5Q0Z
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 | 2006-08-28 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 71.520, 83.550, 188.910 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 18.370 - 2.260 |
R-factor | 0.237 |
Rwork | 0.236 |
R-free | 0.25800 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.940 |
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] | 37.700 | 2.350 |
High resolution limit [Å] | 2.260 | 2.260 |
Rmerge | 0.076 | 0.385 |
Number of reflections | 25796 | 2426 |
<I/σ(I)> | 12.35 | 1.9 |
Completeness [%] | 95.5 | 79.2 |
Redundancy | 5.67 | 1.78 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | evaporation, hanging drop | 6 | 298 | 0.1 M Bis-Tris pH 6.0, 20% w/v PEG 3350 |