Table 1. Crystal data and data-collection statistics.
Values in parentheses are for the outer shell.
| Space group | P21 |
| Unit-cell parameters (Å, °) | a = 73.63, b = 101.38, c = 76.09, α = 90, β = 109.0, γ = 90 |
| Wavelength (Å) | 0.983970 |
| Resolution range (Å) | 41.45–2.25 (2.37–2.25) |
| Completeness (%) | 99.99 (100) |
| Observed reflections | 187273 (27345) |
| Unique reflections | 50220 (7326) |
| 〈I/σ(I)〉 | 4.4 (1.3) |
| Multiplicity | 3.7 (3.7) |
| Rmerge† | 0.121 (0.462) |
R
merge =
.