TABLE 1.
Data collection and refinement statistics
| Parameter | Value(s) for Rv212516–260a |
|---|---|
| Data collection statistics | |
| Wavelength (Å) | 1.100 |
| Space group | C2 |
| Cell dimensions | |
| a, b, c (Å) | 138.25, 79.76, 89.03 |
| α, β, γ (°) | 90.0, 103.57, 90.0 |
| Resolution range (Å) | 30.65–3.00 (3.16–3.00) |
| Rmerge (%) | 19.9 (50.2) |
| I/σI | 5.7 (2.5) |
| Completeness (%) | 98.9 (99.4) |
| Total no. of reflections | 67,525 (9,907) |
| Multiplicity | 3.6 (3.6) |
| Refinement statistics | |
| Resolution range (Å) | 30.65–3.00 |
| No. of unique reflections | 18,826 (2,748) |
| Rwork/Rfree | 0.236/0.289 |
| No. of non-H atoms | |
| Protein | 5,516 |
| Water | 86 |
| Average B-factor (Å2) | |
| Protein | 41.06 |
| Water | 23.62 |
| RMSD | |
| Bond length (Å) | 0.0098 |
| Bond angle (°) | 1.382 |
| Ramachandran statistics (%) | |
| Favored | 93.87 |
| Allowed | 6.13 |
| Outliers | 0 |
| PDB accession number | 5UN0 |
a
Data for the highest-resolution shell are shown in parentheses.