7M95

Bovine sigma-2 receptor bound to Z1241145220

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	80
Detector technology	PIXEL
Collection date	2020-08-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.033167
Spacegroup name	P 21 21 21
Unit cell lengths	55.368, 61.539, 110.411
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.490 - 2.410
R-factor	0.2159
Rwork	0.214
R-free	0.24590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7m93
RMSD bond length	0.004
RMSD bond angle	0.740
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.500	2.550
High resolution limit [Å]	2.410	2.410
Number of reflections	15203	2375
<I/σ(I)>	7.5	0.7
Completeness [%]	99.7	98.2
Redundancy	6.2
CC(1/2)	0.996	0.352

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	6	293	PEG 300,0.1 M MES pH 6,210 mM ammonium phosphate