7W0G
Human PPAR delta ligand binding domain in complex with a synthetic agonist H11
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL02U1 |
Synchrotron site | SSRF |
Beamline | BL02U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-08-19 |
Detector | DECTRIS EIGER2 X 9M |
Wavelength(s) | 0.9789 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 39.860, 93.201, 96.716 |
Unit cell angles | 90.00, 96.27, 90.00 |
Refinement procedure
Resolution | 28.139 - 2.443 |
R-factor | 0.2006 |
Rwork | 0.199 |
R-free | 0.23650 |
Structure solution method | SIR |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.139 | 2.480 |
High resolution limit [Å] | 2.443 | 2.443 |
Rmerge | 0.096 | 0.096 |
Number of reflections | 25924 | 25929 |
<I/σ(I)> | 1.38 | |
Completeness [%] | 99.2 | |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 0.5M sodium citrate, pH 5.5, 19 % PEG 3350, 20% glycerol |