6CZW
Crystal structure of PT1940 bound to HIF2a-B*:ARNT-B* complex
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 | 2012-12-10 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97915 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 73.928, 83.534, 41.525 |
Unit cell angles | 90.00, 106.72, 90.00 |
Refinement procedure
Resolution | 27.010 - 1.600 |
R-factor | 0.2134 |
Rwork | 0.211 |
R-free | 0.25050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4xt2 |
RMSD bond length | 0.023 |
RMSD bond angle | 2.369 |
Data reduction software | HKL-3000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmeas | 0.079 | |
Rpim | 0.041 | 0.558 |
Number of reflections | 31368 | 2985 |
<I/σ(I)> | 25 | 1.1 |
Completeness [%] | 98.9 | 95.2 |
Redundancy | 3.53 | 3 |
CC(1/2) | 0.504 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 293 | 50 mM Bis-Tris pH5.4, 16% PEG 3350. Seed with crushed crystal right after drops are set up |