2WV8
Complex of human dihydroorotate dehydrogenase with the inhibitor 221290
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II |
Synchrotron site | MAX II |
Temperature [K] | 100 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 90.660, 90.660, 122.840 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.380 - 1.900 |
R-factor | 0.185 |
Rwork | 0.185 |
R-free | 0.20100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.400 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.060 | 0.260 |
Number of reflections | 44920 | |
<I/σ(I)> | 17 | 6 |
Completeness [%] | 96.4 | 97.1 |
Redundancy | 4.6 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |