2Y05
Crystal structure of human leukotriene B4 12-hydroxydehydrogenase in complex with NADP and raloxifene
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-24 |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 93.274, 116.599, 154.607 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 59.550 - 2.200 |
| R-factor | 0.1957 |
| Rwork | 0.194 |
| R-free | 0.23085 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zsv |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.430 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.500 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.090 | 0.520 |
| Number of reflections | 82606 | |
| <I/σ(I)> | 5.9 | 2.6 |
| Completeness [%] | 95.0 | 96.4 |
| Redundancy | 3.9 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 10% PEG 10K, 8% ETGLY, 0.1M HEPES, PH 7.5 |
