Table 1. Data collection and refinement statistics of OPHC2 structures.
Data collection | |
PDB ID | 4LE6 |
Beamline | PROXIMA-1 |
Wavelength (Å) | 0.980 |
Detector | PILATUS 6M |
Oscillation (°) | 0.15 |
Number of frames | 1200 |
Resolution (Å) (last bin) | 2.1 (2.2–2.1) |
Space group | C2 |
Unit-cell parameters (Å) | a = 109.9, b = 63.8,c = 221.3, β = 101.8 |
No. of observed reflections (last bin) | 252270 (24317) |
No. of unique reflections (last bin) | 82530 (9469) |
Completeness (%)(last bin) | 93.7 (82.6) |
Rmeas (%) (last bin) | 6.5 (50.1) |
I/σ(I) (last bin) | 13.67 (3.07) |
Redundancy (last bin) | 3.06 (2.57) |
Mosaicity (°) | 0.508 |
Refinement statistics | |
Rfree/Rwork | 20.99/17.32 |
No. of total model atoms | 19946 |
Ramachandran favored | 93.5 |
Ramachandran outliers | 0.8 |
Generously allowed rotamers | 5.7 |
Rmsd from ideal | |
Bond lengths (Å) | 0.008 |
Bond angles (°) | 1.111 |