8SUK

Structure of Rhodococcus sp. USK13 DarR-c-di-AMP complex

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]	100
Detector technology	PIXEL
Collection date	2023-01-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	244.542, 38.981, 115.641
Unit cell angles	90.00, 91.41, 90.00

Refinement procedure

Resolution	41.490 - 2.450
R-factor	0.2169
Rwork	0.215
R-free	0.26010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.939
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.490	2.520
High resolution limit [Å]	2.450	2.450
Rpim	0.070	0.378
Number of reflections	40140	2175
<I/σ(I)>	5.8	1.1
Completeness [%]	98.0
Redundancy	3.2
CC(1/2)	0.989	0.654

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		274	0.1 M Tris pH 8.5, 1.34 M lithium sulphate and 1.3% PEG 400