Table 1.
Data collection, refinement and structure quality.
| Parameter | Value |
|---|---|
| PDB ID | 6AO7 |
| Space group | P6522 |
| Unit-cell parameters | |
| a (Å) | 67.16 |
| b (Å) | 67.16 |
| c (Å) | 134.21 |
| α = β (°) | 90 |
| γ (°) | 120 |
| Matthews coefficient (Å3Da−1) | 2.33 |
| Solvent content (%) | 47.25 |
| Resolution range (Å) | 50–1.85 (1.90–1.85)a |
| Mean I/σ(I) | 35.45 (4.88) |
| No. of observed reflections | 15,998 (1150) |
| Completeness (%) | 99.6 (100) |
| Multiplicity | 13.8 (14.3) |
| Rmerge | 0.038 (0.515) |
| Refinement | |
| No. of used reflections | 15,975 |
| Rwork (%) | 0.200 |
| Rfree (%) | 0.244 |
| Mean B factor (Å2) | 48.0 |
| RMSD bonds (Å) | 0.007 |
| RMSD angles (°) | 0.901 |
| Model validationb | |
| MolProbity | |
| Clash score, all atoms | 2.84 |
| Ramachandran favored (%) | 98.7 |
| Ramachandran outliers (%) | 0 |
| MolProbity score | 1.23 |
aValue in parenthesis are statistics for the highest resolution shell.
bValues calculated using Molprobity.