5Y66
Crystal structure of Pseudomonas fluorescens Kynurenine 3-monooxygenase in complex with L-KYN and Ro61-8048
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17B1 |
| Synchrotron site | SSRF |
| Beamline | BL17B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-09-20 |
| Detector | MAR CCD 130 mm |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.370, 86.242, 121.186 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.579 - 2.340 |
| R-factor | 0.1742 |
| Rwork | 0.171 |
| R-free | 0.23580 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.543 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 2.340 |
| Number of reflections | 19636 |
| <I/σ(I)> | 15.9 |
| Completeness [%] | 91.8 |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 5.5 | 293 | 0.1 M sodium citrate at pH 5.5, 17% w/v PEG3350 and 0.1% w/v n-Octyl-beta-D-glucoside |
