TABLE 2:
Refinement statistics.
Resolution range (Å) | 40.95−1.89 (1.97−1.89) |
No. of reflections Rwork/Rfree | 23,025/1152 (2211/116) |
Data completeness (%) | 95.06 (76) |
Atoms (non-H protein/solvent) | 2197/161 |
Rwork (%) | 17.3 (21.4) |
Rfree (%) | 21.2 (29.3) |
rmsd bond lengths (Å) | 0.007 |
rmsd bond angles (°) | 0.810 |
Mean B-value (Å2; non-H protein/solvent) | 25.7/31.1 |
Ramachandran plot (%) (favored/additional/disallowed) | 98.5/1.5/0 |
Maximum likelihood coordinate error (Å) | 0.20 |
Missing residues, protein | 1–27, 47–63, 243–251 |
MolProbity Clashscore | 4.02 (98th percentile) |
MolProbity overall score | 1.19 (99th percentile) |