8CK8
STRUCTURE OF HIF2A-ARNT HETERODIMER IN COMPLEX WITH (S)-1-Cyclohexyloxy-5,5-difluoro-3-methanesulfonyl-5,6-dihydro-4H-cyclopenta[c]thiophen-4-ol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-03-21 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.99999 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 72.353, 83.731, 41.170 |
Unit cell angles | 90.00, 106.70, 90.00 |
Refinement procedure
Resolution | 35.720 - 2.302 |
R-factor | 0.205 |
Rwork | 0.201 |
R-free | 0.27600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.950 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.720 | 2.384 |
High resolution limit [Å] | 2.302 | 2.302 |
Rmeas | 0.106 | 0.559 |
Rpim | 0.083 | 0.411 |
Number of reflections | 8380 | 419 |
<I/σ(I)> | 7.8 | |
Completeness [%] | 80.1 | |
Redundancy | 2.7 | |
CC(1/2) | 0.977 | 0.766 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 17% (w/v) PEG3350 ; 0.1 M BisTris pH 6.25 |