Table 3. Data collection and processing.
Values in parentheses are for the outer shell.
| Diffraction source | MX2 beamline, Australian Synchrotron |
| Wavelength (Å) | 0.9537 |
| Temperature (K) | 100 |
| Detector | ADSC Quantum 315 |
| Crystal-to-detector distance (mm) | 270 |
| Rotation range per image (°) | 1 |
| Total rotation range (°) | 360 |
| Exposure time per image (s) | 1 |
| Space group | I2 |
| a, b, c (Å) | 76.4, 95.4, 114.4 |
| α, β, γ (°) | 90, 100.2, 90 |
| Mosaicity (°) | 0.27 |
| Resolution range (Å) | 47.7–2.07 (2.13–2.07) |
| Total No. of reflections | 356994 (27812) |
| No. of unique reflections | 49266 (3794) |
| Completeness (%) | 100 (100) |
| CC1/2 | 0.997 (0.790) |
| Multiplicity | 7.2 (7.3) |
| 〈I/σ(I)〉 | 11.2 (2.6) |
| R p.i.m. | 0.046 (0.327) |
| Overall B factor from Wilson plot (Å2) | 31.0 |