1R5K
Human Estrogen Receptor alpha Ligand-Binding Domain In Complex With GW5638
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-BM-C |
Synchrotron site | APS |
Beamline | 14-BM-C |
Temperature [K] | 105 |
Detector technology | CCD |
Collection date | 2002-08-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 136.031, 136.031, 357.626 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 27.950 - 2.700 |
R-factor | 0.20788 |
Rwork | 0.205 |
R-free | 0.23561 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ert |
RMSD bond length | 0.014 |
RMSD bond angle | 1.339 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | EPMR |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.790 |
High resolution limit [Å] | 2.650 | 2.650 |
Rmerge | 0.072 | |
Number of reflections | 53588 | |
<I/σ(I)> | 12.7 | |
Completeness [%] | 96.8 | |
Redundancy | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.7 | 277 | Ethylene imine polymer, tri-sodium citrate, sodium chloride, yttrium chloride hexahydrate, pH 5.7, VAPOR DIFFUSION, HANGING DROP, temperature 277K |