4M8E

CRYSTAL STRUCTURE OF HUMAN RETINOID X RECEPTOR ALPHA-LIGAND BINDING DOMAIN COMPLEX WITH (S) 4-Methyl 9cUAB30 COACTIVATOR PEPTIDE GRIP-1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	OTHER
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2009-02-19
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.315
Spacegroup name	P 43 21 2
Unit cell lengths	66.279, 66.279, 111.011
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.150 - 2.400
Rwork	0.208
R-free	0.24680
RMSD bond length	0.007
RMSD bond angle	1.091
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	26.150	2.490
High resolution limit [Å]	2.400	2.400
Rmerge	0.076
<I/σ(I)>	17	6.5
Completeness [%]	98.7	99.3
Redundancy	10.28	10.03

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	295	4-20% PEG4000, 4-16% GLYCEROL, 0.1M BIS-TRIS, PH7.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 295K