Refinement statistics. For the joint X-ray–neutron refinements, statistics for both X-ray and neutron data are shown. All crystals had the space group I222.
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https://figshare.com/articles/dataset/_Refinement_statistics_For_the_joint_X_ray_8211_neutron_refinements_statistics_for_both_X_ray_and_neutron_data_are_shown_All_crystals_had_the_space_group_I222_/910991
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资源简介：
aHighest resolution shell is shown in parenthesis.
bRwork = ∑hkl(|Fo(hkl)|–|Fc(hkl)|)/∑hkl|Fo(hkl)| for F(hkl) not belonging to the test set (5%);
Rfree = ∑hkl(|Fo(hkl)|–|Fc(hkl)|)/∑hkl|Fo(hkl)| for F(hkl) in the test set (5%).
cIncluding hydrogen bond restraints.
创建时间：
2014-01-23
