Table 1. Statistics for crystallographic structure determination.
Values in parentheses are outer shell data.
| Parameters | |
|---|---|
| Data collection details | |
| Data collection site | In house |
| Detector | MAR345 |
| Wavelength (Å) | 1.5418 |
| Resolution range (Å) | 30.0–2.3 (2.38–2.30) |
| Redundancy | 8.6 (8.0) |
| Completeness (%) | 100.0 (100.0) |
| Average I/σ(I) | 18.23 (2.9) |
| Rmerge* | 11.9 (69.5) |
| Refinement statistics | |
| Resolution range (Å) | 30–2.31 (2.37–2.31) |
| R-factor (Rwork/Rfree)† | 24.5/28.8 |
| rms bond length deviation (Å) | 0.009 |
| rms bond angle deviation (°) | 1.27 |
| Mean B-factor (Å2)‡ | 32.3/35.3/33.7 |
*Rmerge=Σ|I−〈I〉|/Σ〈I〉.
†R-factor=Σ|Fo−Fc|/ΣFo.
‡Main chain/side chain and water/all atoms.