4C4Z
Crystal structure of human bifunctional epoxide hydroxylase 2 complexed with A8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2012-12-21 |
| Detector | MAR scanner 345 mm plate |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.490, 79.850, 87.220 |
| Unit cell angles | 90.00, 89.38, 90.00 |
Refinement procedure
| Resolution | 28.670 - 2.060 |
| R-factor | 0.2223 |
| Rwork | 0.220 |
| R-free | 0.25300 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.920 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | BUSTER (2.11.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 79.850 | 2.160 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.030 | 0.160 |
| Number of reflections | 36430 | |
| <I/σ(I)> | 21.7 | 8.3 |
| Completeness [%] | 90.7 | 82.6 |
| Redundancy | 2.7 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.3 | pH 8.3 |
