Table 1. Data collection and refinement statistics for the R-C1B1 StEH1 variant a .
| Data collection | |
| Wavelength (Å) | 0.9763 |
| Space group | P212121 |
| Cell dimensions a, b, c (Å) | 56.0, 99.1, 123.5 |
| Resolution (Å) | 99.14–2.00 (2.05–2.00) |
| R merge | 0.125 (0.571) |
| Mean I/σI | 9.0 (2.6) |
| Completeness (%) | 99.9 (100) |
| Multiplicity | 5.7 (5.8) |
| Wilson B-factor (Å2) | 20.0 |
| Refinement | |
| Resolution (Å) | 77.3–2.00 |
| No. reflections | 44 563 |
| No. refl. test set (in %) | 2292 (4.9) |
| R work/R free (%) | 17.1/21.1 |
| No. atoms/average B-factors (Å2) | |
| Protein | 5158/25.64 |
| Water molecules | 642/34.3 |
| Dioxane | 12/37.8 |
| r.m.s. deviations | |
| Bond lengths (Å) | 0.009 |
| Bond angles (°) | 1.30 |
aValues given in parentheses are for the highest resolution shell.