8HF8

Human PPAR delta ligand binding domain in complex with a synthetic agonist V1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-04-05
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9789
Spacegroup name	P 1 21 1
Unit cell lengths	39.795, 92.966, 96.715
Unit cell angles	90.00, 96.00, 90.00

Refinement procedure

Resolution	32.260 - 2.110
R-factor	0.2005
Rwork	0.199
R-free	0.22960
Structure solution method	SIR
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.170
High resolution limit [Å]	2.110	2.110
Rmerge	0.123	0.123
Number of reflections	37883
<I/σ(I)>	16.5
Completeness [%]	95.0
Redundancy	2.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.5M sodium citrate, pH 5.5, 19 % PEG 3350, 20% glycerol