Table 1. Data-collection statistics.
Values in parentheses are for the outer shell.
| Beamline | PF-AR NW12A |
| Wavelength (Å) | 1.000 |
| Detector | ADSC Quantum 210 CCD |
| Exposure time (s) | 10 |
| Crystal-to-detector distance (mm) | 301 |
| Oscillation angle (°) | 1.0 |
| Sweep angle (°) | 0–360 |
| Temperature (K) | 100 |
| Resolution (Å) | 30.0–2.6 (2.69–2.60) |
| Space group | P61 or P65 |
| Unit-cell parameters (Å, °) | a = 108.94, b = 108.94, c = 83.79, γ = 120 |
| No. of molecules in unit cell (Z) | 6 |
| Matthews coefficient VM (Å3 Da−1) | 2.69 |
| Solvent content (%) | 54.24 |
| No. of observed reflections | 262611 |
| No. of unique reflections | 16401 (1217) |
| Multiplicity | 16.0 (5.5) |
| Completeness (%) | 93.5 (70.0) |
| Rmerge† (%) | 6.8 (45.3) |
| 〈I/σ(I)〉 | 44.3 (1.9) |
R
merge =
, where Ii(hkl) is the observed intensity and 〈I(hkl)〉 is the mean value of Ii(hkl).