Structure of ristocetin A in complex with a bacterial cell-wall mimetic. Corrigendum.

Nahoum, V.; Spector, S.; Loll, P.

doi:10.1107/S0907444911008262

addenda and errata

STRUCTURAL
BIOLOGY

ISSN: 2059-7983

Volume 67| Part 6| June 2011| Page 592

https://doi.org/10.1107/S0907444911008262

Structure of ristocetin A in complex with a bacterial cell-wall mimetic. Corrigendum.

Virginie Nahoum,^a Sherri Spector ^a and Patrick Loll ^a ^*

^aDepartment of Biochemistry and Molecular Biology, Drexel University College of Medicine, Philadelphia, PA 19102, USA
^*Correspondence e-mail: ploll@drexelmed.edu

(Received 3 March 2011; accepted 4 March 2011)

Two errors in sugar stereochemistry in the structure of ristocetin A have been corrected and the structure has been re-refined.

Keywords: ristocetin A; bacterial cell-wall mimetic; corrigendum.

Supporting information

Crystal structure: contains datablocks global, Ristocetin. DOI: https://doi.org/10.1107/S0907444911008262/be5171sup1.cif

Computing details top

Ristocetin A top

Crystal data top

C₉₅H₁₁₀N₈O₄₄	c = 64.15 Å
Trigonal, P3₁21	T = 100 K
a = 22.65 Å

Data collection top

Radiation source: synchrotron, NSLS beamline X6A	k = →
h = →	l = →

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	B_iso*/B_eq	Occ. (<1)
1C1	0.36755	0.70684	0.85905		0.50
1C1B	0.60107	1.32390	0.88471		0.50
1C2	0.37301	0.68359	0.88083		0.50
1C2B	0.55489	1.35296	0.89065		0.50
1O2	0.35176	0.61380	0.88013		0.50
1O2B	0.56975	1.41006	0.87838		0.50
1C3	0.32334	0.68986	0.89508		0.50
1C3B	0.56291	1.37376	0.91336		0.50
1O3	0.32461	0.66503	0.91509		0.50
1O3B	0.52661	1.40802	0.91714		0.50
1C4	0.25206	0.65025	0.88588		0.50
1C4B	0.63796	1.41959	0.91846		0.50
1O4	0.20816	0.66223	0.89840		0.50
1O4	0.64453	1.43167	0.94017		0.50
1C5	0.25011	0.67125	0.86336		0.50
1C5B	0.68017	1.38798	0.91096		0.50
1C6	0.18159	0.62675	0.85249		0.50
1C6B	0.75634	1.43463	0.91452		0.50
1O5	0.30045	0.66712	0.85142		0.50
1O5B	0.66913	1.37279	0.88940		0.50
2C1	0.47666	0.98493	0.85625		0.50
2C1B	0.50990	1.04947	0.88761		0.50
2C2	0.55330	1.00956	0.85567		0.50
2C2B	0.56145	1.02419	0.88872		0.50
2C3	0.57198	0.96974	0.84030		0.50
2C3B	0.61941	1.06849	0.90375		0.50
2O3	0.63844	0.98320	0.84464		0.50
2O3B	0.67172	1.05187	0.90301		0.50
2C4	0.52120	0.89291	0.84074		0.50
2C4B	0.64880	1.14404	0.89865		0.50
2O4	0.53301	0.86090	0.82358		0.50
2O4B	0.69870	1.18513	0.91352		0.50
2C5	0.44799	0.87956	0.83997		0.50
2C5	0.59201	1.16204	0.89762		0.50
2C6B	0.39340	0.80436	0.84047		0.50
2C6	0.61814	1.23336	0.88916		0.50
2O6	0.39711	0.77541	0.85977		0.50
2O6B	0.57772	1.26308	0.89402		0.50
2O5	0.43651	0.91249	0.85700		0.50
2O5B	0.54246	1.11962	0.88301		0.50
3C1	0.61051	1.12645	0.86626		0.50
3C1B	0.50638	0.90760	0.87748		0.50
3O1	0.59072	1.07547	0.85117		0.50
3O1	0.53245	0.95735	0.89346		0.50
3C2	0.63987	1.19207	0.85391		0.50
3C2B	0.46068	0.83668	0.88646		0.50
3C3	0.70494	1.20573	0.84278		0.50
3C3B	0.50237	0.81384	0.89926		0.50
3O3	0.73490	1.26838	0.83206		0.50
3O3B	0.46099	0.74477	0.90548		0.50
3C4	0.75540	1.20802	0.85885		0.50
3C4B	0.56255	0.82312	0.88618		0.50
3O4	0.81340	1.21470	0.84853		0.50
3O4B	0.60536	0.80533	0.89729		0.50
3C5	0.72344	1.14277	0.87181		0.50
3C5B	0.60376	0.89424	0.87698		0.50
3C6	0.76881	1.14812	0.89006		0.50
3C6B	0.65796	0.89551	0.86276		0.50
3O6	0.78440	1.20721	0.90167		0.50
3O6B	0.69496	0.96087	0.85402		0.50
3O5	0.65951	1.12758	0.88029		0.50
3O5B	0.56058	0.91101	0.86559		0.50
4O3	0.72429	1.37600	0.89544		0.50
4O3B	0.36760	0.64541	0.87851		0.50
4C3	0.65542	1.32930	0.90133		0.50
4C3B	0.30843	0.65244	0.87572		0.50
4C2	0.60983	1.31044	0.88205		0.50
4C2B	0.31694	0.71591	0.88682		0.50
4O2	0.54592	1.30437	0.88766		0.50
4O2B	0.25152	0.70974	0.88981		0.50
4C1	0.59916	1.24034	0.87639		0.50
4C1B	0.35724	0.77214	0.87089		0.50
4O1	0.65831	1.24687	0.86624		0.50
4O1B	0.42786	0.79259	0.87106		0.50
4O4	0.59365	1.20991	0.89626		0.50
4O4B	0.33065	0.74094	0.85095		0.50
4C4	0.64972	1.26155	0.90805		0.50
4C4B	0.30304	0.66753	0.85290		0.50
4C5	0.62994	1.24452	0.93095		0.50
4C5	0.22713	0.63113	0.84783		0.50
4O5	0.60578	1.17351	0.93377		0.50
4O5B	0.21847	0.64153	0.82635		0.50
2C	0.46634	1.45013	0.85184
2O	0.48294	1.40695	0.85492
2CH3	0.47027	1.47980	0.83064
3N	0.43454	1.46501	0.86568
3CA	0.42543	1.43753	0.88654
3CB	0.40009	1.47506	0.90074
3CG	0.45796	1.54418	0.90753
3CD	0.43513	1.58390	0.92122
3CE	0.38565	1.54260	0.93869
3NZ	0.41931	1.54113	0.95857
3C	0.37639	1.36091	0.88683
3O	0.33701	1.33114	0.87263
4N	0.37996	1.33043	0.90389
4CA	0.33380	1.25895	0.90789
4CB	0.26919	1.24901	0.91799
4C	0.37009	1.23377	0.92220
4O	0.42021	1.27511	0.93215
5N	0.34524	1.16668	0.92325
5CA	0.37688	1.13655	0.93559
5CB	0.42495	1.12477	0.92215
5C	0.32441	1.07027	0.94585
5O	0.34679	1.04723	0.95943
5OXT	0.26397	1.04300	0.94025
1O19	0.06570	1.18748	0.95450
1C62	0.07194	1.19120	0.93252
1C63	0.00116	1.15031	0.92253
1O20	−0.03174	1.08037	0.92914
1C64	−0.04162	1.18228	0.92822
1O21	−0.10441	1.14527	0.91765
1C65	−0.00211	1.25865	0.92172
1C66	−0.03344	1.30213	0.92770
1O23	−0.03948	1.30392	0.94993
1O22	0.06676	1.29484	0.93106
1C61	0.10828	1.26619	0.92655
1O8	0.11870	1.26645	0.90481
1C28	0.15853	1.32747	0.89497
1C27	0.16821	1.32008	0.87371
1C25	0.13695	1.25120	0.86540
1C26	0.17639	1.21980	0.86443
1C21	0.15117	1.15347	0.85683
1C22	0.08339	1.11661	0.85033
1C23	0.04175	1.14593	0.85184
1C24	0.06904	1.21251	0.85934
1O7	0.02672	1.23922	0.86057
1C29	0.18890	1.39068	0.90501
1C30	0.23051	1.44768	0.89319
1O9	0.26000	1.50967	0.90269
1C31	0.24161	1.44340	0.87215
1C32	0.21103	1.37967	0.86222
1C33	0.22416	1.37274	0.83916
1C44	0.25510	1.43850	0.82772
1O10	0.31618	1.47200	0.82328
1O11	0.20851	1.45737	0.82450
1C45	0.22927	1.51716	0.81263
1N2	0.26540	1.33981	0.83793
1C34	0.25621	1.29652	0.82277
1O12	0.22258	1.29010	0.80698
1C35	0.28910	1.25237	0.82677
1N3	0.24271	1.18335	0.81901
1C36	0.20889	1.12569	0.82995
1O13	0.17835	1.07043	0.82111
1C20	0.20270	1.12946	0.85380
1N1	0.18542	1.06329	0.86228
1C19	0.20805	1.05840	0.88089
1O6	0.23561	1.10672	0.89305
1C18	0.20271	0.99024	0.88576
1N5	0.17857	0.97091	0.90708
1C17	0.12341	0.91162	0.91146
1O5	0.08883	0.86906	0.89813
1C16	0.10273	0.89730	0.93392
1N4	0.15714	0.90510	0.94841
1C15	0.14857	0.85422	0.96092
1O4	0.10098	0.79473	0.95894
1C56	0.06832	0.93451	0.94320
1C55	0.10616	0.99783	0.95240
1C57	−0.00287	0.90199	0.94427
1C58	−0.03448	0.93334	0.95456
1O18	−0.10338	0.90316	0.95554
1C59	0.00383	0.99564	0.96430
1C60	−0.03039	1.02964	0.97587
1C54	0.07384	1.02679	0.96320
1O17	0.10836	1.08832	0.97316
1C52	0.17447	1.11167	0.97899
1C53	0.19549	1.06895	0.98795
1C51	0.22118	1.17958	0.97526
1O16	0.19777	1.21868	0.96683
1C50	0.28918	1.20405	0.98034
1C49	0.31105	1.16189	0.98901
1C48	0.26381	1.09388	0.99291
1C47	0.28855	1.04871	1.00292
1N6	0.29985	1.06258	1.02558
1C46	0.23684	0.97275	1.00011
1O15	0.19322	0.94308	1.01350
1N7	0.24279	0.94395	0.98295
1C14	0.19868	0.87074	0.97899
1C13	0.23960	0.83143	0.97743
1O3	0.28041	0.84708	0.99550
1C10	0.27860	0.85081	0.95729
1C9	0.25022	0.81170	0.93941
1C8	0.28216	0.83240	0.92016
1C11	0.34053	0.91091	0.95587
1C12	0.37338	0.93237	0.93692
1C7	0.34346	0.89460	0.91913
1O2	0.37548	0.91978	0.90029
1C5	0.35452	0.96051	0.89011
1C4	0.40028	1.00629	0.87569
1O26	0.46288	1.01185	0.87310
1C6	0.29107	0.95618	0.89360
1C1	0.27345	0.99768	0.88239
1C2	0.31857	1.04280	0.86753
1C3	0.38216	1.04759	0.86456
1O1	0.42979	1.09235	0.85037
1C41	0.41718	1.14068	0.84183
1C42	0.39226	1.13084	0.82180
1C43	0.37613	1.17769	0.81287
1C40	0.42810	1.19757	0.85332
1C39	0.41216	1.24391	0.84429
1C38	0.38577	1.23397	0.82426
1C37	0.36075	1.27990	0.81617
1O14	0.34356	1.27343	0.79486
1C67	0.40072	1.31049	0.78111
1C71	0.37311	1.28414	0.75957
1O24	0.42662	1.38135	0.78322
1C70	0.37951	1.40475	0.77739
1C72	0.41911	1.48291	0.77865
1C69	0.35193	1.38130	0.75529
1O25	0.30114	1.40017	0.75125
1C68	0.32092	1.30417	0.75225
1N8	0.25506	1.26782	0.76344
WO1	0.85241	1.02225	0.82485		0.50
WO2	0.92412	0.98784	0.86103		0.50
WO3	0.91112	1.16229	0.87809
WO4	0.02961	1.38054	0.86817
WO5	0.09009	1.27236	0.79614
WO6	0.20907	1.39323	0.78021
WO7	0.39931	0.57133	0.85188		0.50
WO8	0.40123	0.61446	0.80616		0.50
WO9	0.27411	0.66911	0.95026
WO10	0.41594	0.79090	0.94169
WO11	0.51302	0.93156	0.96510
WO12	0.54241	1.06115	0.95123
WO13	0.47116	1.09632	0.97420
WO14	0.38882	0.97887	1.01214
WO15	0.06543	0.83276	1.02178
WO16	0.04522	0.67146	0.97632
WO17	0.11217	0.63378	0.95071
WO18	0.10903	0.51016	0.92451
WO19	0.10465	0.49884	0.88554
WO20	0.84570	1.41026	0.80783		0.50
WO21	0.80939	1.38390	0.85142		0.50
WO22	0.88813	1.15189	0.84471
WO23	0.28378	1.35015	0.96685
WO24	0.41088	1.39961	0.94725
WO25	0.48515	1.30346	0.97073
WO26	0.47481	0.87166	0.89796		0.50
WO27	0.83692	1.33644	0.90308
WO28	0.90036	1.34271	0.86905
WO29	0.19310	1.40032	0.96318
WO30	0.20978	1.46945	0.96133
WO31	0.21841	1.50870	0.94072
WO32	−0.15987	0.98656	0.94323
WO33	−0.05986	0.78076	0.99567
WO34	−0.15072	0.81537	1.00373		0.50
WO35	0.88703	1.32390	0.81745
WO36	0.35890	1.42800	1.00045
WO37	0.10833	1.44686	0.97514
WO38	0.54471	0.98815	0.92016		0.50
WO39	−0.04608	0.90280	0.87919
WO40	0.02441	1.02347	0.89813
WO41	−0.13278	0.72402	0.93003
WO42	0.26155	1.51268	0.98332
WO43	−0.30443	1.15052	0.95395		0.50
IPO2	−0.17521	1.22821	0.96402		0.50
IPC2	−0.23665	1.16821	0.95890		0.50
IPC3	−0.22108	1.12809	0.94293		0.50
IPC1	−0.26412	1.12615	0.97874		0.50

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
1C1	0.1141	0.0582	0.1566	0.0313	−0.0111	0.0126
1C1B	0.1190	0.0685	0.1310	−0.0481	0.0146	0.0008
1C2	0.1505	0.0961	0.1565	0.0250	−0.0060	0.0107
1C2B	0.1325	0.0530	0.1569	−0.0422	0.0003	0.0015
1O2	0.1716	0.0784	0.1752	0.0247	−0.0017	0.0035
1O2B	0.1448	0.0748	0.1890	−0.0253	0.0036	0.0220
1C3	0.1309	0.0724	0.1371	0.0240	−0.0076	−0.0009
1C3B	0.1434	0.0856	0.1492	−0.0419	0.0161	0.0002
1O3	0.1649	0.1121	0.1509	0.0063	−0.0095	0.0149
1O3B	0.1802	0.0697	0.1771	−0.0213	0.0105	−0.0115
1C4	0.1633	0.0287	0.1617	0.0098	−0.0021	0.0064
1C4B	0.1608	0.0686	0.1627	−0.0273	−0.0002	−0.0188
1O4	0.1613	0.0645	0.1447	0.0060	0.0125	0.0057
1O4B	0.2015	0.1466	0.1773	−0.0227	0.0032	−0.0284
1C5	0.1253	0.0710	0.1564	0.0302	−0.0070	−0.0091
1C5B	0.1464	0.0769	0.1607	−0.0272	0.0095	−0.0081
1C6	0.1186	0.0405	0.1635	0.0096	−0.0012	−0.0167
1C6B	0.1669	0.0839	0.1784	−0.0259	−0.0040	−0.0237
1O5	0.1197	0.0354	0.1510	0.0305	−0.0038	−0.0073
1O5B	0.1287	0.0987	0.1550	−0.0526	0.0141	0.0058
2C1	0.0902	0.0362	0.1289	0.0101	−0.0010	−0.0021
2C1B	0.0962	0.0566	0.1336	0.0037	−0.0062	0.0011
2C2	0.0909	0.0499	0.1514	0.0008	0.0010	−0.0012
2C2B	0.1050	0.1183	0.1475	0.0113	0.0011	−0.0049
2C3	0.0962	0.0992	0.1427	0.0046	−0.0019	−0.0104
2C3B	0.1201	0.1412	0.1666	0.0071	−0.0073	−0.0147
2O3	0.1013	0.1366	0.1855	0.0014	−0.0030	−0.0109
2O3B	0.1523	0.1896	0.1941	0.0121	−0.0078	−0.0153
2C4	0.1045	0.0691	0.1399	0.0177	0.0008	−0.0077
2C4B	0.1290	0.1411	0.1597	−0.0031	−0.0142	−0.0080
2O4	0.1333	0.1288	0.1635	0.0136	0.0209	−0.0262
2O4B	0.1566	0.1775	0.1931	−0.0177	−0.0323	−0.0212
2C5	0.1107	0.0538	0.1306	0.0151	0.0008	−0.0147
2C5B	0.1123	0.0886	0.1429	−0.0079	−0.0131	−0.0140
2C6	0.1304	0.0278	0.1389	0.0104	0.0028	0.0045
2C6B	0.1420	0.0469	0.1522	−0.0133	−0.0259	−0.0340
2O6	0.1317	0.0431	0.1389	0.0434	−0.0158	−0.0026
2O6B	0.1071	0.0713	0.1256	−0.0402	0.0161	−0.0120
2O5	0.0966	0.0429	0.1284	0.0196	−0.0096	−0.0001
2O5B	0.0950	0.0757	0.1279	−0.0125	−0.0117	−0.0077
3C1	0.1238	0.0892	0.1609	−0.0139	−0.0111	−0.0084
3C1B	0.1232	0.1136	0.1579	0.0225	0.0048	0.0006
3O1	0.1168	0.0617	0.1589	−0.0216	−0.0110	−0.0029
3O1B	0.1279	0.1294	0.1473	0.0368	0.0004	0.0034
3C2	0.1240	0.0776	0.1720	−0.0170	−0.0084	−0.0177
3C2B	0.1535	0.1155	0.1630	0.0310	−0.0033	−0.0013
3C3	0.1033	0.0901	0.1886	−0.0397	−0.0013	0.0055
3C3B	0.1794	0.1263	0.1739	0.0285	−0.0053	0.0112
3O3	0.1909	0.1101	0.2007	−0.0408	0.0032	0.0142
3O3B	0.1778	0.1429	0.2057	0.0363	−0.0162	0.0239
3C4	0.1066	0.1388	0.1921	−0.0147	−0.0035	0.0034
3C4B	0.1284	0.1165	0.1877	0.0574	−0.0085	0.0099
3O4	0.1178	0.1751	0.2198	−0.0181	−0.0006	−0.0020
3O4B	0.1593	0.1984	0.2264	0.0476	−0.0158	0.0117
3C5	0.1016	0.1330	0.1769	−0.0097	−0.0124	−0.0023
3C5B	0.1375	0.1532	0.1865	0.0390	−0.0019	0.0032
3C6	0.1342	0.1498	0.1792	−0.0157	−0.0161	−0.0050
3C6B	0.1475	0.1874	0.1919	0.0206	0.0052	−0.0022
3O6	0.1843	0.1630	0.2135	−0.0006	−0.0127	−0.0086
3O6B	0.1571	0.2161	0.2177	0.0029	0.0053	−0.0009
3O5	0.1192	0.1098	0.1602	−0.0208	−0.0146	−0.0043
3O5B	0.1070	0.1399	0.1785	0.0403	0.0039	−0.0078
4O3	0.4096	0.4121	0.4052	0.0017	0.0024	−0.0020
4O3B	0.2558	0.2650	0.2627	0.0162	0.0022	−0.0039
4C3	0.4083	0.4188	0.4100	−0.0005	−0.0004	−0.0013
4C3B	0.2305	0.2206	0.2199	0.0135	0.0068	−0.0038
4C2	0.4042	0.4167	0.4096	0.0008	−0.0003	−0.0014
4C2B	0.1994	0.2025	0.1901	0.0140	0.0084	0.0083
4O2	0.4001	0.4054	0.4121	−0.0011	−0.0019	−0.0019
4O2B	0.2124	0.1256	0.1948	0.0198	0.0209	−0.0002
4C1	0.3967	0.4127	0.4037	−0.0010	0.0011	−0.0003
4C1B	0.1661	0.1555	0.1789	0.0200	0.0066	0.0050
4O1	0.3825	0.3775	0.3909	0.0029	−0.0046	−0.0041
4O1B	0.1441	0.1166	0.1513	0.0440	0.0002	−0.0070
4O4	0.4006	0.4101	0.4064	0.0002	0.0000	−0.0004
4O4B	0.1730	0.1702	0.1826	0.0257	−0.0045	0.0140
4C4	0.4081	0.4193	0.4116	−0.0007	−0.0015	−0.0004
4C4B	0.2287	0.2109	0.2320	0.0171	0.0008	0.0018
4C5	0.4163	0.4242	0.4169	−0.0011	−0.0006	0.0011
4C5B	0.2265	0.2437	0.2388	0.0119	0.0039	−0.0024
4O5	0.4251	0.4245	0.4181	−0.0007	−0.0016	0.0043
4O5B	0.2658	0.2690	0.2631	0.0036	−0.0028	−0.0043
2C	0.2620	0.0420	0.1920	0.0374	0.0321	0.0162
2O	0.2689	0.0668	0.2082	0.0364	0.0354	0.0038
2CH3	0.2757	0.0938	0.1961	0.0309	0.0264	0.0081
3N	0.2507	0.0519	0.1740	0.0353	0.0206	0.0142
3CA	0.2347	0.0424	0.1633	0.0342	0.0064	0.0041
3CB	0.2308	0.0583	0.1753	0.0451	0.0077	−0.0005
3CG	0.2665	0.1107	0.2241	0.0324	0.0004	−0.0233
3CD	0.2818	0.1204	0.2706	0.0389	−0.0033	−0.0324
3CE	0.3112	0.2621	0.2905	0.0121	0.0066	−0.0034
3NZ	0.3388	0.3186	0.3213	0.0012	−0.0064	−0.0112
3C	0.2080	0.0368	0.1364	0.0406	0.0023	0.0009
3O	0.2354	0.0473	0.1449	0.0442	−0.0155	0.0112
4N	0.1724	0.0365	0.1397	0.0226	−0.0021	0.0097
4CA	0.1492	0.0316	0.1266	0.0200	−0.0045	0.0016
4CB	0.1338	0.0803	0.1383	0.0358	−0.0028	−0.0019
4C	0.1418	0.0402	0.1218	0.0068	0.0000	−0.0006
4O	0.1664	0.0460	0.1539	−0.0025	−0.0255	−0.0032
5N	0.1131	0.0354	0.1205	0.0047	0.0012	0.0034
5CA	0.1112	0.0380	0.1251	0.0006	0.0015	−0.0015
5CB	0.1173	0.0528	0.1375	−0.0141	0.0016	0.0033
5C	0.0953	0.0402	0.1078	0.0118	0.0075	0.0002
5O	0.0939	0.0552	0.1222	0.0113	0.0001	0.0029
5OXT	0.1036	0.0456	0.1051	0.0050	−0.0008	0.0056
1O19	0.1215	0.1051	0.1194	0.0134	−0.0066	0.0006
1C62	0.1380	0.1119	0.1180	0.0352	0.0036	0.0025
1C63	0.1716	0.1474	0.1324	0.0162	−0.0229	−0.0134
1O20	0.2152	0.1233	0.1736	−0.0116	−0.0312	−0.0082
1C64	0.1560	0.1930	0.1555	0.0160	−0.0219	−0.0133
1O21	0.1786	0.2671	0.2049	−0.0074	−0.0415	−0.0231
1C65	0.1514	0.2073	0.1523	0.0411	−0.0155	−0.0121
1C66	0.1570	0.2378	0.1944	0.0560	−0.0257	−0.0202
1O23	0.1388	0.2584	0.1940	0.0513	−0.0132	−0.0302
1O22	0.1539	0.1460	0.1244	0.0619	−0.0039	−0.0028
1C61	0.1385	0.1156	0.1215	0.0583	0.0036	0.0031
1O8	0.1692	0.1077	0.1205	0.0607	0.0098	0.0050
1C28	0.1727	0.0993	0.1291	0.0741	0.0006	0.0091
1C27	0.1688	0.0882	0.1267	0.0718	0.0117	0.0140
1C25	0.1712	0.0903	0.1207	0.0674	0.0083	0.0177
1C26	0.1632	0.0705	0.1123	0.0546	0.0120	0.0145
1C21	0.1380	0.0719	0.1034	0.0432	0.0072	0.0064
1C22	0.1274	0.1054	0.1396	0.0213	−0.0014	0.0020
1C23	0.1433	0.1541	0.1551	0.0337	0.0057	0.0035
1C24	0.1483	0.1287	0.1378	0.0652	0.0015	0.0039
1O7	0.1603	0.2057	0.1810	0.0740	−0.0049	−0.0089
1C29	0.1689	0.1020	0.1511	0.0665	0.0109	0.0032
1C30	0.1972	0.0900	0.1480	0.0783	0.0112	0.0041
1O9	0.2613	0.0811	0.1680	0.0761	0.0242	0.0056
1C31	0.2036	0.0859	0.1419	0.0733	0.0130	0.0112
1C32	0.1994	0.1049	0.1395	0.0752	0.0089	0.0112
1C33	0.2003	0.1069	0.1376	0.0778	0.0072	0.0174
1C44	0.2137	0.0980	0.1854	0.0745	0.0071	0.0142
1O10	0.2490	0.0924	0.2155	0.0721	0.0120	0.0307
1O11	0.2376	0.1417	0.2028	0.1227	0.0068	0.0264
1C45	0.2405	0.1577	0.2398	0.0790	−0.0047	0.0432
1N2	0.1958	0.0670	0.1363	0.0802	0.0046	0.0037
1C34	0.1693	0.0658	0.1176	0.0589	0.0061	0.0118
1O12	0.1722	0.0967	0.1318	0.0728	0.0064	0.0097
1C35	0.1582	0.0391	0.1230	0.0426	0.0078	−0.0009
1N3	0.1261	0.0387	0.1189	0.0350	−0.0001	0.0105
1C36	0.1248	0.0326	0.1162	0.0261	0.0058	0.0077
1O13	0.1341	0.0390	0.1159	0.0209	0.0066	0.0047
1C20	0.1219	0.0371	0.1137	0.0177	0.0051	0.0088
1N1	0.1065	0.0448	0.1156	0.0162	−0.0010	−0.0001
1C19	0.0863	0.0357	0.1062	0.0065	0.0083	0.0036
1O6	0.1161	0.0358	0.1144	0.0213	−0.0022	0.0002
1C18	0.1015	0.0256	0.1033	0.0036	−0.0061	0.0031
1N5	0.0884	0.0331	0.1096	−0.0032	0.0069	0.0114
1C17	0.1127	0.0323	0.1175	0.0015	0.0053	0.0067
1O5	0.1592	0.0538	0.1098	−0.0289	0.0088	0.0051
1C16	0.1177	0.0471	0.1209	−0.0115	0.0058	0.0040
1N4	0.1192	0.0462	0.1135	0.0033	−0.0004	0.0147
1C15	0.1333	0.0579	0.1180	0.0136	0.0167	0.0103
1O4	0.1720	0.0516	0.1500	−0.0036	−0.0096	0.0289
1C56	0.1026	0.0639	0.1162	−0.0187	0.0098	0.0081
1C55	0.0989	0.0675	0.1212	−0.0052	0.0032	0.0110
1C57	0.1311	0.0920	0.1330	−0.0347	0.0044	−0.0002
1C58	0.1253	0.1214	0.1433	−0.0364	0.0054	0.0075
1O18	0.1316	0.1451	0.2029	−0.0429	0.0206	−0.0230
1C59	0.1031	0.1019	0.1309	−0.0134	0.0042	0.0016
1C60	0.0976	0.1341	0.1613	−0.0142	0.0108	−0.0103
1C54	0.0850	0.0804	0.1208	−0.0118	0.0045	0.0064
1O17	0.0837	0.0839	0.1554	0.0011	0.0082	−0.0171
1C52	0.1027	0.0692	0.1208	0.0119	0.0190	−0.0119
1C53	0.0963	0.0708	0.1247	0.0106	0.0162	−0.0064
1C51	0.1129	0.0610	0.1158	0.0162	0.0126	−0.0006
1O16	0.1195	0.0718	0.1290	0.0165	0.0018	0.0077
1C50	0.1218	0.0659	0.1245	0.0012	0.0043	−0.0034
1C49	0.1094	0.0812	0.1173	−0.0058	0.0039	−0.0053
1C48	0.0962	0.0763	0.1118	0.0023	0.0079	−0.0075
1C47	0.1027	0.0887	0.1175	0.0079	0.0071	−0.0012
1N6	0.1197	0.1098	0.1229	0.0131	0.0029	−0.0045
1C46	0.1196	0.0730	0.1212	0.0146	0.0131	0.0154
1O15	0.1452	0.0858	0.1425	0.0032	0.0314	0.0104
1N7	0.1131	0.0623	0.1178	0.0139	0.0055	0.0154
1C14	0.1431	0.0509	0.1283	0.0179	0.0066	0.0159
1C13	0.1486	0.0670	0.1317	0.0337	0.0045	0.0214
1O3	0.1481	0.0978	0.1306	0.0369	−0.0052	0.0250
1C10	0.1145	0.0581	0.1283	0.0385	0.0008	0.0165
1C9	0.1250	0.0450	0.1386	0.0238	0.0051	0.0201
1C8	0.1267	0.0547	0.1265	0.0297	0.0014	0.0105
1C11	0.1146	0.0641	0.1376	0.0380	0.0044	0.0074
1C12	0.1080	0.0601	0.1431	0.0270	0.0012	0.0157
1C7	0.1061	0.0530	0.1238	0.0239	0.0046	0.0163
1O2	0.1103	0.0549	0.1295	0.0284	0.0062	0.0178
1C5	0.0939	0.0303	0.1173	0.0185	−0.0076	−0.0018
1C4	0.0915	0.0283	0.1190	0.0002	0.0033	−0.0069
1O26	0.0914	0.0437	0.1239	0.0023	0.0012	−0.0037
1C6	0.0942	0.0260	0.1098	0.0068	0.0024	0.0017
1C1	0.0893	0.0257	0.1021	0.0011	0.0027	−0.0052
1C2	0.0913	0.0253	0.1055	0.0004	−0.0014	0.0022
1C3	0.0993	0.0253	0.1018	−0.0003	0.0025	−0.0019
1O1	0.0935	0.0265	0.1267	−0.0006	0.0066	0.0111
1C41	0.1011	0.0272	0.1180	−0.0001	0.0062	0.0131
1C42	0.1109	0.0264	0.1203	0.0005	0.0083	0.0103
1C43	0.1383	0.0263	0.1228	0.0100	0.0101	0.0040
1C40	0.1317	0.0254	0.1236	−0.0024	0.0045	0.0019
1C39	0.1416	0.0253	0.1197	0.0002	0.0042	−0.0004
1C38	0.1400	0.0280	0.1230	0.0144	0.0060	0.0103
1C37	0.1771	0.0327	0.1220	0.0327	0.0052	0.0072
1O14	0.1894	0.0344	0.1144	0.0360	0.0037	0.0113
1C67	0.2269	0.0359	0.1246	0.0236	0.0185	0.0254
1C71	0.2107	0.0579	0.1331	0.0348	0.0018	0.0157
1O24	0.2555	0.0319	0.1534	0.0271	0.0105	0.0221
1C70	0.2493	0.0491	0.1561	0.0444	0.0011	0.0186
1C72	0.2872	0.0363	0.1879	0.0432	0.0024	0.0253
1C69	0.2462	0.0661	0.1645	0.0507	0.0013	0.0235
1O25	0.2686	0.0728	0.1904	0.0843	−0.0173	0.0197
1C68	0.2362	0.0594	0.1502	0.0457	−0.0029	0.0181
1N8	0.2118	0.0576	0.1428	0.0535	−0.0081	0.0053
WO1	0.3028	0.3316	0.3404	−0.0115	0.0043	0.0022
WO2	0.6596	0.6456	0.6578	−0.0001	0.0007	−0.0018
WO3	0.5431	0.5350	0.5377	−0.0058	0.0048	−0.0015
WO4	0.4353	0.4278	0.4503	0.0176	−0.0042	0.0049
WO5	0.6905	0.6957	0.6904	−0.0017	−0.0041	0.0025
WO6	0.4356	0.3965	0.4012	0.0106	−0.0013	0.0021
WO7	0.1762	0.1672	0.2035	0.0305	−0.0197	0.0081
WO8	0.2311	0.1912	0.2258	0.0396	−0.0050	−0.0062
WO9	0.5009	0.4976	0.5223	0.0152	0.0027	0.0087
WO10	0.4034	0.3843	0.4206	0.0064	−0.0092	0.0022
WO11	0.4896	0.4990	0.5078	−0.0080	−0.0012	−0.0032
WO12	0.4052	0.4236	0.4219	−0.0009	−0.0048	−0.0128
WO13	0.1860	0.2755	0.2411	−0.0256	−0.0425	−0.0170
WO14	0.4735	0.4540	0.4665	0.0045	0.0020	0.0010
WO15	0.2472	0.1910	0.2873	−0.0091	0.0330	0.0223
WO16	0.3852	0.2279	0.3626	0.0174	0.0013	0.0541
WO17	0.3618	0.2970	0.3407	0.0075	−0.0117	0.0244
WO18	0.4351	0.3890	0.4165	0.0000	−0.0012	0.0069
WO19	0.4886	0.5198	0.5088	0.0007	−0.0057	−0.0024
WO20	0.2043	0.1064	0.2174	−0.0431	−0.0071	0.0230
WO21	0.2508	0.2271	0.2549	−0.0020	0.0069	−0.0145
WO22	0.2872	0.3324	0.3606	0.0158	−0.0107	−0.0090
WO23	0.1671	0.0930	0.2049	0.0226	0.0396	0.0139
WO24	0.3081	0.2347	0.2901	0.0004	0.0129	−0.0366
WO25	0.3490	0.3258	0.3186	−0.0256	−0.0197	−0.0014
WO26	0.1690	0.1279	0.1711	0.0367	−0.0173	0.0097
WO27	0.3002	0.3035	0.3733	0.0191	−0.0202	0.0015
WO28	0.4074	0.3743	0.4236	−0.0019	−0.0069	−0.0056
WO29	0.1676	0.1264	0.2110	0.0028	0.0094	0.0272
WO30	0.2325	0.0951	0.1353	0.0598	0.0125	−0.0193
WO31	0.3335	0.1850	0.2179	0.0519	0.0161	0.0030
WO32	0.3397	0.3653	0.3775	−0.0181	−0.0009	0.0038
WO33	0.5207	0.4840	0.4953	0.0027	−0.0029	0.0051
WO34	0.3822	0.3672	0.3624	−0.0004	0.0033	−0.0008
WO35	0.5315	0.5324	0.5592	−0.0053	−0.0001	−0.0013
WO36	0.4709	0.4183	0.4182	−0.0272	0.0005	−0.0036
WO37	0.6003	0.5819	0.5868	0.0002	−0.0066	−0.0022
WO38	0.3582	0.3576	0.3493	0.0045	−0.0020	−0.0015
WO39	0.5126	0.5481	0.5118	0.0000	−0.0005	0.0038
WO40	0.4909	0.4799	0.4553	0.0060	0.0107	0.0187
WO41	0.3956	0.1650	0.3375	−0.0068	−0.0038	−0.0296
WO42	0.4324	0.4491	0.4666	−0.0075	0.0045	−0.0077
WO43	0.3124	0.3174	0.3262	−0.0097	0.0027	−0.0060
IPO2	0.1440	0.2262	0.1902	−0.0098	−0.0101	−0.0205
IPC2	0.0351	0.2094	0.1149	−0.0239	−0.0150	−0.0356
IPC3	0.1330	0.1961	0.1777	0.0036	−0.0055	−0.0211
IPC1	0.1850	0.2234	0.1903	−0.0079	−0.0061	−0.0055

References

Nahoum, V., Spector, S. & Loll, P. J. (2009). Acta Cryst. D65, 832–838. Web of Science CrossRef IUCr Journals Google Scholar

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STRUCTURAL
BIOLOGY

ISSN: 2059-7983

Volume 67| Part 6| June 2011| Page 592

https://doi.org/10.1107/S0907444911008262

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addenda and errata\(\def\hfill{\hskip 5em}\def\hfil{\hskip 3em}\def\eqno#1{\hfil {#1}}\)

Structure of ristocetin A in complex with a bacterial cell-wall mimetic. Corrigendum.

Supporting information

References

addenda and errata