6TEE
Crystal structure of monooxygenase RutA under anaerobic conditions.
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-27 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 88.033, 88.033, 96.901 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.055 - 2.200 |
Rwork | 0.189 |
R-free | 0.23720 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5wan |
RMSD bond length | 0.008 |
RMSD bond angle | 1.577 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.450 | 2.320 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.150 | |
Number of reflections | 21254 | 2261 |
<I/σ(I)> | 7.5 | |
Completeness [%] | 94.3 | |
Redundancy | 8.9 | |
CC(1/2) | 0.850 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 100 mM Bis-Tris pH 6.5, 1900 mM Ammonium Sulphate, 2-5% MPD (v/v), 1 mM FMN |