4C6D
Crystal structure of the dihydroorotase domain of human CAD bound to substrate 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 | 2011-09-01 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 82.080, 158.770, 61.560 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.867 - 1.298 |
R-factor | 0.1214 |
Rwork | 0.121 |
R-free | 0.13350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4c6c |
RMSD bond length | 0.022 |
RMSD bond angle | 1.904 |
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] | 19.870 | 1.330 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 0.060 | 0.660 |
Number of reflections | 98957 | |
<I/σ(I)> | 17.9 | 3.6 |
Completeness [%] | 99.7 | 97 |
Redundancy | 7.3 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | pH 6.0 |