Table 1. Data-collection statistics.
Values in parentheses are for the highest resolution shell.
| Wavelength (Å) | 1.23986 |
| Space group | P6122 |
| Resolution range (Å) | 50.0–1.7 (1.76–1.7) |
| Observed reflections | 479682 |
| Unique reflections | 23645 |
| Redundancy | 20.3 (7.6) |
| Completeness (%) | 99.1 (94.8) |
| Rmerge† (%) | 6.6 (28.7) |
| I/σ(I) | 16.0 (5.5) |
R
merge =
, where Ii(hkl) is the observed intensity, 〈I(hkl)〉 is the average intensity and i counts through all symmetry-related reflections.