8OYX

De novo designed soluble GPCR-like fold GLF_18

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	2023-02-08
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 1
Unit cell lengths	37.726, 52.084, 58.392
Unit cell angles	94.08, 104.36, 110.80

Refinement procedure

Resolution	47.930 - 2.110
R-factor	0.2049
Rwork	0.203
R-free	0.25070
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.877
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.930	2.185
High resolution limit [Å]	2.110	2.110
Rmerge	0.050	0.335
Number of reflections	20309	2144
<I/σ(I)>	9.89	3.35
Completeness [%]	88.5	92.81
Redundancy	1.7	1.7
CC(1/2)	0.997	0.748

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.2	293.15	Na Phos Cit pH 4.2, 0.2 M LiSO4, 20% PEG 1000