2EG6
The crystal structure of the ligand-free dihydroorotase from E. coli
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-08-06 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.426, 79.674, 180.987 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 17.000 - 1.700 |
R-factor | 0.176 |
Rwork | 0.174 |
R-free | 0.21400 |
Structure solution method | Refinement |
Starting model (for MR) | 1xge |
RMSD bond length | 0.013 |
RMSD bond angle | 1.417 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.000 | 1.744 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.033 | 0.327 |
Number of reflections | 79401 | |
<I/σ(I)> | 28.7 | |
Completeness [%] | 96.1 | 87.5 |
Redundancy | 3.5 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 20-25% PEG 3350, 0.1M Na HEPES, 0.2M NaF, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |