Table 1. Data collection and refinement statistics.
| Native | Phasing | |
|---|---|---|
| Data collection | ||
| Space group | I4122 | I4122 |
| Cell dimensions | ||
| a, b, c (Å) | 167.23, 167.23, 63.46 | 168.11, 168.11, 63.65 |
| α, β, γ (°) | 90, 90, 90 | 90, 90, 90 |
| Wavelength (Å) | 1.000 | 1.738 |
| Resolution (Å) | 20.0–1.95 (2.00–1.95) | 20.0–2.50 (2.56–2.50) |
| Rmeas | 0.067 (1.168) | 0.010 (0.850) |
| I/σI | 22.83 (2.39) | 22.43 (4.54) |
| Completeness (%) | 97.8 (99.0) | 99.1 (97.6) |
| Multiplicity | 11.2 (13.8) | 14.9 (15.2) |
| CC1/2 | 100 (81.8) | 99.9 (93.5) |
| Refinement | ||
| Resolution (Å) | 19.72–1.95 | |
| Number of reflections | 32,298 (2,384) | |
| Rwork/Rfree | 0.1834/0.2123 | |
| Number of atoms | ||
| Protein | 1,776 | |
| Ligand/ion | 86 | |
| Water | 109 | |
| B-factors | ||
| Protein | 54.6 | |
| Ligand/ion | 42.9 | |
| Water | 46.6 | |
| R.M.S deviations | ||
| Bond lengths (Å) | 0.008 | |
| Bond angles (°) | 1.164 | |
*Highest resolution shell is shown in parenthesis.