Table 3.
Data collection and structure refinement statistics
The data were collected from a single crystal. Values in parentheses are for the highest-resolution shell.
| SHP2/T507K | |
|---|---|
| Data collection | |
| Space group | P21212 |
| Cell dimensions | |
| a, b, c (Å) | 54.699, 203.176, 44.366 |
| α, β, γ (°) | 90.0, 90.0, 90.0 |
| Resolution (Å) | 2.25 |
| Total observations | 105,858 |
| Unique observations | 23,674 |
| Completeness (%) | 95.7 (93.8) |
| Redundancy | 4.5 (4.0) |
| 〈I〉/σ | 12.7 (1.5) |
| Rmerge (%) | 14.0 (81.1) |
| Structure refinement | |
| Resolution (Å) | 2.25 |
| Rwork/Rfree | 0.198/0.262 |
| RMSD bond lengths (Å) | 0.008 |
| RMSD bond angles (°) | 1.005 |
| Ramachandran plot (%) | |
| Most favored | 87.4 |
| Additionally allowed | 11.0 |
| Generously allowed | 1.1 |
| Disallowed | 0.5 |