7ODH
Crystal structure of the O2-tolerant MBH-P242C from Ralstonia eutropha in its as-isolated state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-07-29 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9762 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 73.606, 95.676, 120.824 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.590 - 1.340 |
R-factor | 0.1133 |
Rwork | 0.112 |
R-free | 0.13270 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4iub |
RMSD bond length | 0.006 |
RMSD bond angle | 1.245 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.590 | 1.390 |
High resolution limit [Å] | 1.340 | 1.340 |
Number of reflections | 190645 | 27250 |
<I/σ(I)> | 13.1 | |
Completeness [%] | 99.7 | |
Redundancy | 6.3 | |
CC(1/2) | 1.000 | 0.710 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 25% PEG 3350 5.5-6.5 pH 0.1M Bis-Tris |