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. 2019 May 10;75(Pt 6):399–404. doi: 10.1107/S2053230X19005612

Table 2. Structure solution and refinement.

Values in parentheses are for the outer shell.

Resolution range (Å) 50.00–2.69 (2.76–2.69)
Completeness (%) 98.5 (94.4)
No. of reflections, working set 26963 (2013)
No. of reflections, test set 1517 (81)
Final R cryst 0.145 (0.219)
Final R free 0.211 (0.289)
Cruickshank DPI 0.4008
No. of non-H atoms
 Protein 5341
 Ions 7
 Other ligands 146
 Water 222
 Total 5716
R.m.s. deviations
 Bonds (Å) 0.0142
 Angles (°) 1.7663
Average B factors (Å2)
 Protein, chain A 38.41
 Protein, chain B 41.06
 Galactobiose, chain A 44.05
 Galactobiose, chain B 42.95
 Glycosylation, chain A 56.97
 Glycosylation, chain B 58.03
 Ions 64.93
 Other ligands 71.24
 Water 35.41
Ramachandran plot
 Most favoured (%) 96.37
 Allowed (%) 3.63

The Ramachandran plot was generated using dynarama in Coot (Emsley et al., 2010).