Table 2.
Data collection and refinement statisticsa.
| Data collection | |
|---|---|
| Space group | C121 |
| Unit cell dimensions | |
| a, b, c (Å) | 231.7, 96.1, 170.0 |
| α, β, γ (°) | 90, 132, 90 |
| Resolution range (Å) | 39.2–3.15 (3.23-3.15) |
| Completeness (%) | 90.2 (80.6) |
| Rmerge (%) | 7.7 (70.9) |
| I/σ (I) | 14.8 (1.7) |
| Redundancy | 3.6 (2.1) |
| Refinement statistics | |
| Resolution limit (Å) | 39.2–3.15 |
| No. of reflections | 41,839 |
| Rwork/Rfree (%) | 20.5/25.7 |
| Number of atoms | |
| Protein | 13,064 |
| Ligand/ion | 4 |
| B-factors | |
| Protein | 69.8 |
| Ions | 118.4 |
| r.m.s deviations | |
| Bond lengths (Å) | 0.007 |
| Bond angles (°) | 1.139 |
aValues in parentheses are for the highest-resolution shell. Data were collected from a single crystal.