Table 1 X-ray data collection, phasing and refinement statistics
Data collection | Se-Peak |
|---|---|
Wavelength (Å) | 0.97926 |
Space group | C2 |
Cell dimension | a = 152.039 Å |
b = 65.814 Å | |
c = 98.626 Å | |
β = 129.948° | |
Resolution (Å) | 50.0-2.15 (2.23-2.15) |
Total observations | 298063 |
Unique observations | 78615 |
I/SigI | 10.9 (2.1) |
Redundancy | 3.8 (3.8) |
Completeness | 99.2 (99.5) |
Rsyma (%) | 8.2 (34.6) |
SAD phasing | |
Resolution | 50.0-2.2 |
No. of Se sitesb | 14 |
FOMSOLVEc | 0.3 |
FOMRESOLVEd | 0.64 |
Refinement | |
Resolution (Å) | 50.0-2.15 |
No. of protein atoms | 4152 |
No. of waters | 460 |
Rwork (%) | 21.3 |
Rfree(%) | 26.1 |
RMSD bond length (Å) | 0.010 |
RMSD bond angles (°) | 1.21 |
Ramachandran plot | |
Most favoured (%) | 98.3 |
Additionally allowed (%) | 1.5 |
Generously allowed (%) | 0.2 |
Disallowed (%) | 0.0 |