7FHR
Crystal Structure of a Rieske Oxygenase from Cupriavidus metallidurans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-11-03 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.7377 |
Spacegroup name | P 63 |
Unit cell lengths | 103.416, 103.416, 77.590 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 58.710 - 1.840 |
R-factor | 0.1668 |
Rwork | 0.164 |
R-free | 0.21180 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.719 |
Data reduction software | DIALS |
Data scaling software | Aimless |
Phasing software | Auto-Rickshaw |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 77.590 | 1.880 |
High resolution limit [Å] | 1.840 | 1.840 |
Number of reflections | 40987 | 2488 |
<I/σ(I)> | 16.3 | |
Completeness [%] | 100.0 | |
Redundancy | 2 | |
CC(1/2) | 0.999 | 0.619 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | glycine, lysine, glutamate, PEG 4000 |