Table 2.
X-ray data collection and refinement statistics
| Protein name, PDB ID | Spc98NHD, (PDB:8QRY) |
|---|---|
| Data collection | |
| Space group | P212121 |
| Cell dimensions | |
| a, b, c (Å) | 28.3, 45.3, 65.6 |
| α, β, γ (°) | 90.0, 90.0, 90.0 |
| Resolution (Å) | 65.6-1.87 (1.9–1.87)a |
| Rsym | 0.10 (0.35) |
| I/σI | 8.7 (0.9) |
| Completeness (%) | 99.2 (78.8) |
| Redundancy | 3.3 (2.5) |
| Refinement | |
| Resolution (Å) | 37.3-1.87 |
| Number of reflections | 7,294 |
| Rwork/Rfree | 0.24/0.30 |
| Number of atoms | |
| Protein | 762 |
| Ligand/ion | – |
| Waters | 44 |
| B factors (Å2) | |
| Protein | 21.5 |
| Water | 23.5 |
| Root mean square deviations | |
| Bond lengths (Å) | 0.008 |
| Bond angles (°) | 1.045 |
One crystal was used in this dataset.
aValues in parentheses are for highest-resolution shell.