Table 1.
Statistics for X-ray crystallographic data reduction and refinement
| Native | |
|---|---|
| Data collection | |
| Beamline | I04-1 |
| Wavelength (Å) | 0.91587 |
| Space group | P1 |
| Unit cell | a = 69.5 Å, b = 74.0 Å, c = 106.5 Å |
| α = 91.3°, β = 91.8°,γ = 117.6° | |
| Resolution | 61.5–1.9 (1.94–1.9) Å |
| Reflections | 388 684 (19 110) |
| Unique reflections | 144 175 (7081) |
| R meas (%) | 7.6 (138.7) |
| CC (1/2) | 0.998 (0.552) |
| Completeness (%) | 98.0 (97.3) |
| Mean I/σI | 7.3 (0.8) |
| Multiplicity | 2.7 |
| Refinement | |
| R work/Rfree | 20.5%/22.4% |
| RMS bonds | 0.004 |
| RMS angles | 0.656 |
| Ramachandran | |
| Allowed | 98% |
| Partially allowed | 2% |
| Disallowed | 0 |
| Total number of atoms | 13 015 |
| Protein atoms | 12 049 |
| Water/ligands | 606 |