6O8B

Crystal structure of STING CTD in complex with TBK1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	120
Detector technology	PIXEL
Collection date	2017-04-15
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0
Spacegroup name	P 65 2 2
Unit cell lengths	250.690, 250.690, 239.241
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	82.058 - 3.400
R-factor	0.2442
Rwork	0.243
R-free	0.25780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4im2
RMSD bond length	0.002
RMSD bond angle	0.577
Data reduction software	iMOSFLM
Data scaling software	pointless
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	82.058	3.490
High resolution limit [Å]	3.400	3.400
Rmerge	0.152	2.000
Rpim	0.063	0.860
Number of reflections	60675	4434
<I/σ(I)>	7.8
Completeness [%]	99.3	5.9
Redundancy	6.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	277	0.8 M (NH4)2SO4, 0.1 M BIS-TRIS pH 5.5 and 1% PEG3350