4C6O
Crystal structure of the dihydroorotase domain of human CAD C1613S mutant in apo-form at pH 6.0
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 | 2012-11-12 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 82.120, 159.420, 61.470 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.927 - 1.650 |
R-factor | 0.1168 |
Rwork | 0.115 |
R-free | 0.15710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4c6c |
RMSD bond length | 0.010 |
RMSD bond angle | 1.250 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.930 | 1.690 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.080 | 0.610 |
Number of reflections | 47108 | |
<I/σ(I)> | 19.9 | 2.9 |
Completeness [%] | 96.3 | 55.7 |
Redundancy | 10.1 | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | pH 6.0 |