TABLE 2.
Data collection and refinement statistics
| Data collection | Apo-ROP5BI (platinum) | Apo-ROP5BI native | ROP5BI:ATP |
|---|---|---|---|
| Space group | P21212 | P21212 | P21212 |
| Cell dimensions | |||
| a, b, c (Å) | 116.98, 69.83, 43.30 | 117.34, 70.55, 43.01 | 123.36, 69.33, 43.39 |
| α, β, γ (°) | 90, 90, 90 | 90, 90, 90 | 90, 90, 90 |
| Resolution (Å) | 2.05 | 1.90 | 1.72 |
| Rsym | 8.5 (53.2) | 5.4 (48.6) | 7.2 (54.0) |
| I/σI | 24.8 (2.1) | 42.9 (3.4) | 34.2 (2.9) |
| Completeness (%) | 97.8 (85.0) | 98.7 (88.7) | 98.8 (89.0) |
| Redundancy | 12.5 (5.1) | 12.8 (6.5) | 13.9 (9.3) |
| Refinement | |||
| Resolution (Å) | 36.7–1.90 | 30.2–1.72 | |
| No. reflections | 27,733 | 39,069 | |
| Rwork/Rfree | 0.209/0.261 | 0.179/0.210 | |
| No. atoms | |||
| Protein | 2675 | 2741 | |
| Ligand/ion | 16 (4 EDO) | 40 (1 ATP, 2 Mg, 1 MLI) | |
| Water | 160 | 276 | |
| B-factors | |||
| Protein | 41.7 | 29.9 | |
| Ligand/ion | 46.3 | 21.4 | |
| Water | 49.3 | 39.2 | |
| Root mean square deviations | |||
| Bond lengths (Å) | 0.019 | 0.017 | |
| Bond angles (°) | 1.585 | 1.707 | |