Table 1. Data collection and refinement statistics (molecular replacement).
| Mamu-B*098:C14nef5 | |
|---|---|
| Data collection | |
| Space group | P1 |
| Cell dimensions | |
| a, b, c (Å) | 46.40, 85.18, 127.99 |
| α, β, γ (°) | 89.20, 79.57, 90.02 |
| Resolution (Å) | 50–1.76 (1.79–1.76) |
| Rmerge | 0.042 (0.532) |
| I/σI | 30.9 (2.2) |
| Completeness (%) | 95.9 (78.1) |
| Redundancy | 2.61 (2.5) |
| Refinement | |
| Resolution (Å) | 1.76 (1.78–1.76) |
| No reflections | 182443 (4351) |
| Rwork/Rfree (%) | 19.5 (30.3)/22.8 (31.9) |
| No atoms | |
| Protein | 12621 |
| MYR/EDO/TRS/zinc/chlorine | 60/260/16/18/3 |
| Water | 810 |
| B-factors (Å2) | |
| Protein | 33.2 |
| C14nef5 | 49.9 |
| Water | 36.6 |
| R.m.s. d. | |
| Bond lengths (Å) | 0.008 |
| Bond angles (°) | 1.11 |
EDO, 1,2-ethanediol; MYR, myristic acid; R.m.s.d., root-mean-square deviation; TRS, 2-Amino-2-hydroxymethyl-propane-1,3-diol.
Data were collected from a single crystal.
*The Highest resolution shell is shown in parentheses.