5Q11
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 | 2007-05-02 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 65 |
Unit cell lengths | 92.706, 92.706, 46.397 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.350 - 2.200 |
R-factor | 0.18 |
Rwork | 0.178 |
R-free | 0.22300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.010 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.400 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.069 | 0.621 |
Number of reflections | 10968 | 844 |
<I/σ(I)> | 18.6 | 1.52 |
Completeness [%] | 93.5 | 58.9 |
Redundancy | 8.98 | 1.84 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | evaporation, hanging drop | 6.5 | 298 | 0.1M Bis-Tris pH 6.5, 2M Ammonium Sulfate |