6Z15

Human wtSTING in complex with 3',3'-c-di-AMP

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	2018-04-06
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9184
Spacegroup name	P 41 21 2
Unit cell lengths	110.688, 110.688, 35.645
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.139 - 2.500
R-factor	0.2208
Rwork	0.219
R-free	0.24690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ksy
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.200	2.275
High resolution limit [Å]	2.196	2.196
Number of reflections	11816	1138
<I/σ(I)>	10.89	0.56
Completeness [%]	99.8
Redundancy	13.6
CC(1/2)	0.998	0.245

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	12.5% w/v PEG 1000, 12.5% w/v PEG 3350, 12.5% v/v MPD, 0.1 M bicine/Trizma base pH 8.5, 0.03 M diethyleneglycol, 0.03 M triethyleneglycol, 0.03 M tetraethyleneglycol, 0.03 M pentaethyleneglycol