4XT2
Crystal structure of the high affinity heterodimer of HIF2 alpha and ARNT C-terminal PAS domains in complex with a tetrazole-containing antagonist
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-07-15 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97926 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 74.253, 84.390, 82.784 |
Unit cell angles | 90.00, 104.39, 90.00 |
Refinement procedure
Resolution | 41.688 - 1.698 |
R-factor | 0.161 |
Rwork | 0.159 |
R-free | 0.19160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3f1p |
RMSD bond length | 0.011 |
RMSD bond angle | 1.345 |
Data reduction software | HKL-2000 (v704) |
Data scaling software | HKL-2000 (v704) |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.730 |
High resolution limit [Å] | 1.698 | 1.700 |
Rmerge | 0.059 | 0.562 |
Number of reflections | 54343 | |
<I/σ(I)> | 18.3 | 2.8 |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 3.1 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293.15 | 2 uL 500 uM protein against 100 mM Bis-Tris, 25% PEG3350 |