Table 1. Data collection and refinement statistics.
| Data collection | |
|---|---|
| Space group | C2 |
| Cell dimensions: | |
| a (Å) | 166.862 |
| b (Å) | 186.739 |
| c (Å) | 108.661 |
| β (°) | 120.24 |
| Resolution (Å)* | 50–2.8 (2.85–2.80) |
| Unique reflections | 67551 |
| Rmerge (%)* | 8.3 (45.3) |
| I /σ(I) | 18.1 (2.2) |
| Completeness (%) | 95.0 (87.1) |
| Redundancy | 2.9 (2.1) |
| Temperature (K) | 100 |
| Mosaicity (°) | 0.22–0.49 |
| Refinement | |
| Resolution (Å) | 41.9–2.9 (3.08–2.9) |
| No. reflections | 60890 |
| Rwork / Rfree | 0.225/0.267 |
| No. atoms/B-factors (Å2) | |
| Protein | 10758/58.2 |
| Ions | 40/60.3 |
| Water | 100/27.6 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.009 |
| Bond angles (°) | 1.4 |
| Ramachandran plot | |
| Favored (%) | 81.1 |
| Allowed (%) | 18.0 |
| Generously allowed (%) | 0.5 |
| Disallowed | 0.4 |
*
Values in parentheses are for the last shell.