4HR0
R2-like ligand-binding oxidase with aerobically reconstituted metal cofactor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-27 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.87 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 56.150, 97.738, 130.850 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.153 - 1.896 |
R-factor | 0.167 |
Rwork | 0.166 |
R-free | 0.19560 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.018 |
RMSD bond angle | 1.244 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.010 |
High resolution limit [Å] | 1.896 | 1.900 |
Rmerge | 0.054 | 0.754 |
Number of reflections | 28825 | |
<I/σ(I)> | 15.73 | 2 |
Completeness [%] | 99.3 | 97.3 |
Redundancy | 4.1 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | 12.5%(w/v) PEG 1500, 0.1M HEPES-Na, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |