Table 1.
Data collection and refinement statistics (molecular replacement).
| LeuTW8A | |
|---|---|
| Data collection | |
| Space group | P1 |
| Cell dimensions | |
| a, b, c (Å) | 77.85, 83.99, 86.94 |
| α, β, γ (°) | 65.38, 89.77, 64.56 |
| Resolution (Å) | 2.6 (2.69–2.60)a |
| Rsym or Rmerge | 20.1 (97.3) |
| I / σI | 15.6 (1.22) |
| Completeness (%) | 98.7 (98.1) |
| Redundancy | 6.2 (6.1) |
| Refinement | |
| Resolution (Å) | 43.1–2.6 |
| No. reflections | 53651 (5345) |
| Rwork/Rfree | 21.1/23.4 |
| No. atoms | 7925 |
| Protein | 7899 |
| Ligand/ion | 4 |
| Water | 22 |
| B-factors (Å2) | |
| Protein | 81.2 |
| Ligand/ion | 72.4 |
| Water | 58.3 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.002 |
| Bond angles (°) | 0.49 |
Values in parentheses are for highest-resolution shell.
aData were collected from a single crystal.