 (Supplement), s211

Refining Crystal Structures from Electron Diffraction Data

A. Stewart and C. J. Gilmore



Acta Cryst. (2000). A56 (Supplement), s212

The Pressure Effect of the Bulk Modulus Seen by the Charge Density in InX Compounds

Y. Al-Douri and H. Aourag



Acta Cryst. (2000). A56 (Supplement), s212

Modern High-Pressure Measurements with a CCD Detector System

L. Häming, M. Ruf and E. Hovestreydt



Acta Cryst. (2000). A56 (Supplement), s213

Structural high-pressure evolution of the tetragonal low-pressure polymorph of Mn3O4

R. Miletich and R. J. Angel



Acta Cryst. (2000). A56 (Supplement), s213

Mercury halides under pressure, phase diagrams full of surprises

M. Hostettler, D. Schwarzenbach, M. Bonin and H.-P. Weber



Acta Cryst. (2000). A56 (Supplement), s214

Under Pressure: Hydroxylamine

P. A. McGregor, D. R. Allan, D. J. Francis, W. G. Marshall, S. Parsons and C. R. Pulham



Acta Cryst. (2000). A56 (Supplement), s215

Crystal structure of the triclinic high-pressure polymorph of CaSnOSiO4 malayaite

St. Rath and M. Kunz



Acta Cryst. (2000). A56 (Supplement), s215

Modelling the crystal packing and conformation of [??III(NH3)5NO2]2+2Cl- in a range of pressures

A. V. Dzyabchenko and E. V. Boldyreva



Acta Cryst. (2000). A56 (Supplement), s216

Influence of temperature and pressure on anion ordering in the crystal structures of low dimensional organic conductors

D. Chasseau, D. Le Pevelen, Y. Barrans, L. Ducasse, J. M. Fabre, P. Guionneau and J. Gaultier



Acta Cryst. (2000). A56 (Supplement), s216

X-ray Diffraction and Theoretical Studies of the High-Pressure Behavior of Magnesium Fluoride

J. Haines, J. M. Léger, F. Gorelli, D. D. Klug, J. S. Tse and Z. Q. Li



Acta Cryst. (2000). A56 (Supplement), s217

Features of Zr-Nb alloys structure loaded by spherical converging stress waves

N. I. Taluts, A. V. Dobromyslov and E. A. Kozlov



Acta Cryst. (2000). A56 (Supplement), s217

Equation of state and phase diagram of KNbO3 up to 30  GPa and from 100 to 500  K. A powder X-ray diffraction study

Ph. Pruzan, D. Gourdain, J. C. Chervin, B. Canny and M. Hanfland



Acta Cryst. (2000). A56 (Supplement), s218

Synchrotron data collection of 0.66  Å data for Aldose Reductase, an enzyme of MW = 36  Kdaltons

A. Mitschler, R. Sanishvili, A. Joachimiak, E. Howard, P. Barth, V. Lamour, M. Van Zandt, E. Sibley, D. Moras and A. Podjarny



Acta Cryst. (2000). A56 (Supplement), s218

Wavelength-Modulated Diffraction

H. Iwasaki, T. Koganezawa, Y. Yoshimura and N. Nakamura



Acta Cryst. (2000). A56 (Supplement), s219

Structural Studies by the Debye-Scherrer Camera installed at BL02B2, Spring-8

E. Nishibori, M. Takata, K. Kato, Y. Kubota, Aoyagi, Y. Kuroiwa, S. Ikeda and M. Sakata



Acta Cryst. (2000). A56 (Supplement), s219

A cryo-bench for trapping reaction intermediates in protein crystals

T. Ursby, X. Vernede, P. Charrault, B. Gorges and D. Bourgeois



Acta Cryst. (2000). A56 (Supplement), s220

Temperature Controlled Humidity Chamber for X-ray Diffraction Analysis

D. Beckers, P. Doppler, B. Koppelhuber and G. J. Reiß



Acta Cryst. (2000). A56 (Supplement), s220

A SMART move. The Bruker AXS integrated system for protein data collection

T. Wagner, S. Foundling and C. Bauer



Acta Cryst. (2000). A56 (Supplement), s221

X-ray diffraction between 4  K and 300  K on a four circle diffractometer equipped with a 2D detector

R. Argoud, P. Fertey, P. Bordet and J. Reymann



Acta Cryst. (2000). A56 (Supplement), s221

A New "Open Source" Control-Program for Single Crystal Diffractometry

J. Kopf



Acta Cryst. (2000). A56 (Supplement), s222

New Control Software for the KM6 Six-Circle Kappa Goniometer

M. Meyer, A. Kowalski, D. Kucharczyk, W. A. Paciorek and G. Chapuis



Acta Cryst. (2000). A56 (Supplement), s222

Comparison of optical elements for X-ray powder diffraction analysis in para-focusing and parallel beam geometries

C. A. Reiss



Acta Cryst. (2000). A56 (Supplement), s223

Strategies for Data Collection on a CCD Diffractometer

S. Rühl, M. Bolte and E. Egert



Acta Cryst. (2000). A56 (Supplement), s223

The future powder diffraction station at the swiss synchrotron facility (SLS)

F. Fauth, B. Patterson, B. Schmitt and J. Welte



Acta Cryst. (2000). A56 (Supplement), s224

Instrumentation for X-ray diffraction from crystals under electric fields

P. Allé, R. Guillot, P. Fertey, N. K. Hansen and E. Elkaïm



Acta Cryst. (2000). A56 (Supplement), s224

Retinal polarization sensor

A. M. Benoit, V. Louis and P. Alle



Acta Cryst. (2000). A56 (Supplement), s225

Automatic Weissenberg Data Collection System for Time-Resolved Protein Crystallography

N. Sakabe, K. Sakabe, T. Higashi, N. Igarashi, M. Suzuk, N. Watanabe and K. Sasaki



Acta Cryst. (2000). A56 (Supplement), s225

A new Pixel Detector for X-ray Diffraction

J. F. Berar, B. Caillot, C. Mouget, L. Blanquart, J. C. Clemens and P. Delpierre



Acta Cryst. (2000). A56 (Supplement), s226

X-ray diffraction study of thin film elastic properties in relation with their microstructure

P. Goudeau, P. O. Renault, P. Villain and K. F. Badawi



Acta Cryst. (2000). A56 (Supplement), s226

The effect of nanostucture on the mechanical properties of high strength low alloy steel (HSLA steel)

M. S. Shalaby



Acta Cryst. (2000). A56 (Supplement), s227

Web based software for instrumentation control and data analysis: an application on a single-crystal four circle diffractometer

A. Pifferi, G. Berdini, M. Buzzi, M. Camalli, M. Catricalà, C. Gramaccioni, P. Lazzareschi and R. Spagna



Acta Cryst. (2000). A56 (Supplement), s228

Vapor transport of organic thin films in microgravity and unit gravity

M. Ittu Zugrav, W. E. Carswell, G. B. Haulenbeek and F. C. Wessling



Acta Cryst. (2000). A56 (Supplement), s228

Automated crystallization of polar biomolecules in the metastable regime using microfluidic silicon devices and a variable temperature incubator

R. E. Cachau, J. R. Casas-Finet and A. Sanjoh



Acta Cryst. (2000). A56 (Supplement), s229

Development of a Crystallization Screen for Organic Compounds

C. Keats, K. Prout, D. Watkin, G. Tranter and R. W. Lancaster



Acta Cryst. (2000). A56 (Supplement), s229

Effects of Equilibration Control on Protein Crystallization

T. L. Bray and L. J. DeLucas



Acta Cryst. (2000). A56 (Supplement), s230

Improving crystal quality with a simple new technique for optimization

E. Saridakis and N. E. Chayen



Acta Cryst. (2000). A56 (Supplement), s230

Growth of Aventurine Crystals

I. B. Makhina, A. A. Mar'in and V. Khadzhi



Acta Cryst. (2000). A56 (Supplement), s231

Some Less Usual Ways to Grow Crystals

A. J. Blake, D.-L. Long and A. C. Marr



Acta Cryst. (2000). A56 (Supplement), s231

Microgravity protein crystal growth: a case of a collagen-like polypeptide

A. Zagari, R. Berisio, G. Sorrentino, L. Vitagliano, L. Carotenuto, C. Piccolo and L. Mazzarella



Acta Cryst. (2000). A56 (Supplement), s232

Investigations into the use of Dispersive-Mode Anomalous Scattering in Macromolecular Crystallography

W. Shepard, V. Favre-Nicolin, M.-L. Chesne, C. Abergel, S. Bos, L. Chantalat, R. Kahn, E. Lorenzo, F. Natali, T. Neisius, S. Pascarelli, J. Vicat and J.-L. Hodeau



Acta Cryst. (2000). A56 (Supplement), s232

MAD phasing at long wavelengths

J. Hauschild, G. P. Bourenkov and H. D. Bartunik



Acta Cryst. (2000). A56 (Supplement), s233

Structural characterization of a photoactivable caged hydroxide

A. Bacchi, D. Rogolino, P. Pelagatti, C. Viappiani and S. Abbruzzetti



Acta Cryst. (2000). A56 (Supplement), s234

Application of D.A.N.E.S. studies to highly Absorbing Powdered Samples

S. Bos, H. Renevier, Y. Joly, V. Favre-Nicolin, E. Lorenzo, J. F. Berar, J. L. Hodeau, V. Cajipe, P. Leone, C. Gueho and G. Vaughan



Acta Cryst. (2000). A56 (Supplement), s234

Determination of Resonant Atomic Scattering Factors and observation of DAFS in the Soft X-ray Range using Bragg Diffraction from Multilayers

H. Grimmer, U. Staub, O. Zaharko and H.-Ch. Mertins



Acta Cryst. (2000). A56 (Supplement), s235

Complementarity of Ultra-High Resolution SR X-ray and Neutron Protein Crystallography

J. R. Helliwell



Acta Cryst. (2000). A56 (Supplement), s235

Small-Angle Neutron Scattering and Mossbauer Effect in Austenitic N- and C-containing steels

V. M. Nadutov and V. M. Garamus



Acta Cryst. (2000). A56 (Supplement), s236

Mechanical behaviour of hard [alpha]-keratin fibre nano-structure explored by X-ray diffraction

L. Kreplak, F. Briki and J. Doucet



Acta Cryst. (2000). A56 (Supplement), s236

Investigations on the radiation damage in organic compounds

R. Müller, M. Drakopoulos, S. Ginder, E. Weckert and J. Zellner



Acta Cryst. (2000). A56 (Supplement), s237

The Micro-SAXS Facility at ESRF Beamline ID22 - Monitoring the Process of Bone Growth in Model Biological Systems

M. Drakopoulos, T. J. Wess, A. P. Hammersley, A. Snigirev, I. Snigireva and P. M. Hocking



Acta Cryst. (2000). A56 (Supplement), s238

Crystal structure of methylmalonyl-CoA epimerase: a novel enzymatic function on an ancient metal-binding scaffold

A. A. McCarthy, H. M. Baker, S. C. Shewry, M. L. Patchett and E. N. Baker



Acta Cryst. (2000). A56 (Supplement), s238

Structural basis of sialyl-transferase activity in trypanosomal sialidases

A. Buschiazzo, M. F. Amaya and P. Alzari



Acta Cryst. (2000). A56 (Supplement), s239

Phosphorylation or oxydation level of the phosphate acceptor nucleotide modifies crystal structure of E. coli CMP kinase: correlation with kinetics and site-directed mutagenesis

T. Bertrand, A. M. Gilles and P. Briozzo



Acta Cryst. (2000). A56 (Supplement), s239

Crystallographic studies of gluconate kinase

L. Kraft, G. Schneider and Y. Lindqvist



Acta Cryst. (2000). A56 (Supplement), s240

Structure and mechanism of pteridine reductase 1 from Leishmania

A. Schüttelkopf, D. G. Gourley and W. N. Hunter



Acta Cryst. (2000). A56 (Supplement), s240

Crystal structure of an 'half-and-half' three-fingers chimeric protein

M. H. le Du, A. Ricciardi, M. Khayati, R. Ménez, J. C. Boulain, A. Ménez and F. Ducancel



Acta Cryst. (2000). A56 (Supplement), s241

Systematic 3D-structure determination of enzymes involved in the plant phenylpropanoid pathway

J.-L. Ferrer, J. M. Jez, C. Zubieta, M. E. Bowman and J. P. Noel



Acta Cryst. (2000). A56 (Supplement), s241

Crystallographic Studies of Thioredoxins from Bacillus acidocaldarius

V. Menchise, S. Galdiero, G. De Simone, S. Bartolucci, M. Rossi, C. Pedone and M. Saviano



Acta Cryst. (2000). A56 (Supplement), s242

Crystal Structure of Phospholipase D from Streptomyces antibioticus

A. Suzuki, K. Kakuno, R. Satio, Y. Iwasaki, T. Yamane and T. Yamane



Acta Cryst. (2000). A56 (Supplement), s242

[beta]-Glucosyltranferase: Substrate Binding and metal site

L. Larivière, W. Rüger, P. Freemont and S. Moréra



Acta Cryst. (2000). A56 (Supplement), s243

The structure of SAICAR synthase-substrate complexes at 1  Å resolution

S. V. Antonyuk, V. M. Levdikov, V. V. Barynin, A. I. Grebenko, D. V. Urusova, A. N. Popov, W. R. Melik-Adamyan and V. S. Lamzin



Acta Cryst. (2000). A56 (Supplement), s243

Threonine synthase from Arabidopsis thaliana: 2.2  Å resolution structure and reaction proposal

K. Thomazeau, R. Dumas, G. Curien and V. Biou



Acta Cryst. (2000). A56 (Supplement), s244

Structural analysis of the allosteric transition of Pseudomonas putida catabolic ornithine carbamoyltransferase

B. Clantin, G. Sainz, C. Tricot, V. Stalon and V. Villeret



Acta Cryst. (2000). A56 (Supplement), s244

High-resolution Structure of the Phosphohistidine-containing and Vanadate-inhibited Forms of E. coli Cofactor-dependent Phosphoglycerate Mutase

C. S. Bond, M. F. White and W. N. Hunter



Acta Cryst. (2000). A56 (Supplement), s245

Structural analysis of substrate binding by the glucan synthesizing enzyme amylosucrase

O. Mirza, L. K. Skov, A. Henriksen, G. Potocki De Montalk, R. M. Willemot, M. Remaud-Simeon, P. Sarcabal, P. Monsan and M. Gajhede



Acta Cryst. (2000). A56 (Supplement), s245

Crystal structure of glucosamine-6 phosphate N-acetyltransferase 1: a novel member of the GNAT superfamily

C. Peneff, D. Mengin-Lecreulx and Y. Bourne



Acta Cryst. (2000). A56 (Supplement), s246

Structural studies of HPr-kinases /phosphatases

S. Fieulaine, A. Galinier, S. Poncet, J. Deutscher and S. Nessler



Acta Cryst. (2000). A56 (Supplement), s246

Crystallographic study of the maize cytokinin gluco-side-specific [beta]-glucosidase Zm-p60.1

J. Marek, J. Vévodová, X.-D. Su, J. Zouhar and B. Brzobohatý



Acta Cryst. (2000). A56 (Supplement), s247

Snapshots of Enzyme Activation

R. Bott, G. Ganshaw, M. Soltis, P. Kuhn and M. Knapp



Acta Cryst. (2000). A56 (Supplement), s247

How to degrade sulfated galactans: the structure of [bold kappa]- and [bold iota]-carrageenases

G. Michel, L. Chantalat, E. Fanchon, D. Flament, T. Barbeyron, T. Vernet, B. Henrissat, B. Kloareg and O. Dideberg



Acta Cryst. (2000). A56 (Supplement), s248

Crystal structure of the haloalkane dehalogenase from Sphingomonas paucimobilis UT26

J. Marek, J. Vévodová, I. Kutá-Smatanová, Y. Nagata, L. A. Svensson, J. Newman, M. Takagi and J. Damborsky



Acta Cryst. (2000). A56 (Supplement), s248

Crystal structure of aldehyde reductase from Sporobolomyces salmonicolor

A. Kita, M. Kataoka, K. Tanimizu, H. Kawabata, S. Shimizu and K. Miki



Acta Cryst. (2000). A56 (Supplement), s249

Status Report of the Structure Determination of Baker's Yeast 12S Phosphofructokinase1 R-State

I. Mechin, G. Kopperschläger and W. R. Rypniewskia



Acta Cryst. (2000). A56 (Supplement), s249

Structural studies of the NDP kinase/antiviral nucleotide analogues interaction

P. Meyer, B. Schneider, S. Sarfati, D. Deville-Bonne, M. Veron, B. Canard and J. Janin



Acta Cryst. (2000). A56 (Supplement), s250

Structural characterization of ActVA-orf6, a monooxygenase involved in the biosynthesis of polyketide actinorhodin

A. E. Miele, G. Sciara, S. G. Kendrew, B. Vallone and A. Boffi



Acta Cryst. (2000). A56 (Supplement), s250

Crystal structures of the cellulase Cel48F in complex with inhibitors and substrates give insights into the mechanism of processive cellulases

G. Parsiegla, C. Tardif, C. Reverbel-Leroy, H. Driguez and R. Haser



Acta Cryst. (2000). A56 (Supplement), s251

New insights in the thermolysin crystallogenesis and inhibition

J.-F. Gaucher, M. Selkti, H. Chen, B. Roques, T. Prangé and A. Tomas



Acta Cryst. (2000). A56 (Supplement), s251

Structural studies of inhibiting mechanism E. coli inorganic pyrophosphatase by calcium ions

V. R. Samygina, A. N. Popov, V. S. Lamzin, N. N. Vorobeva, S. A. Kurilova, T. I. Nazarova and S. M. Avaeva



Acta Cryst. (2000). A56 (Supplement), s252

Crystal Structure of Pseudomonas fluorescens 4-hydroxyphenyl-pyruvate dioxygenase involved in the degrading pathway of tyrosine

L. Serre, A. Sailland, D. Sy, P. Boudec, A. Rolland, E. Pebay-Peyroula and C. Cohen-Addad



Acta Cryst. (2000). A56 (Supplement), s252

The structure and function of a proficient enzyme: orotidine 5'-monophosphate decarboxylase

S. Larsen, P. Harris, J. C. Navarro-Poulsen and K. F. Jensen



Acta Cryst. (2000). A56 (Supplement), s253

Channeling of ammonia in glucosamine-6P synthase

A. Teplyakov, G. Obmolova, M.-A. Badet-Denisot and B. Badet



Acta Cryst. (2000). A56 (Supplement), s253

Structure-function relationship in serralysins, probed by site-directed mutagenesis and X-ray crystallography

T. Hege and U. Baumann



Acta Cryst. (2000). A56 (Supplement), s254

Crystallographic study of recombinant TMPK from Mycobacterium tuberculosis, with substrates and inhibitors

I. Li de la Sierra, H. Munier-Lehmann, A. M. Gilles, O. Bârzu and M. Delarue



Acta Cryst. (2000). A56 (Supplement), s254

Cellobiohydrolases and processivity

A. Varrot, S. J. Charnock, M. Schülein, H. Driguez and G. J. Davies



Acta Cryst. (2000). A56 (Supplement), s255

Temperature-controlled crystallographic experiments on acetylcholinesterase

M. Weik, P. Gros, J. Kroon, T. Ursby, D. Bourgeois, R. Ravelli, S. McSweeney, L. Peng, A. Specht, M. Goeldner, G. Kryger, I. Silman and J. Sussman



Acta Cryst. (2000). A56 (Supplement), s255

Crystal Structure of Nitrite Reductase from Rhodobacter sphaeroides

H. Guo, K. Olesen, Y. Xue and L. Sjölin



Acta Cryst. (2000). A56 (Supplement), s256

The Crystal Structure of a Strepmyces sp.Cel12A

A. Shaw, L. Gross, C. Mitchinson and R. Bott



Acta Cryst. (2000). A56 (Supplement), s256

Neutron-Laue and Atomic Resolution X-ray Analysis of the Aspartic Proteinase Endothiapepsin

L. Coates, P. T. Erskine, J. B. Cooper and D. Myles



Acta Cryst. (2000). A56 (Supplement), s257

The Structure of Serotonin N-Acetyltransferase: Illustrating Catalysis by the GCN5-Related N-Acetyltransferase (GNAT) Enzyme Superfamily

F. Dyda, M. A. A. Namboodiri, D. C. Klein and A. B. Hickman



Acta Cryst. (2000). A56 (Supplement), s257

The Structure of 5-Aminolaevulinate Dehydratase (ALAD)

P. T. Erskine, P. M. Shoolingin-Jordan, S. P. Wood, J. B. Cooper and M. J. Warren



Acta Cryst. (2000). A56 (Supplement), s258

De Novo Design and Protein X-ray Analysis of a Protein Kinase Inhibitor

P. Furet, T. Meyer, A. Strauss, S. Raccuglia and J.-M. Rondeau



Acta Cryst. (2000). A56 (Supplement), s258

Dihydroorotate dehydrogenases

S. Nørager, O. Björnberg, K. F. Jensen and S. Larsen



Acta Cryst. (2000). A56 (Supplement), s259

Structural studies of chitinase A from S. marcescens complexed with substrates and the inhibitor allosamidin

Y. Papanikolau, G. Prag, G. Tavlas, M. Papadovasilaki, S. Dimitriou, C. E. Vorgias, A. B. Oppenheim and K. Petratos



Acta Cryst. (2000). A56 (Supplement), s259

The type II Dehydroquinate dehydratase from Bacillus subtilis - an intriguing innactive enzyme

D. A. Robinson, A. W. Roszak, J. R. Coggins and A. J. Lapthorn



Acta Cryst. (2000). A56 (Supplement), s260

Crystal structures of Wild-Type and D30A thioredoxin h from Chlamydomonas reinhardtii enlighten the role of water molecule in catalysis

V. Menchise, C. Corbier, C. Didierjean, M. Saviano, E. Benedetti, J.-P. Jacquot and A. Aubry



Acta Cryst. (2000). A56 (Supplement), s260

Crystal structure of the NAD-dependent erythrose-4-phosphate dehydrogenase from Escherichia coli

B. Kauffmann, D. Cobessi, S. Boschi-Muller, S. Azza, G. Branlant and A. Aubry



Acta Cryst. (2000). A56 (Supplement), s261

The X-ray structure of the ternary complex GAPDH/NAD/G3P enlightens the role of two anion binding sites during the catalysis

M. Fatih, C. Didierjean, C. Corbier, S. Boschi-Muller, G. Branlant and A. Aubry



Acta Cryst. (2000). A56 (Supplement), s261

Cellular detoxification: crystal structure of a repair enzyme from Escherichia coli at 1.9  Å resolution

F. Tête-Favier, D. Cobessi, S. Boschi-Muller, S. Azza, G. Branlant and A. Aubry



Acta Cryst. (2000). A56 (Supplement), s262

Crystallographic and biochemical investigations of the catalytic mechanism of an NADP-dependent aldehyde dehydrogenase from Streptococcus mutans

D. Cobessi, F. Tête-Favier, S. Marchal, G. Branlant and A. Aubry



Acta Cryst. (2000). A56 (Supplement), s262

The structure of heterodimeric imidazole glycerole phosphate synthase (tHisH/tHisF) reveals an substrate transfer channel through a ([alpha]/[beta])8 barrel

M. Walker, S. Beismann-Driemeyer, R. Sterner and M. Wilmanns



Acta Cryst. (2000). A56 (Supplement), s263

Reversible domain motions induced by substrate binding in ribonuclease A

A. Zagari, R. Berisio, A. Merlino, F. Sica, L. Vitagliano and L. Mazzarella



Acta Cryst. (2000). A56 (Supplement), s263

Implication of Tubby Proteins as Transcription Factors by Structure-Based Functional Analysis

T. J. Boggon, W. S. Shan, S. Santagata, S. C. Myers and L. Shapiro



Acta Cryst. (2000). A56 (Supplement), s264

Thiostrepton

M. P. Shaw, C. S. Bond, M. S. Alphey and W. N. Hunter



Acta Cryst. (2000). A56 (Supplement), s265

Portrait of a membrane protein in action: bacterio-rhodopsin pumping protons

K. Edman, P. Nollert, A. Royant, H. Belrhali, E. Pebay-Peyroula, T. Ursby, J. Hajdu, R. Neutze and E. M. Landau



Acta Cryst. (2000). A56 (Supplement), s265

Novel Ion Coordination in Gramicidin, a Membrane Channel

W. L. Duax, B. Burkhart, V. Pletnev, N. Li and W. Pangborn



Acta Cryst. (2000). A56 (Supplement), s266

Over-production, purification and preliminary X-ray crystallographic analysis of GlcV, the ATP-binding cassette of the glucose ABC transport system from Sulfolobus solfataricus

G. Verdon, S. V. Albers, B. W. Dijkstra, A. J. M. Driessen and A.-M. W. H. Thunnissen



Acta Cryst. (2000). A56 (Supplement), s266

Structural evidence for ligand specificity in the binding domain of the human Androgen receptor

P. M. Matias, R. Coelho, M. Thomaz, C. Peixoto, S. Macedo and M. A. Carrondo



Acta Cryst. (2000). A56 (Supplement), s267

Crystal Structure of the First Three Domains of the Type-1 Insulin-like Growth Factor Receptor

T. P. J. Garrett, N. M. McKern, M. Lou, M. J. Frenkel, J. D. Bentley, G. O. Lovrecz, T. C. Elleman, L. J. Cosgrove and C. W. Ward



Acta Cryst. (2000). A56 (Supplement), s267

The 22  kDa endo-specific membrane-bound lytic transglycosylase EmtA

F. I. Gliubich, A. M. W. H. Thunnissen and B. W. Dijkstra



Acta Cryst. (2000). A56 (Supplement), s268

An unusual carbohydrate binding site revealed by the structures of two Maackia amurensis lectins complexed with sialic acid-containing oligosaccharides

J. Lescar, A. Imberty, C. Gautier, R. Loris, L. Wyns and S. Perez



Acta Cryst. (2000). A56 (Supplement), s268

Structural studies of the purple bacterial photosynthetic reaction centre

P. K. Fyfe, J. P. Ridge, K. E. McAuley, A. W. Roszak, R. J. Cogdell, N. W. Isaacs and M. R. Jones



Acta Cryst. (2000). A56 (Supplement), s269

Recognition of Haem by Proteins. Insight from Structural Data Bases (CSD and PDB) Analysis

L. Tchertanov



Acta Cryst. (2000). A56 (Supplement), s269

Crystal structure of [beta]-cinnamomin, a protein elicitor produced by a phytopathogenic fungus

M. Archer, M. L. Rodrigues, M. Aurélio, A. Cravador and M. A. Carrondo



Acta Cryst. (2000). A56 (Supplement), s270

The Crystallization and structure analysis of the dI Component of Transhydrogenase, a Proton-Translocating Membrane Protein

P. A. Buckley, J. B. Jackson, D. W. Rice, S. E. Sedelnikova, J. Burke, T. Shneider, M. Roth and P. J. Baker



Acta Cryst. (2000). A56 (Supplement), s270

Structure of a legume lectin from the bark of Robinia pseudoacacia

A. Rabijns, C. Verboven, E. J. M. Van Damme, W. J. Peumans and C. J. De Ranter



Acta Cryst. (2000). A56 (Supplement), s271

Structural Studies on the Proteins of Myelin

D. J. B. Hunter, D. Kirkham, I. R. Griffiths and A. A. Freer



Acta Cryst. (2000). A56 (Supplement), s271

X-ray structure of the catalytic domain of human complement protease C1s: a trypsin-like domain modulated by a CCP module handle

C. Gaboriaud, V. Rossi, I. Bally, G. Arlaud and J. C. Fontecilla



Acta Cryst. (2000). A56 (Supplement), s272

Towards an atomic structure of intermediate filaments

S. V. Strelkov, H. Herrmann, N. Geisler, R. Zimbelmann, A. Lustig, U. Aebi and P. Burkhard



Acta Cryst. (2000). A56 (Supplement), s272

The crystal structure of the Clostridium thermocellum CelS, the major enzymatic component of the cellulosome

B. G. Guimarães, H. Souchon, J. H. D. Wu and P. M. Alzari



Acta Cryst. (2000). A56 (Supplement), s273

Crystal structures of DNAs damaged by methoxylation reveal the reason why pyrimidine transition and purine transition occur during replication

A. Takénaka, T. Chatake, T. Hikima, T. Hossain, A. Ono, Y. Ueno and A. Matsuda



Acta Cryst. (2000). A56 (Supplement), s273

X-ray analysis of a DNA dodecamer containing 5-formyluracil

M. Tsunoda, N. Karino, Y. Ueno, A. Matsuda and A. Takénaka



Acta Cryst. (2000). A56 (Supplement), s274

Structural studies of the transcription cofactor PC4

S. H. W. Scheres, J. M. H. van den Elsen, M. Meisterernst, J. Kroon and P. Gros



Acta Cryst. (2000). A56 (Supplement), s274

The crystal structure of two UUCG tetraloops

E. Ennifar, A. Nikulin, A. Serganov, M. Garber, C. Ehresmann, S. Nikonov and P. Dumas



Acta Cryst. (2000). A56 (Supplement), s275

The structure of double helical Hexitol Nucleic Acids

R. Declercq and L. Van Meervelt



Acta Cryst. (2000). A56 (Supplement), s276

Three-dimensional structures of the reduced and oxidized forms of cytochrome c3 from Desulfovibrio desulfuricans ATCC 27774  at  pH 7.6

I. Bento, P. M. Matias and M. A. Carrondo



Acta Cryst. (2000). A56 (Supplement), s276

1.5Å high-resolution neutron diffraction results of rubredoxin

K. Kurihara, I. Tanaka, M. W. W. Adams, N. Moiseeva, R. Bau and N. Niimura



Acta Cryst. (2000). A56 (Supplement), s277

Structure of glutamate synthase, a complex iron-sulfur flavoprotein

C. Binda, R. Bossi, S. Wakatsuki, S. Artz, B. Curti, M. A. Vanoni and A. Mattevi



Acta Cryst. (2000). A56 (Supplement), s277

The fate of molybdate inside the cell: Azotobacter vinelandii ModG binding specificity

L. Delarbre, C. E. M. Stevenson, D. J. White, L. A. Mitchenall, R. N. Pau and D. M. Lawson



Acta Cryst. (2000). A56 (Supplement), s278

Ab initio crystal structure of low potentialcytochrome c549 from Synechocistis sp. PCC6803

F. J. Enguita, C. Frazão, R. Coelho, J. Navarro, M. Hervás, M. De la Rosa, G. M. Sheldrick and M. A. Carrondo



Acta Cryst. (2000). A56 (Supplement), s278

Structural analysis of active site mutants of horseradish peroxidase C (HRP C)

K. Meno, O. Mirza, A. Henriksen and M. Gajhede



Acta Cryst. (2000). A56 (Supplement), s279

Structural determination of Bacterioferritin from Desulfovibrio Desulfuricans ATCC 27774

S. Macedo, P. M. Matias, E. Mitchell, A. Coelho, J. Le Gall, P. Lindley and M. A. Carrondo



Acta Cryst. (2000). A56 (Supplement), s279

Crystal structures of photosynthetic reaction center and high-potential iron-sulfur protein from Thermochromatium tepidum

T. Nogi, I. Fathir, M. Kobayashi, T. Nozawa and K. Miki



Acta Cryst. (2000). A56 (Supplement), s280

Magnesium-dependent Serratia marcescens endonuclease: three-dimensional structure at 1.1  Å resolution and molecular mechanism of enzyme action

V. V. Lunin, S. V. Shlyapnikov, M. Perbandt, Ch. Betzel and A. M. Mikhailov



Acta Cryst. (2000). A56 (Supplement), s280

T6 and T3R3 Human Insulin at Atomic Resolution

R. H. Blessing, G. D. Smith and W. A. Pangborn



Acta Cryst. (2000). A56 (Supplement), s281

Crystal Structure of L-Chain Mouse Ferritin at 1.2  Å resolution

T. Granier, J. M. Chevalier, J. M. Mellado, M. Béhuré, B. Gallois, P. Santambrogio, P. Arosio and G. Précigoux



Acta Cryst. (2000). A56 (Supplement), s281

[NiFe] Hydrogenase from Desulfovibrio desulfuricans ATCC 27774: Gene sequencing, three-dimensional structure determination and refinement at1.8 Å and modelling studies of its interaction with the tetra-haem cytochrome c3

P. M. Matias, C. M. Soares, L. M. Saraiva, R. Coelho, J. Morais, J. Le Gall and M. A. Carrondo



Acta Cryst. (2000). A56 (Supplement), s282

Design of Inhibitors of the Hepatitis C Virus Serine Protease: Modelling and Experimental Results

U. Koch, C. Gardelli, F. Narjes, V. G. Matassa and C. Steinkühler



Acta Cryst. (2000). A56 (Supplement), s282

Comprehensive Comparison of the Ergot Alkaloids Family with 5-HT1A Receptor Pharmacophore Models

J. Cejka, B. Kratochvíl and A. Jegorov



Acta Cryst. (2000). A56 (Supplement), s283

The first step of tetanus toxin into nerve cell

C. Fotinou, K. A. Shina, H. Ando, H. Ishida, I. Black, P. Emsley, M. Kiso, N. Fairweather and N. W. Isaacs



Acta Cryst. (2000). A56 (Supplement), s283

Structure-activity relationships in some D-seco estrone derivatives

S. Stankovic, D. Lazar, T. Pilati, S. Jovanovic-Santa, J. Petrovic and R. Kovasevic



Acta Cryst. (2000). A56 (Supplement), s284

The structure of Retro-Diels-Alder catalytic antibody crystals and their evil twins

M. Hugot, J.-L. Reymond and U. Baumann



Acta Cryst. (2000). A56 (Supplement), s284

Structural Investigations of the Major Timothy Grass Pollen Allergen Phl p7

P. Verdino, A. Twardosz, R. Valenta and W. Keller



Acta Cryst. (2000). A56 (Supplement), s285

Structure of the matrix protein of VSV

M. Gaudier, Y. Gaudin and M. Knossow



Acta Cryst. (2000). A56 (Supplement), s285

Crystal structure of two pathogenesis-related proteins of class PR10 from yellow lupine

J. Biesiadka, G. Bujacz, M. Sikorski, M. Jaskolski and A. B. Legocki



Acta Cryst. (2000). A56 (Supplement), s286

Chimeric Human-Simian Anti-CD4 Antibodies Form Crystalline High Symmetry Particles

Y. G. Kuznetsov, J. Day and A. McPherson



Acta Cryst. (2000). A56 (Supplement), s286

The crystal structure of an anti-carbohydrate antibody directed against Vibrio cholerae in complex with antigen

P. M. Alzari, H. Souchon, J. M. Fournier and P. Kovác



Acta Cryst. (2000). A56 (Supplement), s287

The crystal structure of a murine TCR bound to an allogeneic MHC molecule

J. B. Reiser, C. Darnault, A. Guimezanes, C. Grégoire, T. Mosser, A.-M. Schmitt-Verhultz, J. C. Fontecilla-Camps, B. Malissen, D. Housset and G. Mazza



Acta Cryst. (2000). A56 (Supplement), s287

Crystal structure of the human transthyretin-retinol-binding protein complex bound to an anti-RBP Fab

G. Zanotti, V. Calderone, R. Battistutta, F. Gliubich, G. Malpeli, S. K. Nishida, C. Folli and R. Berni



Acta Cryst. (2000). A56 (Supplement), s288

From Immunoglobulin binding proteins to combinatorial crystallization

E. A. Stura, M. Graille, J.-B. Charbonnier, A. L. Corper, B. J. Sutton, M. J. Taussig and G. J. Silverman



Acta Cryst. (2000). A56 (Supplement), s288

Structure and function of heparin binding protein (CAP37)

J. S. Kastrup, A. K. Pedersen, L. F. Iversen, B. B. Stoffer and I. K. Larsen



Acta Cryst. (2000). A56 (Supplement), s289

Structure of the complex between Rac1 and its inhibitor partner RhoGDI at 2.7  Å resolution

S. Grizot, J. Fauré, F. Fieschi, P. Vignais, M.-C. Dagher and E. Pebay-Peyroula



Acta Cryst. (2000). A56 (Supplement), s289

A Redox-Dependent Interaction Between Two Electron-Transfer Partners Intervening In Photosynthesis

R. Morales, G. Kachalova, M.-H. Charon and M. Frey



Acta Cryst. (2000). A56 (Supplement), s290

Functional expression and preliminary X-ray crystallographic study of human Survivin

S. Shin and B.-H. Oh



Acta Cryst. (2000). A56 (Supplement), s290

Structural basis for the activation of the nuclear GTPase Ran by its [beta]-propeller exchange factor RCC1

L. Renault, J. Kuhlmann and A. Wittinghofer



Acta Cryst. (2000). A56 (Supplement), s291

Crystal structure of neuronal Sec1 from the squid Loligo pealei

A. Bracher, A. Perrakis, T. Dresbach, H. Betz and W. Weissenhorn



Acta Cryst. (2000). A56 (Supplement), s291

Domain-swapping dimerization of human cystatin C

M. Jaskolski, R. Janowski, M. Kozak, E. Jankowska, Z. Grzonka, A. Grubb, M. Alvarez Fernandez and M. Abrahamson



Acta Cryst. (2000). A56 (Supplement), s292

Structure of EVH1: a Novel Proline-Rich Ligand Binding Module Involved in Cytoskeletal Dynamics and Neural Function

A. A. Fedorov, E. Fedorov, F. Gertler and S. C. Almo



Acta Cryst. (2000). A56 (Supplement), s292

The BMP-2:BMP receptor IA complex: structural evidence for type I/type II receptor discrimination

T. Kirsch, J. Nickel, W. Sebald and M. Dreyer



Acta Cryst. (2000). A56 (Supplement), s293

Crystallographic Determination of the Free Radical Intermediate of Pyruvate: Ferredoxin Oxidoreductase

E. Chabriere, X. Vernede, M. H. Charon, B. Guigliarelli, E. C. Hatchikian and J. C. Fontecilla-Camps



Acta Cryst. (2000). A56 (Supplement), s293

Crystal structure of an anti-interleukin-2 monoclonal antibody Fab fragment complexed with an antigenic nonapeptide

P. V. Afonin, A. V. Fokin, I. N. Tsygannik, I. Y. Mikhailova and V. Z. Pletnev



Acta Cryst. (2000). A56 (Supplement), s294

Protons in Proteins - New insights from neutron diffraction

D. A. A. Myles and P. A. Timmins



Acta Cryst. (2000). A56 (Supplement), s294

Data Collection and Phasing on One Data Set

B. Schierbeek and F. van Meurs



Acta Cryst. (2000). A56 (Supplement), s295

Recent advances in the Collaborative Computational Project No. 4 for Protein Crystallography

C. Ballard



Acta Cryst. (2000). A56 (Supplement), s295

automar, marFLM, marHKL and marXDS: Data Reduction Software for mar detectors

C. Klein and K. S. Bartels



Acta Cryst. (2000). A56 (Supplement), s296

Towards automated Laue data processing: application to the choice of the optimal X-ray spectrum

D. Bourgeois, U. Wagner and M. Wulff



Acta Cryst. (2000). A56 (Supplement), s296

A New Software for Fine-Slice Data Collection Method for Protein Crystallography

N. H. Xuong, A. Arvai, C. Nielsen and R. Hamlin



Acta Cryst. (2000). A56 (Supplement), s296

Different 'ways' in multiwavelength anomalous dispersion (MAD) data collection

G. Sainz, G. Leonard, V. Stojanoff and A. Thompson



Acta Cryst. (2000). A56 (Supplement), s297

Direct structure solution by a pair-functional method with self-consistent fields

A. D. McLachlan



Acta Cryst. (2000). A56 (Supplement), s297

Diffraction Image Simulations of Single TBSV Particles

A. Zuev, P. Daniels, J. Hajdu, R. Neutze, D. van der Spoel, E. Weckert and R. Wouts



Acta Cryst. (2000). A56 (Supplement), s298

On the significance of an accurate vector-set selection in molecular replacement: a practical example

C. Alvarez-Rúa, J. Borge and S. García-Granda



Acta Cryst. (2000). A56 (Supplement), s298

Vector-search methods revisited in macromolecular crystallography: a new rotation function in Patterson space

J. Borge, C. Alvarez-Rúa and S. García-Granda



Acta Cryst. (2000). A56 (Supplement), s299

Crystallization and structure determination of human low density lipoprotein (LDL) at low resolution, using ab initio phases

S. Ritter, N. L. Lunina, V. Y. Lunin, A. G. Urzhumtsev, A. D. Podjarny, I. Frey, K. Diederichs and M. W. Baumstark



Acta Cryst. (2000). A56 (Supplement), s300

SIR2000: a parallel package

M. C. Burla, M. Camalli, B. Carrozzini, G. L. Cascarano, V. Di Martino, C. Giacovazzo, G. Polidori, D. Siliqi and R. Spagna



Acta Cryst. (2000). A56 (Supplement), s300

SYSTER: a program for the evaluation of systematic errors in reflection data

J. M. M. Smits and R. de Gelder



Acta Cryst. (2000). A56 (Supplement), s301

Flat model bulk solvent correction in the program REFMAC

R. A. Steiner and G. N. Murshudov



Acta Cryst. (2000). A56 (Supplement), s302

Improvement of the Inorganic Crystal Structure Database ICSD

R. Allmann



Acta Cryst. (2000). A56 (Supplement), s302

An Environment for Searching and Mining Multiple Structural Databases

P. S. White, Y. Le Page and J. R. Rodgers



Acta Cryst. (2000). A56 (Supplement), s303

PC Crystal Chemistry Analysis of Organic Crystal Structures

P. N. Oleynikov and P. M. Zorky



Acta Cryst. (2000). A56 (Supplement), s303

Packing Patterns of Oximes

W. D. S. Motherwell, L. C. Kerr and P. R. Raithby



Acta Cryst. (2000). A56 (Supplement), s304

Different ways of establishing crystal structure interrelations: new examples

O. Yakubovich and W. Massa



Acta Cryst. (2000). A56 (Supplement), s304

Detection of Molecular Symmetry in the Cambridge Structural Database

J. W. Yao, J. C. Cole, W. D. S. Motherwell and F. H. Allen



Acta Cryst. (2000). A56 (Supplement), s305

Direct Visualization of an Impurity Depletion Zone

A. A. Chernov, J. M. Garcia-Ruiz and B. R. Thomas



Acta Cryst. (2000). A56 (Supplement), s305

Crystallization screening with electrophoretic gels

J. M. García-Ruiz, A. Hernández-Hernández, J. López-Jaramillo and B. Thomas



Acta Cryst. (2000). A56 (Supplement), s306

Relationships between H-bonding and donor - acceptor bonds in amine-functionalized alkoxides of aluminium and gallium

J. Zachara, J. Lewinski, T. Kopec, J. Lipkowski and E. Kolodziejczyk



Acta Cryst. (2000). A56 (Supplement), s306

Ultra-high resolution structure of a new polymorphic form of bovine pancreatic trypsin inhibitor

A. Addlagatta, H. Czapinska, Sz. Krzywda, J. Otlewski and M. Jaskólski



Acta Cryst. (2000). A56 (Supplement), s307

Hydrogen bond networks of solid cephalosporins - comparison with their biological activity

I. Madura, J. Zachara, A. Zimniak and I. Oszczapowicz



Acta Cryst. (2000). A56 (Supplement), s307

Formation of Highly Crystalline Guanidinium Salts of Sulfonated Phosphines and their Complexes

A. Cs. Bényei, Á. Kathó and F. Joó



Acta Cryst. (2000). A56 (Supplement), s308

Evidence for Intramolecular N-H...O Resonance-Assisted H-Bond in [beta]-Enaminones and Related Heterodienes

P. Gilli, V. Ferretti and V. Bertolasi



Acta Cryst. (2000). A56 (Supplement), s308

The influence of cations on the formation of the intramolecular hydrogen bond in hydrogen phthalates

A. Langkilde and S. Larsen



Acta Cryst. (2000). A56 (Supplement), s309

The role of intra- and intermolecular hydrogen bonding in the crystal structure of arylsulfonylguanidine derivatives

I. Dybala, A. E. Koziol, E. Szacoñ and D. Matosiuk



Acta Cryst. (2000). A56 (Supplement), s309

Inclusion crystals of finasteride

I. Wawrzycka, A. E. Koziol and E. Cendrowska



Acta Cryst. (2000). A56 (Supplement), s310

Hydrogen Bonds in 13-Hydroxylupanine Epimers

I. Wolska and T. Borowiak



Acta Cryst. (2000). A56 (Supplement), s310

Neutron diffraction study of very short OHN hydrogen bonds in phenol - pyridine adduct

I. Majerz, T. Steiner, S. A. Mason and C. C. Wilson



Acta Cryst. (2000). A56 (Supplement), s311

Solid State Investigation of the Polymorphic System of Butethal-5-ethyl-5-N-Butyl Barbituric Acid

O. Navon and J. Bernstein



Acta Cryst. (2000). A56 (Supplement), s311

Synthesis and crystal structure of two acidic selenates: (C6H14N2)(HSeO4)2 and (C6H16N2)(HSeO4)2

M. A. Zakharov, S. I. Troyanov, L. A. Aslanov and E. Kemnitz



Acta Cryst. (2000). A56 (Supplement), s312

Crystal structures of n-octadecylammonium halides

M. Rademeyer, D. G. Billing and G. J. Kruger



Acta Cryst. (2000). A56 (Supplement), s312

Controlled host:guest ratio in inclusion compounds

H. Su and L. R. Nassimbeni



Acta Cryst. (2000). A56 (Supplement), s313

Crystallographic and Thermodynamic Aspects of Cephalosporin Complexation

R. de Gelder, G. J. Kemperman, F. J. Dommerholt, A. J. H. Klunder and B. Zwanenburg



Acta Cryst. (2000). A56 (Supplement), s313

Quasi-racemates, Racemates and Enantiomers of Cobaloximes

C. Hu, R. Härter, I. Kalf and U. Englert



Acta Cryst. (2000). A56 (Supplement), s314

Effect of Tailor-Made Additives on Benzil Crystal Growrth: Real-Time Imaging by Atomic Force Microscopy and Habit Modification Analysis

G. Calabrese and M. Moret



Acta Cryst. (2000). A56 (Supplement), s314

Thermally Induced Solid to Solid Reaction of 2,4-Dinitrophenylhydrazine with Aromatic Aldehydes

Z. Urbanczyk-Lipkowska



Acta Cryst. (2000). A56 (Supplement), s315

An investigation of crystal structures and thermal behaviour of the adducts 2,2'-bipyridine with 2,2'-dihydroxy-1,1'-binapthyl and 4,4'-bipyridine with 2,2'-bis(p-hydroxyphenyl) propane and water

J. Bacsa and L. R. Nassimbeni



Acta Cryst. (2000). A56 (Supplement), s316

Molecular Interactions in the Crystal Structures of 4-(2,4,6-triphenyl-1-pyridinio)phenolate and its Salts

K. Stadnicka and P. Milart



Acta Cryst. (2000). A56 (Supplement), s316

Intermolecular Interactions in the Crystal Structures of Some Diaryl Telluride Antioxidants

L. Engman, I. Kania, A. Kurtyka, B. J. Oleksyn and J. Sliwinski



Acta Cryst. (2000). A56 (Supplement), s317

Structural diversity in octahedral rhenium cyanocluster complexes with M2+ (M = Mn, Co, Ni) cations

S. B. Artemkina, A. V. Virovets, N. G. Naumov and V. E. Fedorov



Acta Cryst. (2000). A56 (Supplement), s317

Development of New Layered Metal Phosphonates as Protective Thin Films: Design, Synthesis, Structure and Properties

A. H. Mahmoudkhani and V. Langer



Acta Cryst. (2000). A56 (Supplement), s318

Supramolecular Chemistry of Calixarenes

A. T. Gubaidullin and I. A. Litvinov



Acta Cryst. (2000). A56 (Supplement), s318

The Structural Studies on Calix[4]arene Ligands and Their Complexes with Anions

M. Cajan, J. Vévodová, I. Stibor, P. Lhoták and J. Koca



Acta Cryst. (2000). A56 (Supplement), s319

Molecular Packing Analysis of Molecular Complexes of N,N-Dimethylaniline

T. Dahl



Acta Cryst. (2000). A56 (Supplement), s319

Modification of Roothaan equations for the ab-initio calculation of Interactions in Large Molecular Systems in the absence of Basis Set Superposition Error

M. Sironi, A. Famulari, F. Moroni and M. Raimondi



Acta Cryst. (2000). A56 (Supplement), s320

A Novel Thiophosphorylated Cavitand and its Complex with Silver Picrate

B. Tinant, J.-P. Declercq, B. Bibal and J.-P. Dutasta



Acta Cryst. (2000). A56 (Supplement), s320

Derivatives of 5-Morpholine-2-phenyl-3-pyridazinone

A. Katrusiak, S. Baloniak and A. Katrusiak



Acta Cryst. (2000). A56 (Supplement), s321

Enantioselectivity in Clathrates. A Ternary Crystal of a Wheel-and-Axle Host with two Guests: All Three Molecules Disordered

P. Bombicz, I. Csöregh, M. Czugler, A. Kálmán and E. Weber



Acta Cryst. (2000). A56 (Supplement), s321

Structure of a Calix[4]arene by X-ray diffraction

L. A. González-Ramírez, F. Santoyo-González, J. D. Martín-Ramos, J. López-Jaramillo and J. M. García-Ruiz



Acta Cryst. (2000). A56 (Supplement), s322

The Structure of a Novel Macrocyclic Organotellurate(IV)

H. Citeau, K. Kirschbaum, O. Conrad and D. M. Giolando



Acta Cryst. (2000). A56 (Supplement), s322

Crystal engeneering towards design of macrocyclic coordination compounds: the new family of the iodocuprates(I) complexes of 18-crown-6

J. A. Rusanova, K. V. Domasevitch and V. N. Kokozay



Acta Cryst. (2000). A56 (Supplement), s323

Catenanes, Rotaxanes and Knots: From Small Building Blocks to Mechanically Interlocked Molecules

M. Nieger and F. Vögtle



Acta Cryst. (2000). A56 (Supplement), s323

Calix[6]Arenes: A Supramolecular Approach For The Modeling Of The Active Site Of Metalloenzymes

M. Giorgi, O. Seneque, M.-N. Rager and O. Reynaud



Acta Cryst. (2000). A56 (Supplement), s324

Chiral Recognition and Crystal Structures of Dca Inclusion Compound with Fenchone

K. Prout, M. I. Mohamed Tahir and S. J. Heyes



Acta Cryst. (2000). A56 (Supplement), s324

Supramolecular Assemblies Involving Benzenepolycarboxylic Acids

M. R. J. Elsegood



Acta Cryst. (2000). A56 (Supplement), s325

Structures of solid state supramolecular chemistry: some more models

M. Czugler



Acta Cryst. (2000). A56 (Supplement), s325

Supramolecular assembly of diiodoperfluoro-arenes and -alkanes trough halogen bonding

T. Pilati, P. Metrangolo and G. Resnati



Acta Cryst. (2000). A56 (Supplement), s326

Calixpyrroles and their Complexes

K. Suwinska, B. Turner and Y. Eichen



Acta Cryst. (2000). A56 (Supplement), s326

Crystal Structures of Solvated and Unsolvated Decameric Oxomolybdenum(V,VI) Cluster with Coordinated 3-Methylpyridine

B. Modec, J. V. Brencic and L. Golic



Acta Cryst. (2000). A56 (Supplement), s327

Supramolecular structure of [H(phen)2][Ni(C2B9H11)2]

T. M. Polyanskaya



Acta Cryst. (2000). A56 (Supplement), s327

On the isostructurality of calcium channel antagonist 1,4-dihydropyridines

A. Kálmán, L. Fábián and Gy. Argay



Acta Cryst. (2000). A56 (Supplement), s328

Anionic Cationic Interactions in Dinuclear Cyclic Complexes of Cu(I), Ag(I) and Hg(II) with Phosphines Containing an Imidazole Ring

F. Bachechi, A. Burini, R. Galassi and B. R. Pietroni



Acta Cryst. (2000). A56 (Supplement), s328

Hydrogen-Bonded Networks and Porous Crystals of Metalloporphyrins

Y. Diskin-Posner, S. Dahal and I. Goldberg



Acta Cryst. (2000). A56 (Supplement), s329

The Simple Structure Of [Co(ostaH)3]

R. A. Coxall, D. K. Henderson, S. Parsons and R. E. P. Winpenny



Acta Cryst. (2000). A56 (Supplement), s329

Stability conditions for Quasi-Racemates of Coordination Compounds

R. Härter, U. Englert, C. Hu, I. Kalf and X. Zheng



Acta Cryst. (2000). A56 (Supplement), s330

Structure of an unusual copper-basket shaped assemblage

M. Cesario, R. Ziessel and T. Prangé



Acta Cryst. (2000). A56 (Supplement), s330

Binary Crystals via Quasiracemates

R. Haerter, C. Hu, I. Kalf, X. Zheng and U. Englert



Acta Cryst. (2000). A56 (Supplement), s331

Few molecules in asymmetric unit; why?

V. Langer, A. V. Malkov and P. Kocovsky



Acta Cryst. (2000). A56 (Supplement), s331

Structural behaviour of Ni(II) and Cu(II) complexes with N2O2 Schiff base ligands: the effect of molecular conformation on crystal packing

M. T. Duarte, M. F. M. Piedade, C. Freire and B. de Castro



Acta Cryst. (2000). A56 (Supplement), s332

Copper(I) and Copper(II) Halogeno Polymers with 2,1,3-benzothiazole: Variation of 1D and 2D Polymeric Structures as a Function of Reaction Conditions

C. P. Raptopoulou, V. Psycharis, A. Gantis, G. S. Papaefstathiou and S. P. Perlepes



Acta Cryst. (2000). A56 (Supplement), s332

X-ray Study of Binuclear K+/Ba2+-Transition Metal Complexes with Heterotopic Macrocyclic Ligands Based on Isothiosemicarbazide

V. Ch. Kravtsov, Yu. A. Simonov, J. Lipkowski, V. B. Arion, N. V. Gerbeleu and J. I. Gradinaru



Acta Cryst. (2000). A56 (Supplement), s333

Chiral recognition and crystal structures of DCA inclusion compound with [alpha]-methylbenzylamine

M. I. Mohamed Tahir, K. Prout and S. J. Heyes



Acta Cryst. (2000). A56 (Supplement), s333

From Coordination Compounds to Supramolecular systems. The Structure of Ni(II) Complexes Based on S-alkylisothiosemicarbazide and Related Macrocycles

Yu. A. Simonov, V. Ch. Kravtsov, P. N. Bourosh, J. Lipkowski, N. V. Gerbeleu, J. I. Gradinaru, V. B. Arion and M. D. Revenco



Acta Cryst. (2000). A56 (Supplement), s334

Hexagonal and Pseudo-Hexagonal Grid Motifs in Inorganic Crystal Engineering: Cobalt(II) Cupferronato Complexes Incorporating Neutral N-Donors with Intermolecular NH2 Connectors

A. Deák, A. Kálmán, L. Párkányi, M. Venter and I. Haiduc



Acta Cryst. (2000). A56 (Supplement), s335

The Effect Of Deuteration On The Crystalline Structure And The Motion Of Methyl Group In Lithium Acetate Dihydrate

B. Nicolaï, F. Fillaux and A. Cousson



Acta Cryst. (2000). A56 (Supplement), s335

Variable Temperature Crystal Structure Studies of m-Nitroaniline

G. Wójcik and J. Holband



Acta Cryst. (2000). A56 (Supplement), s336

From Polyaniline Oligomers to Conducting Organic Crystals

A. Gawlicka-Chruszcz, K. Stadnicka and J. Laska



Acta Cryst. (2000). A56 (Supplement), s336

Phases of Solid Methanol

B. H. Torrie, O. S. Binbrek and I. P. Swainson



Acta Cryst. (2000). A56 (Supplement), s337

Low temperature structure and dynamics of [beta]-chloropivalic acid

C. Buhrmester and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s337

The Surprising Polymorph C of Cimetidine: synchrotron radiation to the rescue

H. Birkedal, A. Bauer-Brandl and P. Pattison



Acta Cryst. (2000). A56 (Supplement), s338

Synthesis, Crystal Structure and Magnetic Properties of a ([bold mu]-Hydroxo)([bold mu]-Pyrazolato) Dicopper(II) Complex

Y. Elerman, H. Kara and K. Prout



Acta Cryst. (2000). A56 (Supplement), s338

Synthesis, Crystal Structure and Magnetic Properties of a Novel (GdIII-CuII) Heterodinuclear Complex

H. Kara, Y. Elerman and K. Prout



Acta Cryst. (2000). A56 (Supplement), s339

Zerovalent copper in reactions with triethanolamine and cobalt(II) salts: syntheses, structural, spectroscopic and magnetic studies of novel mixed-metal Cu/Co complexes

V. G. Makhankova, O. Yu. Vassilyeva, V. N. Kokozay and B. W. Skelton



Acta Cryst. (2000). A56 (Supplement), s339

Temperature And Pressure Dependence Of The Crystal Structures Of Spin Crossover Iron Complexes

M. Marchivie, P. Guionneau, M. Kollmannsbergem, J. F. Létard, Y. Barrans, A. E. Goeta, J. A. K. Howard and D. Chasseau



Acta Cryst. (2000). A56 (Supplement), s340

Polymeric Cu(II)-Complexes with 1,4,5,8,9,12-Hexaazatriphenylene (HAT) as Bridging Ligand

H. Grove and J. Sletten



Acta Cryst. (2000). A56 (Supplement), s340

Oxalato-bridged Dimer [Fe2oxF4(DMSO)4] and Double-Chain (imidH)2[Fe2oxF6]: Structures and Magnetism

W. Massa, R. Leo and J. Pebler



Acta Cryst. (2000). A56 (Supplement), s341

The crystal structure of soda at 110  K and 270  K

E. Libowitzky and G. Giester



Acta Cryst. (2000). A56 (Supplement), s341

Anharmonic thermal motion of a rigid molecule

D. Schwarzenbach



Acta Cryst. (2000). A56 (Supplement), s342

Temperature dependent study of copper(II) carboxylates with 2-aminopyridine

N. Lah, G. Giester, C. Lengauer, P. Segedin and I. Leban



Acta Cryst. (2000). A56 (Supplement), s342

Implications of charge transfer in molecular organic crystals

V. Oison, C. Koenig and C. Katan



Acta Cryst. (2000). A56 (Supplement), s343

Low-Temperature Structure, Molecular Dynamics and Phase Transition of Phenothiazine

A. Criado and F. J. Zúñiga



Acta Cryst. (2000). A56 (Supplement), s343

Synthesis, Crystal Structure and Magnetic Properties of Linear Trinuclear Nickel(II) Complexes

A. Elmali, E. Kavlakoglu, I. Svoboda and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s344

Investigation of crystal structure of M(hfac)2 with 2,2,5,5-tetramethyl-4-phenyl-3-imidazoline-1-oxyl-3-oxide (M = Cu(II), Co(II))

N. V. Pervukhina and A. B. Burdukov



Acta Cryst. (2000). A56 (Supplement), s344

Synthesis, Crystal Structure and Magnetic Properties of Binuclear ([bold mu]-Hydroxo)([bold mu]-acetato) Dicopper(II) Complexes

E. Kavlakoglu, A. Elmali, I. Svoboda and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s345

Simple Structure Prediction? Use Of Crystallographic Data To Aid Design And Prediction Of Molecular Structure Using Molecular ModellingTechniques

A. Parkin, D. Coventry, R. A. Coxall, S. Parsons and P. A. Tasker



Acta Cryst. (2000). A56 (Supplement), s345

Novel Chiral Local Anesthetic: Multidisciplinary Characterization

J. Grochowski, P. Serda, M. Pasenkiewicz-Gierula, P. Talik, R. Czarnecki, T. Librowski and S. Lochynski



Acta Cryst. (2000). A56 (Supplement), s346

Insights into Crystal Structure Prediction using the Cambridge Structural Database and other related methods

S. J. Borwick, D. J. Watkin and W. D. S. Motherwell



Acta Cryst. (2000). A56 (Supplement), s346

Crystallographic Computing Of The High Energy Material Hmxp

B. Kempa, V. Thome, M. Herrmann and W. Engel



Acta Cryst. (2000). A56 (Supplement), s347

Quantum Chemical Calculations on the Crystal Structure of Borazine (B3N3H6)

G. Raabe



Acta Cryst. (2000). A56 (Supplement), s348

Cation distribution of solid solutions of calcium and cadmium hydroxyapatite

A. Nounah, J. L. Lacout and J. M. Savariault



Acta Cryst. (2000). A56 (Supplement), s348

Synchrotron powder diffraction study of the structural phase transition of Friedel salt Ca2Al(OH)6+ Cl-, 2H2O

J.-P. Rapin, G. Renaudin, E. Elkaïm and M. François



Acta Cryst. (2000). A56 (Supplement), s349

Structure determination of two organometallic complexes from powder data with grid-search techniques

E. Dova, K. Goubitz, R. Driessen, E. Sonneveld, V. Chernyshev and H. Schenk



Acta Cryst. (2000). A56 (Supplement), s349

Magnetic textures - Analysis of Easy Magnetization Direction; Application to Powder Pattern Decomposition

R. Cerny



Acta Cryst. (2000). A56 (Supplement), s350

Advances in automatic powder indexing: An enhanced 32-bit version of the Crysfire suite

R. Shirley



Acta Cryst. (2000). A56 (Supplement), s350

X-ray Powder Diffraction Study of Tetragonal Rare Earth Oxybromides, REOBr

J. Hölsä, M. Lahtinen, M. Lastusaari, J. Niittykoski and J. Valkonen



Acta Cryst. (2000). A56 (Supplement), s351

Crystal Structures of HFCs and HCFCs by High Resolution Powder X-ray Diffraction

M. Brunelli and A. N. Fitch



Acta Cryst. (2000). A56 (Supplement), s351

Crystal structure of complex organic compound by powder diffraction methods

W. Lasocha, P. Milart, A. Rafalska-Lasocha and H. Schenk



Acta Cryst. (2000). A56 (Supplement), s352

Structure solution from powder pattern for a derivative of ascomycin using Cerius2 software

L. Motta-Viola, S. Pfeffer-Hennig and D. Giron



Acta Cryst. (2000). A56 (Supplement), s352

X-ray Powder Diffraction experiments with a 32-channel Si microstrip detector

V. Psycharis, A. Gantis, C. P. Raptopoulou, V. Perdikatsis, A. Pavlidis and D. Loukas



Acta Cryst. (2000). A56 (Supplement), s353

On the hydrogen induced cubic to-trigonal phase transition in R-H systems (R = trivalent rare-earth)

G. Renaudin, P. Fischer and K. Yvon



Acta Cryst. (2000). A56 (Supplement), s353

Carbonate localization in substituted apatite

J. M. Savariault, H. El Fehi, A. Ben Salah and M. Jemal



Acta Cryst. (2000). A56 (Supplement), s354

The adaptation of modulations in melilites to temperature and composition

M. Schosnig, A. K. Schaper, A. Kutoglu, W. Treutmann and H. Rager



Acta Cryst. (2000). A56 (Supplement), s354

Probing the Local Structure of Doped Manganites using the Atomic Pair Distribution Function

Th. Proffen and S. J. L. Billinge



Acta Cryst. (2000). A56 (Supplement), s355

Structure Determination of Low-Symmetry Naturally Originated Compounds Using SR Powder Diffraction

P. Serda, J. Grochowski, R. Czarnecki and T. Librowski



Acta Cryst. (2000). A56 (Supplement), s355

Texture as a tool for structure determination from powder diffraction data

T. Wessels, Ch. Baerlocher and L. B. McCusker



Acta Cryst. (2000). A56 (Supplement), s356

Application of Rietveld method for studying the structural characteristics of substituted copper ferrite compound

I. S. Ahmed Farag and A. M. Moustafa



Acta Cryst. (2000). A56 (Supplement), s356

Identification of small amounts of foreign phases in biomaterials containing calcium carbonate

B. Hasse, J. C. Marxen, W. Becker, H. Ehrenberg and M. Epple



Acta Cryst. (2000). A56 (Supplement), s357

Decomposition of the (Gd, Ho,Tb, Er)Ni5 Induced by High-Energy Ball Milling

A. Tonejc, M. Stubicar and Z Blazina



Acta Cryst. (2000). A56 (Supplement), s357

In situ X-ray Diffraction of Co/Al2O3 Catalyst during the Disproportionation of Carbon Monoxide

P. Pinheiro, M.-C. Schouler, P. Gadelle and E. Dooryhée



Acta Cryst. (2000). A56 (Supplement), s358

Structural Studies of Ultrafine-Grained Materials Obtained by Severe Plastic Deformation

R. Kuzel, R. K. Islamgaliev, J. Cízek and F. Chmelík



Acta Cryst. (2000). A56 (Supplement), s358

XRD study of size effects in Ni nanoparticles

L. M. Plyasova, T. A. Kriger, I. Yu. Molina, M. A. Ermakova and V. N. Parmon



Acta Cryst. (2000). A56 (Supplement), s359

Substitution of Fe3+ + O2- [if and only if] Co2+ +(OH)- and ordering of the Bi atoms in Bi2Fe(Fe,Co)(O,OH)2(OH)2(AsO4)2 minerals neustädtelite and cobaltneustädtelite

H. Effenberger, W. Krause, H.-J. Bernhardt and C. McCammon



Acta Cryst. (2000). A56 (Supplement), s359

Compressibility and high presussure chemistry of metamict Zircon ZrSiO4

P. Simoncic, M. Kunz and U. Schaltegger



Acta Cryst. (2000). A56 (Supplement), s360

The crystal structure of arsentsumebite, Pb2Cu[(As,S)O4)]2(OH)

N. V. Zubkova, D. Y. Pushcharovsky, G. Giester and E. Tillmanns



Acta Cryst. (2000). A56 (Supplement), s360

New Phases in RE-Borosilicate Systems (RE = La, Nd, Gd, Ho)

E. P. Shvanskii, N. I. Leonyuk, G. Bocelli and L. Righi



Acta Cryst. (2000). A56 (Supplement), s361

Pt-Pd-(Ni) monosulphides: structure refinement and modelling

T. Evstigneeva, S. van Smaalen, R. E. Dinnebier and V. von Seckendorff



Acta Cryst. (2000). A56 (Supplement), s361

Structure of K-rich Birnessite synthesized by Thermal Decomposition of KMnO4

A. C. Gaillot, V. A. Drits and B. Lanson



Acta Cryst. (2000). A56 (Supplement), s362

A single-crystal X-ray study on the low-temperature phase transitions in leonite-type compounds

B. Hertweck, T. Armbruster and E. Libowitzky



Acta Cryst. (2000). A56 (Supplement), s362

Crystal structure formation of silicates in accordance with the mechanism of matrix assembly

G. D. Ilyushin and L. N. Demianets



Acta Cryst. (2000). A56 (Supplement), s363

Crystal growth and structure of a new yttrium titanate, Y5+xTi2+yO12, related to rutile

U. Kolitsch



Acta Cryst. (2000). A56 (Supplement), s363

A new, lintisite-related titanosilicate mineral from Russia: crystal structure, occurrence and properties

U. Kolitsch, D. Y. Pushcharovsky, I. V. Pekov and E. Tillmanns



Acta Cryst. (2000). A56 (Supplement), s364

Mineralogical and Structural Investigations of Volkonskoite from West Ural

Y. S. Simakova



Acta Cryst. (2000). A56 (Supplement), s364

Electric Field Gradients derived from CCD X-ray Diffraction Data in Silicates: the cases of 27Al in Al2SiO5 Polymorphs and 25Mg in Mg2SiO4 Forsterite

N. E. Ghermani, S. Dahaoui, S. Ghose and J. A. K. Howard



Acta Cryst. (2000). A56 (Supplement), s365

Charge density study of synthetic grossular garnets

Y. Dusausoy, F. Porcher, C. Lecomte, H. Legal, J. M. Gaite and H. Rager



Acta Cryst. (2000). A56 (Supplement), s365

The vibrational behaviour of eight-coordinated atoms in pyralspite garnets: anharmonicity or disorder?

C. M. Gramaccioli, T. Pilati and F. Demartin



Acta Cryst. (2000). A56 (Supplement), s366

Determination of the environment of Fe3+ using the fourth order Spin-Hamiltonian constants, its power and limits

J.-M. Gaite, Y. Dusausoy, S. S. Hafner and H. Rager



Acta Cryst. (2000). A56 (Supplement), s366

Structure of Triclinic Na-rich Birnessite

B. Lanson, V. A. Drits, Q. Feng and A. Manceau



Acta Cryst. (2000). A56 (Supplement), s367

Computer modeling of the mixing properties of MO-M'O solid solutions

V. S. Urusov, T. G. Petrova and N. N. Eremin



Acta Cryst. (2000). A56 (Supplement), s367

Computer modeling of structure and properties of Mn-oxides using atomization energy minimization

V. S. Urusov, O. V. Obolenskiy and N. N. Eremin



Acta Cryst. (2000). A56 (Supplement), s368

Microstructures of Polygonal Serpentines from HRTEM Imaging, Electron Diffraction, and Simulation Data

B. Devouard and A. Baronnet



Acta Cryst. (2000). A56 (Supplement), s369

Electric field induced distortions in KTP

F. Lorut, P. Pernot-Rejmánková, M. Schlenker and J. Baruchel



Acta Cryst. (2000). A56 (Supplement), s369

Structural analysis of nonlinear optical materials

V. Ichharam and J. C. A. Boeyens



Acta Cryst. (2000). A56 (Supplement), s370

Evolution of the NLO material analogues of KTiOPO4 in the temperature range 293 - 973  K (structural and SHG properties)

P. Delarue, C. Lecomte, M. Jannin, G. Marnier, J. P. Feve and O. Pacaud



Acta Cryst. (2000). A56 (Supplement), s370

Y2Be2SiO7: Growth, Structure, Solid Solution

G. Kuz'micheva, D. Larin, S. Kutovoi, V. Panyutin and V. Rybakov



Acta Cryst. (2000). A56 (Supplement), s371

Evolution of the structural and mean square displacement parameters in (NH4)xK1-xH2PO4 solid solutions versus concentration and temperature

A. Boukhris, C. Lecomte and A. Thalal



Acta Cryst. (2000). A56 (Supplement), s371

High temperature ferro-paraelectric phase transition in tris(trimethylammonium) nonachlorodiantimonate(III) (TMACA) studied by X-ray diffraction method

M. Bujak and J. Zaleski



Acta Cryst. (2000). A56 (Supplement), s372

Holographic measurements as a probe for domain dynamics and polarization reversal in the ferroelectric relaxor Strontium-Barium-Niobate

U. Dörfler, M. Imlau, Th. Woike, W. Kleemann, R. Pankrath and M. Wöhlecke



Acta Cryst. (2000). A56 (Supplement), s372

Influence of impurities on the second harmonic generation efficiency in KTiOPO4 crystals

M. Imlau, K. Betzler, E. Krätzig and Th. Woike



Acta Cryst. (2000). A56 (Supplement), s373

Satellite reflections from lateral heterostructures of inversion domains in LiNbO3, KTiOPO4 and KTiOAsO4

T. S. Lyford, P. A. Thomas, S. P. Collins and D. Laundy



Acta Cryst. (2000). A56 (Supplement), s373

Isotope Effect in TlH2PO4. Structural Study of the Antiferroelectric Low Temperature Phases of TlH2PO4 and TlD2PO4

E. Álvarez, G. Madariaga and T. Brezewski



Acta Cryst. (2000). A56 (Supplement), s374

Pinning effects and the dynamic behavior of ferroelectric domains in Sr0.61Ba0.39Nb2O6:Ce

T. Granzow, M. Imlau, Th. Woike, W. Kleemann, M. Wöhlecke and R. Pankrath



Acta Cryst. (2000). A56 (Supplement), s374

Polymorphism of nonlinear optical materials

T. V. Timofeeva, V. N. Nesterov, R. D. Clark and M. Yu. Antipin



Acta Cryst. (2000). A56 (Supplement), s375

Impedance spectroscopy study of hydrothermal synthesized BaTi1-XZrXO3:Ni ceramics

A. Outzourhit, M. A. El Idrissi raghni, M. L. Hafid and F. Bensamka



Acta Cryst. (2000). A56 (Supplement), s375

Crystal Structures and Raman Scattering of the Phases of Li2NH4K(SO4)2. A New Compound with Ferroelectric Paraelectric Phase Transition

J. Mata, X. Solans, T. Calvet and M. Font-Bardia



Acta Cryst. (2000). A56 (Supplement), s376

Structure of the hydrated phase of RbD2PO4 (DRDP): RbD2PO4*D2O

S. Mattauch, W. Paulus, J. Glinnemann and G. Heger



Acta Cryst. (2000). A56 (Supplement), s376

Lifetime of small Nb4+-Polarons in Sr0.61Ba0.39Nb2O6:Ce,Cr and KNbO3

Th. Woike, D. Berben, M. Imlau, K. Buse, R. Pankrath and E. Krätzig



Acta Cryst. (2000). A56 (Supplement), s377

Structural Features of Flux Grown (Y,RE)Al3(BO3)4 (RE = Nd, Gd) Solid Solutions

E. V. Koporulina, N. I. Leonyuk and A. V. Mokhov



Acta Cryst. (2000). A56 (Supplement), s377

Electronic structure and Pb-O bonding in Complex Lead Perovskites and Lead Monoxide

J. M. Raulot, P. Cortona and G. Baldinozzi



Acta Cryst. (2000). A56 (Supplement), s378

Relations Between Structural Features and Crystallization Mechanisms of Non-Linear Optical Borate Materials

N. I. Leonyuk



Acta Cryst. (2000). A56 (Supplement), s378

Polar Phase in Alkaline and Thallium Fluoroberyllates at Room Temperature?

C. González-Silgo, J. González-Platas, J. Rodríguez-Carvajal, M. L. Martínez-Sarrión and L. Mestres



Acta Cryst. (2000). A56 (Supplement), s379

What crystallography can bring to the determination of cubic optical nonlinearities in noncentrosymmetric crystals

J. P. Fève, B. Boulanger, P. Delarue and B. Ménaert



Acta Cryst. (2000). A56 (Supplement), s379

Piezo-electric materials. X-ray diffraction from crystals under electric fields. A first test on alpha quartz

R. Guillot, P. Allé, P. Fertey, N. K. Hansen and E. Elkaïm



Acta Cryst. (2000). A56 (Supplement), s380

Syntheses and Characterization of BaTiO3 ceramic powders and delineation of methodologies for the fine control of stoichiometry in the synthesis of mixed oxides

A. E. Marteel and J. A. Davies



Acta Cryst. (2000). A56 (Supplement), s380

Structural Control of Perovskite-type BaXO3 by Selection of X ions

H. Horiuchi, T. Shishido and M. Tanaka



Acta Cryst. (2000). A56 (Supplement), s381

Neutron and X-ray powder diffraction study of the antiferromagnet-ferromagnet and insulator-metal transitions in the TbBaCo1.9Fe0.1O5.5 perovskite

D. D. Khalyavin, I. O. Troyanchuk and A. N. Pirogov



Acta Cryst. (2000). A56 (Supplement), s381

Preparation and structure of a new perovskite-like ternary oxide Sr3ReO6

K. G. Bramnik, A. M. Abakumov and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s382

Models of the Crystal Structures of Phases in Doped Lanthanum Manganites

V. E. Naish and T. V. Novoselova



Acta Cryst. (2000). A56 (Supplement), s382

Charge ordering and antiferromagnetism in Pr0.8Na0.2MnO3

M. Dlouha, S. Vratislav, Z. Jirák and K. Knízcek



Acta Cryst. (2000). A56 (Supplement), s383

Anomaly of structural properties in PMN at low temperatures

A. R. Lebedinskaya and M. F. Kupriyanov



Acta Cryst. (2000). A56 (Supplement), s383

Synthesis of La1-xCaxMnO[bold delta] by wet chemical routes

C. Vázquez-Vázquez, S. Dosil-Caamaño and M. A. López-Quintela



Acta Cryst. (2000). A56 (Supplement), s384

New oxyfluoride lead-free ferroelectric relaxors in the BaTiO3-BaZrO3-BaLiF3 system

A. Kerfah, K. Taïbî, A. Guehria-Laïdoudî, A. Simon and J. Ravez



Acta Cryst. (2000). A56 (Supplement), s384

Charge ordering in the layered perovskites LnBaCo2O5 (Ln = Ho,Tb)

E. Suard, F. Fauth, V. Caignaert, I. Mirebeau and G. Baldinozzi



Acta Cryst. (2000). A56 (Supplement), s385

Investigation of the structure and phase transitions in the novel a-site substituted perovskite compound Na0.5Bi0.5TiO3

G. O. Jones and P. A. Thomas



Acta Cryst. (2000). A56 (Supplement), s385

Photoinduced crystallographic transition in the gmr like perovskite compound Nd0.7Ca0.3MnO3

F. Fauth, E. Suard and V. Caignaert



Acta Cryst. (2000). A56 (Supplement), s386

Crystal Structure of Ca4.78Cu6O11.60

Ph. Galez, M. Lomello-Tafin and Th. Hopfinger



Acta Cryst. (2000). A56 (Supplement), s386

Ferroelastic phase of Pb5Al3F19

G. Bravic, R. Von der Mühll and J. Ravez



Acta Cryst. (2000). A56 (Supplement), s387

The true symmetry of [H3NCH2CH2NH3]2 [FeO(PO4)4].H2O with an open-framework structure

A. Meden, N. Rajic and V. Kaucic



Acta Cryst. (2000). A56 (Supplement), s387

The structure and dynamics of doubly occupied Ar hydrate

H. Itoh, J. S. Tse and K. Kawamura



Acta Cryst. (2000). A56 (Supplement), s388

Structure Solution of the Highly Disordered Layer Silicate H-RUB-18

M. Borowski, H. Gies and B. Marler



Acta Cryst. (2000). A56 (Supplement), s388

Werner Clathrates: A New Polymeric Inclusion Compound

M. L. Kilkenny and L. R. Nassimbeni



Acta Cryst. (2000). A56 (Supplement), s389

Zeolitic catalysts with chemisorbed methyl groups

S. Vratislav, M. Dlouhá and V. Bosácek



Acta Cryst. (2000). A56 (Supplement), s389

Zinc-Gallophosphate Analogues of Analcime and Paracelsian

N. Zabukovec Logar, A. Golobic, M. Mrak and V. Kaucic



Acta Cryst. (2000). A56 (Supplement), s390

Study of formation and structure of [(Co0.56Zn0.44)2(PO4)(H1.5PO4)2]C4H8N2 H4

A. Bareges, A. N. Christensen and R. G. Hazell



Acta Cryst. (2000). A56 (Supplement), s390

Microporous Rare-Earth Coordination Polymers: The Effect of Lanthanide Contraction on Crystal Architecture and Porosity

A. Michaelides, S. Skoulika, A. Dimos, C. Didierjean and A. Aubry



Acta Cryst. (2000). A56 (Supplement), s391

Adsorption of aromatic molecules in NaX zeolite: trying a structure determination by single-crystal X-ray diffraction

E. Aubert, F. Porcher, M. Souhassou, Y. Dusausoy, C. Lecomte, H. P. Weber and S. Capelli



Acta Cryst. (2000). A56 (Supplement), s392

Solving the structure of a new Ca-Sc-Sn disilicate twinned by metric merohedry

G. Ferraris, A. Gula, G. Ivaldi, M. Nespolo and G. Raade



Acta Cryst. (2000). A56 (Supplement), s392

Opposite Polarity Twin Domains of KLiSO4

Ch. Scherf, D. Rouède, Y. Le Grand, N. R. Ivanov, Th. Hahn, H. Klapper and G. Heger



Acta Cryst. (2000). A56 (Supplement), s393

An Investigation of Polar Twinning in KTiOPO4 and KTiOAsO4

P. A. Thomas, T. Lyford, P. Rejmankova-Pernot, F. Lorut, J. Baruchel and S. P. Collins



Acta Cryst. (2000). A56 (Supplement), s393

XRD/NMR structure determination of twinned. [beta]-Cu7PSe6 and [alpha]-Cu7PSe6 polymorphs

E. Gaudin, F. Taulelle, M. Evain, F. Boucher and V. Petricek



Acta Cryst. (2000). A56 (Supplement), s394

The Single Crystal X-ray Diffraction Study of KPb2Cl5

L. I. Isaenko, A. A. Merkulov, V. M. Pashkov, A. V. Virovets and D. Y. Nauma



Acta Cryst. (2000). A56 (Supplement), s394

Structures of SrGeO3-CaGeO3 solid solutions

F. Nishi and Y. Matsumoto



Acta Cryst. (2000). A56 (Supplement), s395

Evidence for a structural phase transition in the quasi-2D spin dimer system SrCu2(BO3)2

K. Sparta, G. Redhammer, P. Roussel, G. Roth and G. Heger



Acta Cryst. (2000). A56 (Supplement), s396

Modelling of Alite: an industrial challenge

M. Signes-Frehel, M. N. de Noirfontaine and F. Dunstetter



Acta Cryst. (2000). A56 (Supplement), s397

Intergrowth Phases of Rare Earth Boride Carbides and the Structure of Interfaces

O. Oeckler, J. Bauer, H. Mattausch and A. Simon



Acta Cryst. (2000). A56 (Supplement), s397

Physisorption Studies on Carbon Nanotubes

A. Bougrine, M. Muris, M. Bienfait, D. Billaud, N. Dupont-Pavlovsky and E. McRae



Acta Cryst. (2000). A56 (Supplement), s398

Structural studies of non-graphitized cokes (experiment and modelization)

I. Rannou



Acta Cryst. (2000). A56 (Supplement), s399

Temperature Dependent X-ray Stress Analysis on MBE- Grown GaN- Films On Sapphire

B. Sonderegger, J. Keckes, G. Leising and R. Resel



Acta Cryst. (2000). A56 (Supplement), s399

X-ray diffraction line broadening by stacking faults in SrBi2Nb2O9/SrTiO3 epitaxial thin films

A. Boulle, C. Legrand, R. Guinebretière, J. P. Mercurio and A. Dauger



Acta Cryst. (2000). A56 (Supplement), s400

The Influence of Boundaries to Properties of Electronic Layered Crystalline Structures

S. M. Stojkovic



Acta Cryst. (2000). A56 (Supplement), s400

Adsorption of oxygen on copper films on a Pt(111) surface: structure and composition

J. S. Tsay, T. Mangen, R.-J. Linden and K. Wandelt



Acta Cryst. (2000). A56 (Supplement), s401

Determination of the chemical composition profile in As+ implanted InGaAs/InP superlattice crystal by means of X-ray diffraction

J. Gaca, M. Wojcik and A. Turos



Acta Cryst. (2000). A56 (Supplement), s401

Laterally structured surfaces of GaAs (001) characterized by conventional and synchrotron X-ray methods

K. Mazur, J. Sass, F. Eichhorn and A. Turos



Acta Cryst. (2000). A56 (Supplement), s402

Electron density topological analysis of silicon surfaces. The case of Si(100)(1x1):H and Si(100)(2x1):H

F. Cargnoni and C. Gatti



Acta Cryst. (2000). A56 (Supplement), s402

Surface Structure of SrTiO3

S. Harkema, G. J. van Hummel, D. H. A. Blank, A. J. H. M. Rijnders and H. Rogalla



Acta Cryst. (2000). A56 (Supplement), s403

Regularities of crystallization of thin films of disilicide solid solution

L. Dvorina



Acta Cryst. (2000). A56 (Supplement), s403

Direct Phase Determination of Surface In-plane Reflection of Thin films by X-ray Grazing Incident Three-wave Resonance Diffraction

Y.-S. Huang, C.-S. Chao, C.-H. Hsu, Y. P. Stetsko, C.-Y. Hung, C.-H. Ching, G.-Y. Lin, T.-C. Lin, Y.-R. Li and S.-L. Chang



Acta Cryst. (2000). A56 (Supplement), s404

Growth of hexaphenyl thin films - preferred orientation of molecules on various substrates

R. Resel and G. Leising



Acta Cryst. (2000). A56 (Supplement), s404

HRXRD determination of the shape of the composition profile in quaternary InGaAsP/InP superlattice

M. Wojcik, J. Gaca and W. Strupinski



Acta Cryst. (2000). A56 (Supplement), s405

Adsorption of oxygen on copper films on a Pt(111) surface: structure and composition

J. S. Tsay, T. Mangen, R.-J. Linden and K. Wandelt



Acta Cryst. (2000). A56 (Supplement), s406

Investigation of the Alkaline Earth Phosphates: Crystal Structure of a New Strontium Hydrogen Phosphate Form

L. B. Taher, L. Smiri, Y. Laligant and V. Maisonneuve



Acta Cryst. (2000). A56 (Supplement), s406

Lead(II) Heptanoate: structure and thermal properties

M. François, J. P. Rivera, F. Lacouture, C. Didierjean, E. Rocca and J. Steinmetz



Acta Cryst. (2000). A56 (Supplement), s407

Diffuse scattering in bulk solids and surface layers

R. Barabash



Acta Cryst. (2000). A56 (Supplement), s407

Short-range order in quenched AL-LI alloys

I. S. Braude, T. V. Grigorova and L. G. Ivanchenko



Acta Cryst. (2000). A56 (Supplement), s408

Diffuse Scattering Associated with the Relaxation State in the AIIIBV Compounds

J. Sass and K. Mazur



Acta Cryst. (2000). A56 (Supplement), s408

Diffuse scattering of a diatomic molecular system: comparison between the liquid and the plastic solid phases of oxygen

O. B. M. Hardouin Duparc, F. Dunstetter, O. Condat and C. Clément



Acta Cryst. (2000). A56 (Supplement), s409

The Simultaneous Account of Effects of Static Displacements, Short-Range Order and Thermal Oscillations of Atoms in a Diffuse Scattering of X-rays and Neutrons by Polycrystalline Interstitial Solid Solutions

V. A. Tatarenko and I. O. Golovashich



Acta Cryst. (2000). A56 (Supplement), s410

The Use of Optical Transforms in Teaching

T. R. Welberry



Acta Cryst. (2000). A56 (Supplement), s411

Investigations of two nickel phosphine complexes

D. D. Ellis and A. L. Spek



Acta Cryst. (2000). A56 (Supplement), s411

Crystal structures of heteronuclear Cu/Zn complexes with ethylenediamine obtained by direct synthesis

O. V. Prima, S. R. Petrusenko and V. N. Kokozay



Acta Cryst. (2000). A56 (Supplement), s412

Crystal Structure of Boc-Gly-[Delta]Phe-Gly Phe-4-pNA

K. Ejsmont, M. Makowski and J. Zaleski



Acta Cryst. (2000). A56 (Supplement), s412

Nicotinamide Adducts of Cobalt(II) Arylcarboxylates

H. Necefoglu and T. Hökelek



Acta Cryst. (2000). A56 (Supplement), s413

The influence of metal coordination on ligand geometry: The structures of 2-(diphenylphosphino)acetophenone and bis(2-(diphenylphosphino)acetophenone)palladium(II)trifluoromethanesulfonate

M. H. Johansson, C. Andersson and A. Oskarsson



Acta Cryst. (2000). A56 (Supplement), s413

Synthesis and Structure of a New Binuclear Complex [BaCo(C3H2O4)2(H2O)4]

A. Djeghri, F. Balegroune, A. Guehria-Laidoudi, L. Toupet and P. Briard



Acta Cryst. (2000). A56 (Supplement), s414

Structure and stability of a bridged biphenyl: an X-ray and theoretical study

A. Forni and G. Casalone



Acta Cryst. (2000). A56 (Supplement), s414

Steric and Electronic studies of Palladium bis-Phosphine Catalysts

P. A. Champkin, M. R. J. Elsegood and W. Clegg



Acta Cryst. (2000). A56 (Supplement), s415

Some Hemithio-dithioacetal Derivatives of Tetrahydropyran

J. Kansikas and K. Sipilä



Acta Cryst. (2000). A56 (Supplement), s415

X-ray Study of the Products of Urotropin N-alkylation in Water Catalysed by Tetrafluoroborate Anion

E. Kosterina, V. Rybakov, S. Troyanov and L. A. Aslanov



Acta Cryst. (2000). A56 (Supplement), s416

The Crystal Structure of n-Octadecylammonium Bromide

D. G. Billing, G. J. Kruger and M. Rademeyer



Acta Cryst. (2000). A56 (Supplement), s416

Structural and spectroscopic characterization of complexes of mercury(II) halides and pseudohalides with benzimidazole-2-thione

D. Matkovic-Calogovic, G. Pavlovic, Z. Popovic, Z Soldin and G. Giester



Acta Cryst. (2000). A56 (Supplement), s417

Stereochemical study of natural sesquiterpenic complexes by X-rays

L. El Firdoussi, S. Allaoud and A. Karim



Acta Cryst. (2000). A56 (Supplement), s417

Crystal structure of two modifications of u(tta)2 complex with nitronylnitroxide

G. Romanenko, I. El'tsov and V. Ovcharenko



Acta Cryst. (2000). A56 (Supplement), s418

Structural Study of 3,4-Dihydro-2(1H)pyridones and Isoxazolo[5,4-b]pyridin-6(7H)-ones

H. Novoa, N. Blaton, M. O. Peeters, C. De Ranter, M. Suárez, Y. Verdecia, E. Ochoa, E. Salfrán, L. Morán, N. Martin, R. Martínez, M. Quinteiro, C. Seoane and J. L. Soto



Acta Cryst. (2000). A56 (Supplement), s418

Polymeric aqua-(hydrogen glutarato) glutarato lanthanum (III) monohydrate

B. Benmerad, A. Guehria-Laïdoudi, F. Balegroune, H. Birkedal and G. Chapuis



Acta Cryst. (2000). A56 (Supplement), s419

Structural studies of tributyltin 2-sulfobenzoate

J. Sykora, J. Brus, A. Smicka and M. Husak



Acta Cryst. (2000). A56 (Supplement), s419

Novel boron coordination compounds with polymeric complex anion. Crystal structure of ammonium-cadmium (1:2) bis ((+)-tartrato)boratetetrahydrate

I. Zviedre, V. Belsky, J. Ronis and J. Schwartz



Acta Cryst. (2000). A56 (Supplement), s420

Coordination peculiarities of 5-pyridinesubstituted N-methyl isoxazolidines: syntheses, characterization and crystal sructures of Pd(II), Zn(II) complexes

A. B. Lysenko, S. V. Shishkina, O. V. Shishkin, F. L. Ortiz and R. D. Lampeka



Acta Cryst. (2000). A56 (Supplement), s420

Crystal structures and absolute configurations of two new amino acids obtained from monoterpene ketones

J. Holband, G. Wójcik, S. Lochynski and J. Kuldo



Acta Cryst. (2000). A56 (Supplement), s421

Crystal structure and thermal expansion of LuB12 single crystals

A. Pietraszko, A. Czopnik, N. Shitsevalova, Y. Paderno and V. Pluzhnikov



Acta Cryst. (2000). A56 (Supplement), s421

Phase Transitions in the Ba(OD)2-System: A new low-T polymorph

A. Friedrich, M. Kunz and E. Suard



Acta Cryst. (2000). A56 (Supplement), s422

Holographic light scattering in centrosymmetric crystals

P. Herth, Th. Woike, M. Imlau and R. A. Rupp



Acta Cryst. (2000). A56 (Supplement), s422

Metastable Structures, Bonding Properties and Phase Transitions in Alloys of the Zr-Nb and Ti-V Systems

G. J. Cuello, A. Fernández Guillermet, G. Aurelio and J. Campo



Acta Cryst. (2000). A56 (Supplement), s423

Infrared Spectroscopy of Li2B4O7

N. D. Zhigadlo, M. Zhang and E. K. H. Salje



Acta Cryst. (2000). A56 (Supplement), s423

Phase transitions and structures of the Ag8TiS6 ionic conductor

F. Duc, M. Dusek, P. Pattison, M. Onoda and G. Chapuis



Acta Cryst. (2000). A56 (Supplement), s424

Crystal Structure of the Solid Solutions in the Li-Mg-Ca and Li-Mg-Gd ternary systems

V. V. Pavlyuk, G. S. Dmytriv, D. G. Kevorkov, O. I. Bodak, R. Schmid-Fetzer and J. Gröbner



Acta Cryst. (2000). A56 (Supplement), s424

Structural Study of Cerium Chromates

B. Casari and V. Langer



Acta Cryst. (2000). A56 (Supplement), s425

Phase analysis of NaxWO3 and NaxMoyW1-yO3

A. U. Monir, A. Hussain and T. M. Khobaer



Acta Cryst. (2000). A56 (Supplement), s425

Structure and low temperature yield stress of quenched Al-Li alloys

V. V. Pustovalov, N. V. Isaev, V. S. Fomenko and S. E. Shumilin



Acta Cryst. (2000). A56 (Supplement), s426

On the rocks... crystallization on rough surfaces. New applications

C. Teixeira



Acta Cryst. (2000). A56 (Supplement), s426

Investigating the Configuration at Vanadium in Highly Active Catalysts for Stereoselective Oxidations

I. Svoboda, M. Greb, J. Hartung, P. Schmidt and H. Fuess



Acta Cryst. (2000). A56 (Supplement), s427

New structural members of polysulfide family

N. V. Podberezskaya, N. V. Pervukhina, S. V. Belaya, I. G. Vasilyeva and S. V. Borisov



Acta Cryst. (2000). A56 (Supplement), s427

Phase transition and temperature induced switch of Jahn-Teller deformation direction in Cs2Cu(ZrF6)2 6H2O

P. E. Tomaszewski, A. Pietraszko, K. Lukaszewicz and M. A. Augustyniak-Jablokow



Acta Cryst. (2000). A56 (Supplement), s428

High Temperature Phase Transformation of Y4Al2O9

M. Shimada, H. Yamane and B. A. Hunter



Acta Cryst. (2000). A56 (Supplement), s428

The study of ordered phases in Ti1-uVuC0.6

M. Yu. Tashmetov, V. T. Em, C. H. Lee and H. S. Shim



Acta Cryst. (2000). A56 (Supplement), s429

Synthesis and crystal structures of fluorinated phases of potassium-indium hydroxiphosphate

M. G. Zhizhin, V. A. Morozov, L. N. Komissarova, A. A. Filaretov and F. M. Spiridonov



Acta Cryst. (2000). A56 (Supplement), s429

Domains of actinide atoms in crystals

A. P. Shevchenko, V. A. Blatov and V. N. Serezhkin



Acta Cryst. (2000). A56 (Supplement), s430

Spectral distribution of the photoemission quantum efficiency and reflection for Tl-As-S crystals in far ultraviolet

T. N. Shchurova, N. D. Savchenko, A. A. Spesivykh and V. M. Bentsa



Acta Cryst. (2000). A56 (Supplement), s430

Continuous Distortion of Periodic Surfaces as a Model for Phase Transitions

S. Leoni, S. P. Piotto and R. Nesper



Acta Cryst. (2000). A56 (Supplement), s431

Admixtures in Synthetic Zircons: SEM and XRD Study

A. Maslenikov and J. Plotkina



Acta Cryst. (2000). A56 (Supplement), s431

Tellurium crystal chemistry in some new tellurite compunds

J. C. Champarnaud-Mesjard, P. Thomas, S. Blanchandin, M. Dutreilh and B. Frit



Acta Cryst. (2000). A56 (Supplement), s433

Weak Interactions in Dipicrylamine

K. Wozniak, P. R. Mallinson, C. C. Wilson, E. Hovestreydt and E. Grech



Acta Cryst. (2000). A56 (Supplement), s433

Topological Analysis of the Electron Density in a Resonance Structure

S. J. Coles, S. M. Cafferkey and M. B. Hursthouse



Acta Cryst. (2000). A56 (Supplement), s434

Prediction of charge density and energy in polypeptides. Transferability and beyond

C. Delafosse and P. J. Becker



Acta Cryst. (2000). A56 (Supplement), s434

310 helix octapeptide electrostatic potential obtained from transferred experimental electric moments. Comparison to ab-initio SCF theoretical calculations

N. Bouhmaida, N. E. Ghermani, C. Jelsch, C. Lecomte, M.-M. Rohmer and M. Bénard



Acta Cryst. (2000). A56 (Supplement), s435

Joint analysis of charge and momentum densities

P. J. Becker, J. M. Gillet, C. Fluteaux and P. Cortona



Acta Cryst. (2000). A56 (Supplement), s435

A modulated structure determination and refinement using marginal diffraction data

A. D. Rae, A. J. Edwards, A. F. Williams and C. J. Matthews



Acta Cryst. (2000). A56 (Supplement), s436

Automatic model correction by the wARP/ARP method

I. M. L. Billas, L. Moulinier, A. Podjarny and D. Moras



Acta Cryst. (2000). A56 (Supplement), s436

The challenge of anomalous diffraction experiments at the MV edge (3.5  Å) of uranium

M.-L. Chesne, E. Fanchon, R. Kahn, H. Stuhrmann and J. Vicat



Acta Cryst. (2000). A56 (Supplement), s437

A Gd-complex to obtain heavy atom derivatives for SAD and MAD experiments. Results with tetragonal hen egg-white lysozyme

E. Girard, L. Chantalat, J. Vicat and R. Kahn



Acta Cryst. (2000). A56 (Supplement), s437

Site Directed Mutagenesis of Nitrite Reductase. The Crystallographic Studies of Recombinant Nitrite Reductase and Mutations

M. J. Ellis, F. E. Dodd, R. R. Eady, G. Sawers, M. Prudencio, S. S. Hasnain and B. E. Smith



Acta Cryst. (2000). A56 (Supplement), s438

Crystal Structure of Human Placental Alkaline Phosphatase

M. H. le Du, T. Stigbrand, M. Taussig, A. Ménez and E. Stura



Acta Cryst. (2000). A56 (Supplement), s438

Adrenodoxin/Adrenodoxin-Reductase: X-ray Structure of a Complex of two Components of the Steroidogenic Electron Transport System in Adrenal Cortex Mitochondria at 2.3  Å Resolution

J. J. Müller, A. Lapko, G. Bourenkov, E.-Ch. Müller, A. Otto, K. Ruckpaul and U. Heinemann



Acta Cryst. (2000). A56 (Supplement), s439

Guanine-specific binding at an intercalated DNA junction

J. R. Hobbs, J. H. Thorpe, W. A. Denny, P. Charlton and C. J. Cardin



Acta Cryst. (2000). A56 (Supplement), s439

The High Resolution Crystal Structure of the Nucleosome Core Particle: Sequence-Dependent DNA-Bending and Plasticity of Histone-DNA Binding

C. A. Davey and T. J. Richmond



Acta Cryst. (2000). A56 (Supplement), s440

Structural changes at the copper centre of Azurin in an oxidation-reduction process: an integrated approach combining crystallography and EXAFS

F. E. Dodd, K.-C. Cheung, R. W. Strange, Z. H. L. Abraham, R. R. Eady and S. S. Hasnain



Acta Cryst. (2000). A56 (Supplement), s440

Crystal structure of the Stromelysin-3 complexed with a phosphinic inhibitor reveals that its S1' pocket is a deep opened cavity

A. L. Gall, M. Ruff, V. Dive, M. C. Rio, P. Basset and D. Moras



Acta Cryst. (2000). A56 (Supplement), s441

A novel free-mounting system for protein crystals: transformation and improvement of diffraction power by accurately controlled humidity changes

R. Kiefersauer, H. Dobbek, S. Grazulis, M. Than and R. Huber



Acta Cryst. (2000). A56 (Supplement), s441

Spherically averaged phased translation function and its applications to search of molecules and fragments in the macromolecular electron density maps

A. Vagin and M. Isupov



Acta Cryst. (2000). A56 (Supplement), s442

Comparison of Solubility and Interactions of Aprotinin (BPTI) solutions in H2O and D2O

M. Budayova-Spano, S. Lafont, J.-P. Astier, C. Ebel and S. Veesler



Acta Cryst. (2000). A56 (Supplement), s442

Crystal Architecture and Magnetic Properties of Four Transition-metal Adipato Coordination Polymers

E. Bakalbassis, M. Korabik, A. Michaelides, J. Mronziski, C. Raptopoulou, S. Skoulika, A. Terzis and D. Tsaousis



Acta Cryst. (2000). A56 (Supplement), s443

The single-to-single crystal isomerization reaction of ([bold eta]5-C5H4Me)Re(CO)[P(OPh)3]Br2

R. S. Bogadi and D. C. Levendis



Acta Cryst. (2000). A56 (Supplement), s443

Structural systematics for structure prediction

M. B. Hursthouse and S. Ward



Acta Cryst. (2000). A56 (Supplement), s444

Powder Solve - a complete package for structure determination from powder diffraction data

M. A. Neumann, G. E. Engel, S. Wilke and F. J. J. Leusen



Acta Cryst. (2000). A56 (Supplement), s444

Site occupancies of spinel solid solutions

B. Lavina



Acta Cryst. (2000). A56 (Supplement), s445

A New Commensurate Structure of Co-âkermanite

K. Hagiya, K. Kusaka, M. Ohmasa and K. Iishi



Acta Cryst. (2000). A56 (Supplement), s445

Crystal and molecular structure of cobalt 2-methylthio-8-mercaptoquinolinate

L. Pech, Yu. Bankovsky, A. Kemme, E. Silina and J. Lejejs



Acta Cryst. (2000). A56 (Supplement), s446

Crystal structure of palladium2- methylthio-8-mercaptoquinolinate-{Pd3[C9H5(SCH2)NS]3

E. Silina, Yu. Bankovsky, V. Belsky, A. Stash, L. Pech and J. Lejejs



Acta Cryst. (2000). A56 (Supplement), s446

Tripotassium trichromium(III) tetraarsenate K3Cr3(AsO4)4 Synthesis and structural study

B. Bouzemi, H. Boughzala and T. Jouini



Acta Cryst. (2000). A56 (Supplement), s447

Structural and Anisotropic Thermal Expansion Correlation of Li2ZrO3 at Different Temperatures

Z. Heiba and K. El-Sayed



Acta Cryst. (2000). A56 (Supplement), s447

Novel Ta-bronzes. The crystal structure and conductivity of K6Ta6.5O15+xF6+y with partialy reduced Ta ions

A. V. Arakcheeva, V. V. Grinevitch, V. A. Mitin and V. F. Shamray


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