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