6S4N
LXRbeta ligand binding domain in comlpex with small molecule inhibitors
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-08-30 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.433, 109.398, 88.980 |
| Unit cell angles | 90.00, 90.88, 90.00 |
Refinement procedure
| Resolution | 54.718 - 1.900 |
| Rwork | 0.215 |
| R-free | 0.24500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.552 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.8.0135 2015/10/01) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 89.100 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 104549 | 12776 |
| <I/σ(I)> | 8.3 | |
| Completeness [%] | 92.7 | |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 293 | 0.1 M HEPES pH 7.5 and 18% PEG6000 |
