Improving the accuracy and resolution of neutron crystallographic data by three-dimensional profile fitting of Bragg peaks in reciprocal space

Sullivan, B.; Archibald, R.; Langan, P.S.; Dobbek, H.; Bommer, M.; McFeeters, R.L.; Coates, L.; Wang, X.P.; Gallmeier, F.; Carpenter, J.M.; Lynch, V.; Langan, P.

doi:10.1107/S2059798318013347

Acta Crystallographica Section D
Acta Crystallographica
Section D STRUCTURAL BIOLOGY

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Figure 6
Shell-by-shell refinement statistics for each data set. CC values are shown on the left and R values on the right. From these plots it is clear that profile fitting has the largest effect on high-resolution data. Values are given in Supplementary Tables S6, S7 and S8.

STRUCTURAL
BIOLOGY

ISSN: 2059-7983

Volume 74| Part 11| November 2018| Pages 1085-1095

https://doi.org/10.1107/S2059798318013347

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