Table 4 Data collection, phasing and refinement statistics.
Data collection | |
|---|---|
Wavelength (Å) | 1.000 |
Space group | P21 |
Cell dimensions | |
a, b, c (Å) | 48.4, 41.8, 81.7 |
α, β, γ (°) | 90, 91.9, 90 |
Resolution (Å)* | 42.22–1.67 (1.73–1.67) |
Rsym* | 0.127 (0.609) |
I/σI* | 11.6 (2.04) |
Completeness (%)* | 99.34 (94.21) |
Redundancy* | 7.0 (3.9) |
CC1/2 (%)* | 99.4 (70.8) |
Refinement | |
Resolution (Å) | 1.67 |
No. reflections | 37934 |
Rwork/Rfree | 20.5/23.8 |
No. atoms | |
Protein | 2883 |
Ligands | 22 |
Solvent | 170 |
B-factors | |
Protein | 13.2 |
Ligands | 12.6 |
Solvent | 27.0 |
R.m.s. deviations | |
Bond lengths (Å) | 0.024 |
Bond angles (°) | 1.8 |
Ramachandran plot | |
Favoured (%) | 99.15 |
Allowed (%) | 0.85 |
Outliers (%) | 0 |