5FN0
Crystal structure of Pseudomonas fluorescens kynurenine-3- monooxygenase (KMO) in complex with GSK180
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-07-18 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 186.850, 105.290, 133.640 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 93.430 - 3.190 |
| R-factor | 0.1589 |
| Rwork | 0.157 |
| R-free | 0.19640 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.120 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | BUSTER (2.11.5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 187.000 | 3.210 |
| High resolution limit [Å] | 3.190 | 3.190 |
| Rmerge | 0.070 | 0.600 |
| Number of reflections | 44508 | |
| <I/σ(I)> | 19.4 | 3.2 |
| Completeness [%] | 100.0 | 99.8 |
| Redundancy | 6.7 | 6.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | HANGING DROP VAPOUR DIFFUSION. 0.1M HEPES PH 7.0, 10% GLYCEROL, 10% 2-PROPANOL, 6.5% PEG 4000, 10MM KCL. |
