6FW7
Crystal structure of L-tryptophan oxidase VioA from Chromobacterium violaceum in complex with 4-Fluoro-L-Tryptophan
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-12-16 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.98 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 151.812, 174.880, 93.919 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 59.035 - 3.000 |
R-factor | 0.1986 |
Rwork | 0.195 |
R-free | 0.26160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6esd |
RMSD bond length | 0.010 |
RMSD bond angle | 1.234 |
Data reduction software | xia2 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.040 | 3.120 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.270 | |
Rmeas | 0.294 | |
Number of reflections | 25435 | 2508 |
<I/σ(I)> | 5.47 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.5 | 6.7 |
CC(1/2) | 0.848 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 100 mM HEPES pH 7.5, 9% PEG 8000 and 9% ethylene glycol |