6FZF
PPAR mutant complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-05-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.972422 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.644, 123.684, 54.466 |
Unit cell angles | 90.00, 95.31, 90.00 |
Refinement procedure
Resolution | 17.626 - 1.950 |
R-factor | 0.1534 |
Rwork | 0.152 |
R-free | 0.19440 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1prg |
RMSD bond length | 0.007 |
RMSD bond angle | 0.845 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.626 | 2.020 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.052 | 0.753 |
Number of reflections | 50678 | |
<I/σ(I)> | 12.42 | |
Completeness [%] | 99.0 | 98 |
Redundancy | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 290 | 25% PEG 3350, 0.2 M ammonium sulfate, 0.1 M Bis-Tris pH 6.5 |