6M8O

Crystal structure of the receiver domain of LytR from Staphylococcus aureus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2013-08-15
Detector	RAYONIX MX-300
Wavelength(s)	0.9795
Spacegroup name	P 61 2 2
Unit cell lengths	84.747, 84.747, 157.304
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.700 - 2.500
R-factor	0.20136
Rwork	0.199
R-free	0.23666
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2qvo
RMSD bond length	0.022
RMSD bond angle	2.306
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASES
Refinement software	REFMAC (5.8.0230)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.660	2.600
High resolution limit [Å]	2.500	2.500
Rmerge	0.087	2.607
Rmeas	0.089	2.669
Rpim	0.026	0.781
Number of reflections	12211	1323
<I/σ(I)>	20.3	1.8
Completeness [%]	99.9	99.7
Redundancy	20.9	21.5
CC(1/2)	0.998	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	277	100 mM MES (pH 6.5), 1.6 M magnesium sulfate heptahydrate