5Q0K
Ligand binding to FARNESOID-X-RECEPTOR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-07-18 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 65 |
Unit cell lengths | 93.520, 93.520, 47.830 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.630 - 1.800 |
R-factor | 0.213 |
Rwork | 0.210 |
R-free | 0.27100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.000 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.800 | 1.890 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.165 | 1.044 |
Number of reflections | 22191 | 2869 |
<I/σ(I)> | 9.34 | 1.26 |
Completeness [%] | 99.6 | 97.8 |
Redundancy | 11.04 | 9.87 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | evaporation, hanging drop | 7.5 | 298 | 0.2M MgCl2, 0.1M HEPES pH 7.5, 25%PEG3350 |