3GQO
Crystal structure of macro domain of Venezuelan Equine Encephalitis virus in complex with ADP-ribose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-01-29 |
Detector | MAR555 FLAT PANEL |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 74.000, 87.200, 105.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.740 - 2.600 |
R-factor | 0.199 |
Rwork | 0.195 |
R-free | 0.27500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gqe |
RMSD bond length | 0.010 |
RMSD bond angle | 1.433 |
Data scaling software | XSCALE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.700 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.104 | 0.497 |
Number of reflections | 20549 | |
<I/σ(I)> | 4.72 | |
Completeness [%] | 99.2 | 89.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 293 | 0.2M AmSO4, 0.1 M Na Cacodylate, 30 % PEG 8000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |