2IOK
Human estrogen receptor alpha ligand-binding domain in complex with compound 1D
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | OTHER |
Wavelength(s) | 1.54 |
Spacegroup name | P 41 |
Unit cell lengths | 99.860, 99.860, 54.900 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 2.400 |
R-factor | 0.215 |
R-free | 0.32300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ert |
RMSD bond length | 0.005 |
RMSD bond angle | 0.016 |
Phasing software | MERLOT |
Refinement software | SHELXL (97-1) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 49.900 |
High resolution limit [Å] | 2.400 |
Number of reflections | 20663 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |