Table 1. Data collection and refinement statistics.
| PDB ID: 5BON | |
|---|---|
| Data collection | |
| Space group | P1 |
| Cell dimensions | |
| a, b, c (Å) | 60.8, 71.7, 82.8 |
| α, β, γ (°) | 90.1, 90.0, 73.08 |
| Resolution (Å) | 47.5–1.8 (1.9-1.8) |
| Rsym or Rmerge | 4.9 (74.7) |
| I/σI | 12.95 (1.4) |
| Completeness (%) | 95.8 (93.9) |
| Redundancy | 1.8 (1.7) |
| Refinement | |
| Resolution (Å) | 47.5–1.8 |
| No. of reflections | 118,828 |
| Rwork/Rfree | 19.2/22.0 |
| No. of atoms | |
| Protein | 10,053 |
| Ligand/ion | 31 |
| Water | 1,013 |
| B-factors | |
| Protein | 36.7 |
| Ligand/ion | 33.0 |
| Water | 40.8 |
| R.m.s.d. | |
| Bond lengths (Å) | 0.004 |
| Bond angles (°) | 0.93 |
R.m.s.d., root mean squared deviation.
Values in parentheses are for highest-resolution shell. A single crystal was used for data collection and structure refinement.