Table 1.
Data collection and refinement statistics
| PDB code | 6IQ6 |
|---|---|
| Data collection | |
| Wavelength (Å) | 0.97932 |
| Space group | P21 |
| Cell dimensions | |
| a, b, c (Å) | 71.6, 108.5, 175.8 |
| α, β, σ (°) | 90.0, 96.4, 90.0 |
| Resolution (Å) | 40.5-2.3 (2.33–2.29)a |
| Total reflections | 630779 |
| Rmerge | 0.118 (0.576)a |
| I/σI | 9.0 (2.4)a |
| Completeness (%) | 99.8 (96.4)a |
| Redundancy | 5.2 (4.3)a |
| Refinement | |
| Resolution (Å) | 40.5-2.3 (2.33–2.29)a |
| Unique reflections | 120651 (6121)a |
| Rwork/Rfree | 0.2153/0.2551 |
| Total No. of atoms | 20298 |
| Protein | 20184 |
| Ligand/ion | 45 |
| Water | 69 |
| B factors | |
| Protein | 35.6 |
| Water | 23 |
| r.m.s.d. | |
| Bond lengths (Å) | 0.0083 |
| Bond angles (°) | 1.397 |
| Ramachandran statistics | |
| Most favoured (%) | 94.3 |
| Allowed (%) | 5.1 |
| Outlier (%) | 0.64 |
a
Values in parentheses are for the highest-resolution shell.