7JQG

Crystal structure of human PPARgamma ligand binding domain Y473E mutant in complex with GW1929

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-06-23
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	C 1 2 1
Unit cell lengths	92.699, 61.625, 118.660
Unit cell angles	90.00, 102.44, 90.00

Refinement procedure

Resolution	39.380 - 2.150
R-factor	0.2276
Rwork	0.225
R-free	0.27000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1prg
Data reduction software	DIALS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.380	2.227
High resolution limit [Å]	2.150	2.150
Rmerge	0.013	0.196
Rmeas	0.019	0.277
Rpim	0.013	0.196
Number of reflections	35158	3506
<I/σ(I)>	22	3.49
Completeness [%]	98.2
Redundancy	2	2
CC(1/2)	0.999	0.934

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	293	0.1M MOPS, pH 7.4, 0.8M SODIUM CITRATE