Table 1. X-ray diffraction data statistics.
Values in parentheses are for the highest resolution shell.
| Space group | P6422 or P6222 |
| Unit-cell parameters (Å, °) | a = b = 139.9, c = 100.2, α = β = 90, γ = 120 |
| Resolution (Å) | 50–1.91 (1.94–1.91) |
| Total reflections | 836117 (7928) |
| Unique reflections | 40176 (1802) |
| Average redundancy | 19.6 (4.4) |
| Completeness (%) | 94.3 (68.0) |
| Rmerge† (%) | 5.9 (27.9) |
| 〈I/σ(I)〉 | 77.5 (4.7) |
| Solvent content (%) | 69.9 |
| Matthews coefficient (Å3 Da−1) | 4.09 |
| Molecules per ASU | 1 |
†
R
merge = 
, where Ii(hkl) is the ith intensity measurement of reflection hkl and 〈I(hkl)〉 is its average.