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. 2020 Apr 1;76(Pt 4):168–174. doi: 10.1107/S2053230X20004124

Table 4. Structure refinement.

Resolution range (Å) 39–2.1 (2.17–2.10)
Completeness (%) 99.9
σ Cutoff F > 1.370σ(F)
No. of reflections, working set 24872 (2303)
No. of reflections, test set 1998 (185)
Final R cryst 0.19 (0.26)
Final R free 0.21 (0.28)
No. of non-H atoms
 Total 2993
 Protein 2824
 Ligand 0
 Water 169
 Total 2993
R.m.s. deviations
 Bonds (Å) 0.01
 Angles (°) 0.26
Average B factors (Å2)
 Overall 34.77
 Protein 34.3
 Water 43.2
Ramachandran plot
 Most favored (%) 99.43
 Allowed (%) 0.57