8CPJ

Crystal structure of PPAR gamma (PPARG) in an inactive form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-15
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00002
Spacegroup name	P 41 21 2
Unit cell lengths	63.106, 63.106, 168.056
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.660 - 2.400
R-factor	0.24064
Rwork	0.238
R-free	0.28194
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.122
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.620	2.480
High resolution limit [Å]	2.400	2.400
Rmerge	0.101	1.387
Rmeas	0.107	1.496
Rpim	0.029	0.394
Number of reflections	14070	1341
<I/σ(I)>	19.6	2
Completeness [%]	100.0
Redundancy	13.8	14.2
CC(1/2)	0.999	0.798

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	27% PEG 3350, 0.15M sodium citrate