3GPO
Crystal structure of macro domain of Chikungunya virus in complex with ADP-ribose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-12-13 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.8856 |
Spacegroup name | P 31 |
Unit cell lengths | 87.957, 87.957, 84.175 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.400 - 1.900 |
R-factor | 0.171 |
Rwork | 0.170 |
R-free | 0.20100 |
Starting model (for MR) | 3gpg |
RMSD bond length | 0.013 |
RMSD bond angle | 1.447 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.25) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.072 | 0.554 |
Total number of observations | 38681 | |
Number of reflections | 57403 | |
<I/σ(I)> | 1.1 | |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 5.4 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 293 | 46% PEG 600, 100 mM hepes, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 293K |