Table 1.
Summary of crystallographic analysis
| Data collection | |
| Space group | P1 21 1 |
| a, b, c (Å) | 91.98, 83.98, 115.52 |
| α, β, γ (°) | 90.00, 96.61, 90.00 |
| X-ray source | Diamond I03 |
| Wavelength (Å) | 0.9790 |
| Resolution range (Å) | 47.40–2.60 (2.74–2.60) |
| No. unique reflections | 53,683 (7,804) |
| Completeness (%) | 99.4 (99.6) |
| Redundancy | 3.6 (3.7) |
| Rmerge (%) | 9 (50) |
| I/σI | 10.1 (2.7) |
| Phasing (figures of merit) | |
| Before density modification | 0.26 |
| After density modification | 0.67 |
| Refinement | |
| Resolution range (Å) | 47.4–2.6 |
| Rwork/Rfree (%) | 19.95/25.08 |
| No. protein molecules; amino acids; waters; hetero molecules | 2; 1,278; 208; 25 |
| Mean B-factors (Å2) | 48.78 |
| Wilson B-factor (Å2) | 42.06 |
| r.m.s. bond lengths (Å) | 0.004 |
| r.m.s. bond angles (°) | 0.885 |
| MolProbity analysis | |
| All-atom clash-score | 25.27 |
| Poor rotamers (%) | 6.03 |
| Ramachandran outliers (%) | 0.00 |
| Ramachandran favored (%) | 93.97 |
| MolProbity score | 2.20 |
Values in parentheses are for the highest-resolution shell.