1Y0S
Crystal structure of PPAR delta complexed with GW2331
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 180 |
| Detector technology | IMAGE PLATE |
| Collection date | 1997-11-07 |
| Detector | RIGAKU RAXIS II |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.356, 94.523, 96.492 |
| Unit cell angles | 90.00, 97.92, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.650 |
| R-factor | 0.21 |
| Rwork | 0.210 |
| R-free | 0.26100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gwx |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.464 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.740 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.089 | 0.413 |
| Number of reflections | 19351 | |
| <I/σ(I)> | 16 | 2.6 |
| Completeness [%] | 94.7 | 97.2 |
| Redundancy | 4 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 298 | PEG 35K, KI, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
