TABLE 1.
Data collection statistics
| Parameters | Native value |
|---|---|
| Wavelength (Å) | 0.9792 |
| Cell parameter (Å), P21 | a = 52.86 |
| b = 88.24 | |
| c = 76.67, β = 94.2° | |
| Resolution range (Å) | 88.3-3.15 (3.3-3.15) |
| No. of observed reflectionsa | 41,223 (6,137) |
| No. of unique reflections | 12,236 (1,786) |
| Completeness (%) | 99.8 (99.8) |
| Multiplicity | 3.4 (3.4) |
| Rmergeb | 0.14 (0.68) |
| I/σ(I) | 11 (2.1) |
| Solvent content (%) | 50.17 |
a
The numbers in parentheses refer to the last (highest) resolution shell.
b
Rmerge=ΣhΣi Ihi−<Ih> / Σh,iIhi, where Ihi is the ith observation of the reflection h, while <Ih> is its mean intensity.