9AZ8
Kynurenine monooxygenase from Pseudomonas fluorescens complexed with 4-cyclohexylphenylacetyltetrazole
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-12-08 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.540, 52.540, 136.510 |
| Unit cell angles | 90.00, 104.11, 90.00 |
Refinement procedure
| Resolution | 41.900 - 1.950 |
| R-factor | 0.1707 |
| Rwork | 0.170 |
| R-free | 0.21060 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21_5207) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.800 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 129564 | 172 |
| <I/σ(I)> | 2.56 | |
| Completeness [%] | 97.3 | |
| Redundancy | 1.7 | |
| CC(1/2) | 0.997 | 0.876 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 295 | 13% PEG 8000, 0.13M Ca(OAc)2, 14% glycerol, and 0.08M sodium cacodylate pH6.5 |
