Table 2. Data-collection and processing statistics.
Values in parentheses are for the outer shell.
| Diffraction source | Rigaku RU-200 rotating anode |
| Wavelength (Å) | 1.5418 |
| Temperature (K) | 293 |
| Detector | 180 mm MAR Research image plate |
| Crystal-to-detector distance (mm) | 120 |
| Rotation range per image (°) | 1.5 |
| Total rotation range (°) | 129 |
| Exposure time per image (s) | 240 |
| Space group | P43212 |
| Unit-cell parameters (Å) | a = b = 37.16, c = 114.98 |
| Mosaicity (°) | 0.48 |
| Resolution range (Å) | 35.36–2.50 (2.64–2.50) |
| Total No. of reflections | 15197 |
| No. of unique reflections | 3127 |
| Completeness (%) | 99.0 (100) |
| Multiplicity | 4.9 (5.0) |
| 〈I/σ(I)〉 | 5.8 (3.1) |
| R r.i.m. † | 0.111 (0.235) |
| Overall B factor from Wilson plot (Å2) | 30.2 |
Estimated R r.i.m. = R merge[N/(N − 1)]1/2, where N is the data multiplicity.