Table I. Crystallographic data collection and refinement statistics.
| Data Collection and Refinement | |
| Data collection | |
| Space group | P212121 |
| Unit cell a, b, c, | 45.849, 65.857, 170.867 |
| α, β, γ | 90, 90, 90 |
| Resolution | 30.0–1.80 |
| Highest resolution shell | (1.9–1.8) |
| Rsym | 6.2% (19.6%) |
| Completeness | 97% (91%) |
| I/σ (I) | 22.6 (5.2) |
| Refinement | |
| Resolution range (A) | 28.24–1.8 |
| No. reflections | 340.949 |
| No. unique reflections | 47.524 |
| Rwork (%) | 17.386 |
| Rfree (%) | 21.760 |
| No. atoms | 4,170 |
| Protein | 3,720 |
| Ligand | 21 |
| Solvent | 475 |
| R.m.s. deviations | |
| Bond length | 0.02 |
| Angles | 1.655 |