Table 1. X-ray diffraction data and processing statistics.
Values in parentheses are for the highest resolution shell.
| Space group | P212121 |
| Unit-cell parameters (Å) | a = 66.1, b = 74.1, c = 98.6 |
| Resolution range (Å) | 50.00–2.20 (2.28–2.20) |
| Total No. of reflections | 197524 |
| No. of unique reflections | 24678 |
| Completeness (%) | 99.5 (98.9) |
| Average I/σ(I) | 27.4 (7.5) |
| Rmerge† (%) | 8.3 (28.6) |
| Average multiplicity | 7.9 (7.9) |
†
R
merge = 
, where Ii(hkl) is the observed intensity and 〈I(hkl)〉 is the average intensity from multiple measurements.