Table 2:
Data collection and refinement statistics
| PP1α7–300: KNL123–80a | |
|---|---|
| Protein | |
| Organism | Homo sapiens |
| PDBID | 6CZO |
| Data collection | |
| Space group | P42212 |
| Cell dimensions | |
| a, b, c (Å) | 138.0, 138.0, 118.4 |
| α, β, γ (°) | 90.0, 90.0, 90.0 |
| Resolution (Å) | 50.0 − 2.95 (3.00 − 2.95) |
| Rmerge | 8.9 (66.5) |
| I/I | 29.2 (4.4) |
| Completeness (%) | 100.0 (100.0) |
| Redundancy | 7.9 (8.1) |
| Refinement | |
| Resolution (Å) | 45.13 − 2.95 (3.06 − 2.95) |
| No. reflections | 24763 |
| Rwork / Rfree | 0.17 (0.0.23)/0.21 (0.32) |
| No. atoms | |
| Protein | 5001 |
| Ligand/ion | 14 |
| Water | 61 |
| Average B-factor (Å2) | |
| Protein | 65.8 |
| Ligand | 63.9 |
| Water | 62.2 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.004 |
| Bond angles (°) | 0.615 |
| Ramachandran | |
| Outliers (%) | 0.3 |
| Allowed (%) | 5.7 |
| Favored (%) | 94.0 |
| Clashscore | 3.43 |
a
Data was collected from a single crystal
*
Values in parentheses are for highest-resolution shell.