5Q0M
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 | 2008-09-04 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 65 |
Unit cell lengths | 93.562, 93.562, 45.590 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.514 - 2.200 |
R-factor | 0.1869 |
Rwork | 0.183 |
R-free | 0.26150 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.009 |
RMSD bond angle | 1.024 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.800 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.062 | 0.543 |
Number of reflections | 11752 | 1454 |
<I/σ(I)> | 12.61 | 1.86 |
Completeness [%] | 99.9 | 99.5 |
Redundancy | 4.14 | 3.59 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | evaporation, hanging drop | 7.5 | 298 | 0.1 M HEPES pH 7.5, 1.4 M Sodium Citrate |