6O6P

Structure of the regulator FasR from Mycobacterium tuberculosis in complex with DNA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-02
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97948
Spacegroup name	C 2 2 21
Unit cell lengths	61.697, 174.680, 158.169
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.066 - 3.851
R-factor	0.2919
Rwork	0.287
R-free	0.33150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6o6n
Data reduction software	TRUNCATE
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	39.540	39.540	4.310
High resolution limit [Å]	3.850	8.610	3.850
Rmerge	0.166	0.063	1.454
Rmeas	0.176	0.066	1.581
Rpim	0.055	0.020	0.595
Number of reflections	6467	821	1452
<I/σ(I)>	8.3
Completeness [%]	76.5	99	62.3
Redundancy	8.6	11	5.6
CC(1/2)	0.997	0.998	0.623

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293	28% PEG2000 MME, 0.25 M ammonium citrate, 0.1 M imidazole