Table 1.
Data collection and refinement statistics
| Inhibitor 1 complex | |
| Data collection | |
| Space group | P212121 |
| Cell dimensions | |
| a, b, c (Å) | 91.9, 110.5, 137.2 |
| α, β, γ (°) | 90, 90, 90 |
| Resolution (Å) | 76.4-2.73 (2.81-2.73) |
| Rsym | 0.088 (0.464) |
| I/σI | 17.2 (4.6) |
| Completeness (%) | 99.8 (100.0) |
| Redundancy | 4.5 (4.6) |
| Refinement | |
| Resolution (Å) | 76.4 − 2.73 |
| No. reflections | 37797 |
| Rwork/Rfree | 0.178/0.231 |
| No. atoms | |
| Protein | 9522 |
| Ligand/ion | 124 |
| Water | 202 |
| B-factors | |
| Protein | 55.5 |
| Ligand/ion | 50.1 |
| Water | 41.1 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.010 |
| Bond angles (°) | 1.19 |
Values in parentheses are for highest-resolution shell.