3LWF

Crystal structure of Putative transcriptional regulator (NP_470886.1) from LISTERIA INNOCUA at 2.06 A resolution

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL11-1
Synchrotron site	SSRL
Beamline	BL11-1
Temperature [K]	100
Detector technology	CCD
Collection date	2009-12-03
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.97925,0.91837,0.97898
Spacegroup name	C 1 2 1
Unit cell lengths	108.961, 115.782, 75.927
Unit cell angles	90.00, 120.70, 90.00

Refinement procedure

Resolution	72.830 - 2.060
R-factor	0.182
Rwork	0.180
R-free	0.21800
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.446
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC (5.5.0102)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	72.830	72.830	2.130
High resolution limit [Å]	2.060	4.420	2.060
Rmerge	0.083	0.039	0.639
Number of reflections	49880	5087	4716
<I/σ(I)>	10.62	28.7	2
Completeness [%]	99.4	98.4	99.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	10.3	293	1.9500M ammonium sulfate, 0.2000M lithium sulfate, 0.1M CAPS pH 10.3, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 293K