5Q0N
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 | 2007-10-02 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 72.340, 84.530, 191.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.270 - 2.400 |
R-factor | 0.19 |
Rwork | 0.188 |
R-free | 0.22600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.020 |
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] | 41.300 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.113 | 0.683 |
Number of reflections | 30214 | 3721 |
<I/σ(I)> | 10.22 | 2.35 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 7.27 | 6.84 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | evaporation, hanging drop | 7.5 | 298 | 0.2 M Mg Chloride, 0.1 M HEPES pH 7.5, 25% w/v PEG 3350 |