2VSR
hPPARgamma Ligand binding domain in complex with 9-(S)-HODE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-3 |
Synchrotron site | ESRF |
Beamline | ID14-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-11-16 |
Detector | ADSC CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 93.182, 61.674, 118.941 |
Unit cell angles | 90.00, 103.02, 90.00 |
Refinement procedure
Resolution | 51.020 - 2.050 |
R-factor | 0.226 |
Rwork | 0.226 |
R-free | 0.26600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2i4p |
RMSD bond length | 0.007 |
RMSD bond angle | 1.100 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.020 | 2.160 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.050 | 0.270 |
Number of reflections | 39198 | |
<I/σ(I)> | 13.5 | 2.9 |
Completeness [%] | 94.4 | 77.5 |
Redundancy | 2.3 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | pH 8 |