8P7A

Crystal structure of the ORD domain of human ORP8

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-23
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9184
Spacegroup name	P 21 21 2
Unit cell lengths	105.610, 190.240, 58.720
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.560 - 2.560
R-factor	0.2206
Rwork	0.219
R-free	0.25070
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.586
Data reduction software	XDS (xdsapp v2.0)
Data scaling software	XDS (xdsapp v2.0)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.560	2.652
High resolution limit [Å]	2.560	2.560
Rmerge	0.285	4.747
Rmeas	0.296	4.952
Rpim	0.082	1.398
Number of reflections	38965	130
<I/σ(I)>	9.52	0.51
Completeness [%]	52.9	3.39
Redundancy	12.9	12.3
CC(1/2)	0.998	0.495

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	15% PEG 20.000, 100 mM HEPES pH 7.0