1V3V
Crystal structure of leukotriene B4 12-hydroxydehydrogenase/15-oxo-prostaglandin 13-reductase complexed with NADP and 15-oxo-PGE2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL45XU |
Synchrotron site | SPring-8 |
Beamline | BL45XU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2003-04-09 |
Detector | RIGAKU RAXIS V |
Wavelength(s) | 1.00 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 58.553, 77.460, 79.095 |
Unit cell angles | 90.00, 102.29, 90.00 |
Refinement procedure
Resolution | 32.100 - 2.000 |
Rwork | 0.194 |
R-free | 0.23860 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.006 |
RMSD bond angle | 1.423 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.100 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.055 | 0.262 |
Number of reflections | 45828 | |
<I/σ(I)> | 18.5 | 5.4 |
Completeness [%] | 98.0 | 97.6 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | batch | 6.5 | 291 | PEG 4000, MES, magnesium chloride, pH 6.5, batch, temperature 291K |