7A79

Crystal structure of RXR gamma LBD in complexes with palmitic acid and GRIP-1 peptide

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	2020-07-16
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	63.246, 67.051, 110.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.010 - 2.050
R-factor	0.1979
Rwork	0.195
R-free	0.24830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6sjm
RMSD bond length	0.014
RMSD bond angle	1.351
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.010	46.010	2.120
High resolution limit [Å]	2.050	7.940	2.050
Rmerge	0.148	0.097	0.782
Rmeas	0.163	0.103	0.880
Rpim	0.054	0.033	0.310
Number of reflections	30235	603	2910
<I/σ(I)>	8.2		2
Completeness [%]	99.9	99.5	100
Redundancy	8.5	8.2	7.9
CC(1/2)	0.994	0.993	0.754

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	17% PEG 3350, 0.1M potassium citrate