6SY9

Structure of the Legionella pneumophila response regulator LqsR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-17
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	50.100, 67.840, 116.600
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.031 - 2.100
R-factor	0.2035
Rwork	0.202
R-free	0.22820
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	HKL2Map
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.031	46.031	2.150
High resolution limit [Å]	2.100	9.390	2.100
Rmerge	0.089	0.020	1.950
Rmeas	0.093	0.021	2.027
Total number of observations	311660
Number of reflections	23899	318	1732
<I/σ(I)>	20.98	83.16	1.67
Completeness [%]	100.0	99.1	100
Redundancy	13.041	10.151	13.577
CC(1/2)	1.000	1.000	0.639

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	0.1M Sodium formate, 0.1M Bis-Tris propane, 18% (w/v) PEG 3350