6HVL

CdaA complex with c-di-AMP and AMP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	180
Detector technology	PIXEL
Collection date	2017-06-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.976200
Spacegroup name	H 3 2
Unit cell lengths	121.900, 121.900, 141.160
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.271 - 2.800
R-factor	0.1899
Rwork	0.188
R-free	0.23370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rv7
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	42.271	50.000	2.900
High resolution limit [Å]	2.800	42.271	2.800
Rmerge	0.109	0.020	0.805
Rmeas	0.118	0.023	0.877
Number of reflections	9435	2	941
<I/σ(I)>	12.39	31.17	1.93
Completeness [%]	93.1	66.7	95.4
Redundancy	5.649	3	5.682
CC(1/2)	0.998		0.726

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.2 m Ca(CH3OO)2, 0.1 M Na-HEPES pH 7.5, 10 % w/v PEG8000,