1UPV

Crystal structure of the human Liver X receptor beta ligand binding domain in complex with a synthetic agonist

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	CCD
Collection date	2002-10-15
Detector	MARRESEARCH
Spacegroup name	C 1 2 1
Unit cell lengths	141.800, 43.200, 51.800
Unit cell angles	90.00, 105.80, 90.00

Refinement procedure

Resolution	20.000 - 2.100
Rwork	0.215
R-free	0.27400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fcy
RMSD bond length	0.009
RMSD bond angle	1.213
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	AMoRE
Refinement software	REFMAC (5.1.19)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.180
High resolution limit [Å]	2.100	2.100
Rmerge	0.093	0.317
Number of reflections	15111
<I/σ(I)>	6.4	2
Completeness [%]	83.3	71.3
Redundancy	2.6	2.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		RESERVOIR: 25% MPD, 10% PEG4K, 100 MM HEPES PH 7.5, 10 MM D PROTEIN: 4-8 MG/ML IN 20 MM TRIS PH 8.0, 100 MM NACL, 10 MM