Table 2. Structure solution and refinement.
Values in parentheses are for the outer shell.
| Resolution range (Å) | 39.80–2.30 (2.36–2.30) |
| Completeness (%) | 99.9 (100.0) |
| No. of reflections, working set | 15586 |
| No. of reflections, test set | 832 |
| Final R cryst (%) | 18.5 (25.4) |
| Final R free (%) | 26.6 (38.1) |
| No. of non-H atoms | |
| Protein | 2862 |
| Water | 93 |
| Total | 2955 |
| R.m.s. deviations | |
| Bonds (Å) | 0.016 |
| Angles (°) | 1.764 |
| Average B factors (Å2) | |
| Protein | 31.3 |
| Water | 28.7 |
| Ramachandran plot | |
| Most favoured (%) | 86.7 |
| Additionally allowed (%) | 12.0 |
| Generously allowed (%) | 1.3 |