Table 1.
Data collection and refinement statistics (molecular replacement).
| Aro3 | |
|---|---|
| Data collection | |
| Space group | P 2 21 21 |
| Cell dimensions | |
| a, b, c (Å) | 73.68, 95.561, 105.785 |
| α, β, γ (°) | 90, 90, 90 |
| Resolution (Å) | 105.79–3.3 (3.56–3.3)a |
| Rsym or Rmerge | 0.115 (1.503) |
| I / σI | 9.6 (1.3) |
| Completeness (%) | 96.6 (95.9) |
| Redundancy | 7.0 (7.3) |
| Refinement | |
| Resolution (Å) | 34.37–3.3 (3.418–3.3) |
| No. reflections | 11,322 (1145) |
| Rwork/Rfree | 0.252/0.295 |
| No. atoms | |
| Protein | 5760 |
| Ligand/ion | 0 |
| Water | 0 |
| B-factors | 176.3 |
| Protein | 176.3 |
| Ligand/ion | 0 |
| Water | 0 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.013 |
| Bond angles (°) | 1.76 |
aNumber of xtals for each structure should be noted in footnote. Values in parentheses are for highest-resolution shell.