Table 1. Data collection, refinement and model quality statistics for Mfa4.
| selenomethionine-substituted Mfa426–333 | |
|---|---|
| Data processing | |
| Space group | P21P21P21 |
| Cell dimensions a, b, c (Å) | 54.68, 84.54, 138.36 |
| Resolution (Å) | 1.90 |
| Highest resolution shell (Å) | 2.00–1.90 |
| Total observations | 327588 |
| Unique reflections | 51290 |
| <I/σ (I)a> | 16.0 (3.4) |
| Rpima(%) | 2.7 (20.6) |
| Completeness (%)a | 99.5 (97.8) |
| Overall redundancya | 6.4 (6.2) |
| Refinement | |
| No. of reflections in working set | 48676 |
| No. of reflections in test set | 2614 |
| Rwork/Rfree (%) | 18.4/22.9 |
| RMSD from ideal | |
| Bond lengths (Å) | 0.008 |
| Bond angles (°) | 1.12 |
| Wilson B-factor (Å2) Average B-factors (Å2) | 32.1 |
| Protein (A, B) | 42, 9, 55, 7 |
| Water | 37.6 |
| Ramachandran plot (%) | |
| Favored, allowed | 97.7, 0.5 |
aValues in parentheses indicate statistics for the highest resolution shell.