6K9G
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] | 110 |
| Detector technology | CCD |
| Collection date | 2018-04-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 67.433, 103.739, 152.233 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.010 - 2.800 |
| R-factor | 0.26174 |
| Rwork | 0.261 |
| R-free | 0.28110 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6jio |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.104 |
| 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 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.085 | 0.581 |
| Number of reflections | 26810 | 4967 |
| <I/σ(I)> | 21.9 | 3.2 |
| Completeness [%] | 99.2 | |
| Redundancy | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 281 | 22% PEG 3350, 0.1M Tris HCl pH 8.5 |
