Table 1.
Data collection and refinement statistics
| Tu:CdiA–CT:CdiI | |
|---|---|
| Data collection | |
| Space group | C 1 2 1 |
| Cell dimensions | |
| a, b, c (Å) | 101.93, 102.76, 88.14 |
| α, β, γ (°) | 90, 111.863, 90 |
| Wavelength (Å) | 0.98000 |
| Resolution (Å)a | 49.76–3.40 (3.52–3.40) |
| R sym a | 0.308 (2.134) |
| I / σIa | 7.1 (1.0) |
| CC 1/2a | 0.994 (0.386) |
| Completeness (%)a | 98.4 (89.0) |
| Redundancya | 7.5 (6.7) |
| Refinement | |
| Resolution (Å) | 35.6–3.413 |
| No. reflections | 86153 |
| R work / Rfree (%) | 23.68 / 27.79 |
| No. atoms | |
| Protein | 5190 |
| Ligand | - |
| Water | - |
| B-factors (Å2) | |
| Protein | 111.13 |
| Ligand | - |
| Water | - |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.004 |
| Bond angles (°) | 1.04 |
aValues in parentheses are for the highest resolution shell.