7MFI

Bovine sigma-2 receptor bound to cholesterol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	80
Detector technology	PIXEL
Collection date	2019-08-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.03320
Spacegroup name	P 1 21 1
Unit cell lengths	70.873, 54.894, 93.007
Unit cell angles	90.00, 94.30, 90.00

Refinement procedure

Resolution	47.240 - 2.810
Rwork	0.240
R-free	0.27810
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7m93
RMSD bond length	0.003
RMSD bond angle	0.590
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.19.1_4122+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.900
High resolution limit [Å]	2.800	2.800
Rmerge	0.322	2.200
Rmeas	0.350	2.383
Rpim	0.134	0.900
Number of reflections	17737	1752
<I/σ(I)>	5.35	0.94
Completeness [%]	99.7	98.54
Redundancy	6.7	6.9
CC(1/2)	0.992	0.426

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	6	293	PEG 300 400 mM Na Citrate 100 mM MES pH 6 1,2,3 heptanetriol