TABLE 1.
X-ray data collection and refinement statistics
| Data collectiona | |
| Environment | ADSC detector, ESRF, beamline ID29 |
| Wavelength | 1.072 Å |
| Cell dimensions (Å, °) | a = 68.51, b = 68.51, c = 28.51, α = β = γ = 90 |
| Resolution (Å) | 68.51-1.76 (1.82-1.76) |
| Space group | P43 |
| Unique reflections | 12817 |
| Average multiplicity | 3.8 (2.6) |
| Completeness (%) | 96.9 (86.8) |
| Rmergeb | 0.075 (0.38) |
|
<I/σI)>
|
9.9 (1.7)
|
| Refinement | |
| Number of reflections (completeness, %) | 12178 (96.92) |
| Resolution range (Å) | 68.51–1.76 |
| R factor/Rfree (%) | 15.62/22.67 |
| Number of protein atoms (average B, Å2)c | 929 (30.61) |
| Number of water molecules (average B, Å2)c | 129 (38.31) |
| Root mean square bond length (Å) | 0.012 |
| Root mean square bond angle (°) | 1.816 |
| Ramachandran plot outliers (number, %)d | 3, 2.5 |