Table 3. Data collection and processing.
Diffraction source | MX2 beamline, Australian Synchrotron (Aragão et al., 2018 ▸) |
Wavelength (Å) | 0.954 |
Temperature (K) | 100 |
Detector | ADSC Quantum 315r |
Crystal-to-detector distance (mm) | 400 |
Rotation range per image (°) | 0.5 |
Total rotation range (°) | 180 |
Exposure time per image (s) | 0.5 |
Space group | P21 |
a, b, c (Å) | 96.75, 172.67, 135.43 |
α, β, γ (°) | 90, 91.05, 90 |
Mosaicity (°) | 0.21 |
Resolution range (Å) | 50–2.56 (2.60–2.56) |
Total No. of reflections | 531768 |
No. of unique reflections | 141364 |
Completeness (%) | 98.9 (84.1) |
Multiplicity | 3.8 (3.4) |
〈I/σ(I)〉 | 8.7 (1.5) |
R p.i.m. (%) | 6.2 (39.0) |
CC1/2 | 0.994 (0.641) |
Overall B factor from Wilson plot (Å2) | 39.3 |