Table 2. Data collection and refinement statistics.
Values in parentheses are for the highest resolution shell.
| Crystal 1 | Crystal 2 | |
|---|---|---|
| PDB code | 6GPG | |
| Data collection | ||
| Space group | P212121 | P6522 |
| Wavelength (Å) | 1.00 | 1.00 |
| Cell dimensions | ||
| a, b, c (Å) | 112.1, 177.1, 314.8 | 175.6, 175.6, 109.5 |
| α, β, γ (°) | 90, 90, 90 | 90, 90, 120 |
| Resolution range (Å) | 47.2–3.3 (3.42–3.30) | 46.4–2.9 (3.00–2.89) |
| Rmerge (%) | 14.3 (112) | 7.6 (206) |
| I/σI | 8.45 (1.28) | 19.72 (1.15) |
| CC1/2 | 99.8 (67.6) | 99.9 (99.7) |
| Completeness (%) | 95.3 (79.7) | 99.7 (97.4) |
| Redundancy | 3.38 (2.91) | 13.09 (13.21) |
| Refinement | ||
| Resolution (Å) | 3.3 | 2.9 |
| No. reflections | 90,121 | 22,649 |
| Rwork/ Rfree | 22.8/28.3 | 21.4/25.9 |
| No. atoms | ||
| Macromolecules | 35,730 | 5,810 |
| Ions | 10 | 2 |
| Ramachandran statistics | ||
| Favoured (%) | 92.78 | 92.71 |
| Allowed (%) | 6.39 | 6.98 |
| Outliers (%) | 0.83 | 0.31 |
| R.M.S deviations | ||
| Bond lengths (Å) | 0.011 | 0.009 |
| Angles (°) | 1.48 | 1.43 |
| B-factors | ||
| Macromolecules | 109.98 | 139.89 |
| Ions | 105.23 | 121.74 |