6VMH

Crystal structure of transcriptional regulator from bacteriophage 186

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-02-28
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.95
Spacegroup name	P 32 2 1
Unit cell lengths	59.860, 59.860, 112.970
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.930 - 2.750
R-factor	0.2209
Rwork	0.212
R-free	0.26530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6vli
Data reduction software	iMOSFLM
Data scaling software	Aimless (0.5.25)
Phasing software	Auto-Rickshaw
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.930	29.930	2.900
High resolution limit [Å]	2.750	8.700	2.750
Rmerge	0.480	0.228	1.312
Rmeas	0.501	0.242	1.366
Rpim	0.141	0.077	0.376
Total number of observations	80395	2282	11988
Number of reflections	6506	236	939
<I/σ(I)>	4.9	7.7	2.5
Completeness [%]	99.9	97.6	100
Redundancy	12.4	9.7	12.8
CC(1/2)	0.948	0.916	0.753

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		289.15	0.2 M ammonium acetate, 0.1 M HEPES pH 7.5, 25% w/v polyethylene glycol 3350