3KWY
Crystal structure of RXRalpha ligand binding domain in complex with triphenyltin and a coactivator fragment
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Detector technology | CCD |
| Collection date | 2008-12-13 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9334 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 64.635, 64.635, 113.589 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 28.090 - 2.300 |
| R-factor | 0.18574 |
| Rwork | 0.183 |
| R-free | 0.24437 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2p1t |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.202 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | REFMAC |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.000 | 2.420 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.069 | 0.364 |
| Number of reflections | 11258 | |
| <I/σ(I)> | 17.8 | 5.9 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 6.8 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 293 | PEG 4000, acetate ammonium, Tris-HCl, pH 7.5, VAPOR DIFFUSION, temperature 293K |
