4LNW

Crystal structure of TR-alpha bound to T3 in a second site

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU ULTRAX 18
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2003-10-16
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 21 21 21
Unit cell lengths	59.781, 80.789, 102.562
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.590 - 1.900
R-factor	0.16
Rwork	0.158
R-free	0.18400
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.321
Data reduction software	DENZO
Data scaling software	SCALA (3.1.9)
Phasing software	AMoRE
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	63.464	102.562	2.000
High resolution limit [Å]	1.900	6.010	1.900
Rmerge	0.051	0.031	0.349
Number of reflections	39906
<I/σ(I)>	25.6	18	2.1
Completeness [%]	99.9	99.1	99.9
Redundancy	8	6.4	8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	291	1.0 M sodium cacodylate and 0.1 M sodium acetate threehydrate, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 291K