6WNC
Structure of the Rieske non-heme iron oxygenase GxtA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-02 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.9787 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 74.730, 96.932, 80.809 |
Unit cell angles | 90.00, 106.97, 90.00 |
Refinement procedure
Resolution | 38.650 - 2.200 |
R-factor | 0.1954 |
Rwork | 0.194 |
R-free | 0.21880 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6wn3 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.535 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.186 | 0.477 |
Number of reflections | 54048 | 5122 |
<I/σ(I)> | 10.56 | 1.56 |
Completeness [%] | 96.3 | 90.9 |
Redundancy | 4.3 | 2.2 |
CC(1/2) | 0.981 | 0.730 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.3 M MgCl2, 0.1 M Bis-Tris pH 5.5, 25% v/v PEG3350, 15% v/v glycerol |