3IMY

Structure of TR-beta bound to selective thyromimetic GC-1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU ULTRAX 18
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2004-01-01
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	68.996, 68.996, 130.861
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	35.230 - 2.550
R-factor	0.227
Rwork	0.225
R-free	0.27100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1bsx
RMSD bond length	0.008
RMSD bond angle	1.370
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	40.000	40.000	2.640
High resolution limit [Å]	2.550	5.490	2.550
Rmerge	0.067	0.031	0.577
Number of reflections	11916
<I/σ(I)>	13.8
Completeness [%]	96.9	99	99.9
Redundancy	3.9	3.7	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	291	100mM NaCac, 1.2M NaAc, 200mM Na succinate, pH 7.5, VAPOR DIFFUSION, temperature 291K