5AM5
ligand complex structure of soluble epoxide hydrolase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | RIGAKU A200-CU |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 92.324, 92.324, 244.472 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 79.950 - 2.260 |
R-factor | 0.171 |
Rwork | 0.168 |
R-free | 0.22800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ahx |
RMSD bond length | 0.010 |
RMSD bond angle | 1.160 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | BUSTER (2.11.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 244.470 | 2.380 |
High resolution limit [Å] | 2.260 | 2.260 |
Rmerge | 0.210 | 1.020 |
Number of reflections | 29286 | |
<I/σ(I)> | 11.2 | 2.7 |
Completeness [%] | 98.7 | 97.6 |
Redundancy | 11.7 | 12 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |