3H7W
Crystal structure of the high affinity heterodimer of HIF2 alpha and ARNT C-terminal PAS domains with the artificial ligand THS017
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-12-14 |
| Detector | SBC-2 |
| Wavelength(s) | 0.97915 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 73.890, 82.727, 41.158 |
| Unit cell angles | 90.00, 106.48, 90.00 |
Refinement procedure
| Resolution | 22.710 - 1.650 |
| R-factor | 0.19907 |
| Rwork | 0.197 |
| R-free | 0.23638 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3f1p |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.481 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-2000 |
| Phasing software | REFMAC |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.063 | 0.519 |
| Number of reflections | 28092 | |
| <I/σ(I)> | 24.8 | 2.1 |
| Completeness [%] | 98.2 | 95.2 |
| Redundancy | 4.3 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.1M BisTris, 17% PEG3350, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
