Table 1. X-ray diffraction data statistics.
Values in parentheses are for the highest resolution shell. The data set was collected on the A1 beamline at CHESS.
| Wavelength (Å) | 0.9789 |
| Space group | P63 |
| Unit-cell parameters (Å) | a = b = 196.80, c = 156.46 |
| Total No. of reflections | 75640 |
| No. of unique reflections | 38980 (3863) |
| Resolution (Å) | 30–2.9 (3.0–2.9) |
| Completeness (%) | 99.3 (99.4) |
| 〈I/σ(I)〉 | 21.8 (1.4) |
| Redundancy | 14.9 (14.0) |
| Molecules per ASU | 2 |
| Rmerge† (%) | 11.4 (57.2) |
| Solvent content | 0.671 |
| Matthews coefficient VM (Å3 Da−1) | 3.28 |
R
merge =
, where Ii(hkl) and 〈I(hkl)〉 represent the diffraction intensity values of the individual measurements and the corresponding mean values.