1T3Q
Crystal structure of quinoline 2-Oxidoreductase from Pseudomonas Putida 86
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2002-11-10 |
Detector | MARRESEARCH |
Wavelength(s) | 1.05 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 278.320, 72.100, 202.650 |
Unit cell angles | 90.00, 127.98, 90.00 |
Refinement procedure
Resolution | 19.290 - 1.800 |
R-factor | 0.186 |
Rwork | 0.186 |
R-free | 0.20700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1n5w |
RMSD bond length | 0.006 |
RMSD bond angle | 1.400 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.000 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 290508 | |
Completeness [%] | 99.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.4 | 277 | Tris-HCl, ammonium sulfate, glycerol, pH 8.4, VAPOR DIFFUSION, SITTING DROP, temperature 277K |