6ENQ
Structure of human PPAR gamma LBD in complex with Lanifibranor (IVA337)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 123 |
| Detector technology | PIXEL |
| Collection date | 2005-11-01 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 92.880, 60.000, 117.490 |
| Unit cell angles | 90.00, 102.93, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.200 |
| Rwork | 0.227 |
| R-free | 0.27140 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1prg |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | CNX (2005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.800 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Number of reflections | 32992 | |
| <I/σ(I)> | 16.5 | 3.5 |
| Completeness [%] | 97.6 | 94.8 |
| Redundancy | 3.1 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | Na Citrate 0,9 M 1,2 - propanediol 3,5 % Hepes 0,1 M |
