6K9M
Human LXR-beta in complex with an agonist
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-07-08 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 66.863, 105.356, 150.430 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.010 - 2.900 |
| R-factor | 0.24479 |
| Rwork | 0.243 |
| R-free | 0.27963 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6jio |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.167 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.010 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.106 | 0.723 |
| Number of reflections | 23587 | 4346 |
| <I/σ(I)> | 23.12 | |
| Completeness [%] | 97.7 | 98.6 |
| Redundancy | 5.3 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 281 | 22% PEG3350, 0.1 M Tris HCl, pH8.5 |
