Table 1. Data collection and refinement statistics (molecular replacement).
Each dataset was collected from a single crystal. Values for highest resolution shell are shown in parentheses.
| Parameter | EGFR/erlotinib |
|---|---|
| Data collection | |
| Space group | C2221 |
| Cell dimensions | |
| a, b, c (Å) | 78.0, 114.3, 84.9 |
| α, β, γ (°) | 90, 90, 90 |
| Resolution (Å) | 50–2.75 |
| Rsym | 0.159 (0.494) |
| I/σ | 12.8 (2.1) |
| Completeness (%) | 96.6 (82.1) |
| Redundancy | 4.8 (2.8) |
| Refinement | |
| Resolution (Å) | 50–2.75 |
| Number of reflections | 9413 |
| Rwork/Rfree | 0.23/0.25 |
| Number of atoms | |
| Protein | 2201 |
| Ligand | 29 |
| Water | 34 |
| B-factors | |
| Protein | 47.2 |
| Ligand | 47.5 |
| Water | 43.3 |
| RMSDs | |
| Bond lengths (Å) | 0.009 |
| Bond angles (°) | 1.081 |