3FC6

hRXRalpha & mLXRalpha with an indole Pharmacophore, SB786875

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2003-08-23
Detector	ADSC QUANTUM 210
Wavelength(s)	1.00
Spacegroup name	C 1 2 1
Unit cell lengths	122.162, 90.029, 101.642
Unit cell angles	90.00, 111.92, 90.00

Refinement procedure

Resolution	44.200 - 2.063
R-factor	0.2014
Rwork	0.199
R-free	0.25010
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MLPHARE
Refinement software	PHENIX ((phenix.refine))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.200	2.130
High resolution limit [Å]	2.060	2.060
Rmerge	0.082	0.376
Number of reflections	58748
<I/σ(I)>	7.9	2.2
Completeness [%]	93.4	71.3
Redundancy	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1