8PBQ
Mutant R1810Q of the dihydroorotase domain of human CAD protein bound to the substrates
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-02-28 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97918 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 82.294, 158.810, 61.124 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.440 - 1.540 |
R-factor | 0.1484 |
Rwork | 0.147 |
R-free | 0.17590 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.134 |
Phasing software | PHASER (v8.0) |
Refinement software | REFMAC (v8.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.440 | 1.595 |
High resolution limit [Å] | 1.540 | 1.540 |
Number of reflections | 393684 | 38757 |
<I/σ(I)> | 18.99 | 2.35 |
Completeness [%] | 100.0 | |
Redundancy | 6.6 | |
CC(1/2) | 0.999 | 0.843 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 100 mM HEPES pH 7.5, 3.2M sodium formate, 2 mM carbamoyl aspartate |