Table 1. Data-collection statistics.
Values in parentheses are for the last resolution shell.
| Source | Beamline 4A, PLS |
| Wavelength (Å) | 0.96418 |
| Resolution range (Å) | 55.8–2.0 |
| Space group | P61 |
| Unit-cell parameters (Å) | |
| a = b | 64.4 |
| c | 36.5 |
| Total No. of reflections | 51450 |
| No. of unique reflections | 6225 |
| Completeness (%) | 99.8 (100.0) |
| Molecules per asymmetric unit | 1 |
| VM (Å3 Da−1) | 2.05 |
| Solvent content (%) | 39.9 |
| Average I/σ(I) | 12.3 (2.8) |
| Rmerge† (%) | 8.4 (63.0) |
R
merge =
, where I
i(hkl) is the intensity of reflection hkl,
is the sum over all reflections,
is the sum over i measurements of reflection hkl and 〈I(hkl)〉 is the weighted average intensity of all observations i of reflection hkl.