6ABT

Crystal structure of transcription factor from Listeria monocytogenes

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	273
Detector technology	CCD
Collection date	2017-12-17
Detector	ADSC QUANTUM 1
Wavelength(s)	1.0003
Spacegroup name	P 64
Unit cell lengths	67.024, 67.024, 90.288
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	58.040 - 2.800
R-factor	0.2573
Rwork	0.255
R-free	0.28830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6abq
RMSD bond length	0.011
RMSD bond angle	1.627
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0103)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	58.040	50.000	2.850
High resolution limit [Å]	2.800	7.590	2.800
Rmerge	0.080	0.051	0.334
Rmeas	0.086	0.056	0.360
Rpim	0.033	0.022	0.133
Number of reflections	5721	295	266
<I/σ(I)>	11.9
Completeness [%]	99.9	97.4	100
Redundancy	7.3	6.1	7.3
CC(1/2)		0.995	0.990

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.3	291	with 0.2 M calcium acetate, 0.1 M cacodylate acid, pH 6.3, and 48 % polyethylene glycol 600