6HC1

Bdellovibrio bacteriovorus DgcB FHA in complex with phosphorylated N-terminal peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-12
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9282
Spacegroup name	P 65 2 2
Unit cell lengths	68.750, 68.750, 191.000
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	59.540 - 1.490
R-factor	0.1437
Rwork	0.142
R-free	0.17750
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.698
Data reduction software	XDS
Data scaling software	Aimless (0.5.31)
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	59.540	56.840	1.530
High resolution limit [Å]	1.490	6.660	1.490
Rmerge	0.130	0.065	2.796
Rmeas	0.132	0.066	2.856
Rpim	0.022	0.012	0.578
Total number of observations		18340	78317
Number of reflections	44707	644	3238
<I/σ(I)>	16.1	45.1	1.2
Completeness [%]	100.0	99.9	100
Redundancy	33.5	28.5	24.2
CC(1/2)	0.999	0.999	0.545

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	0.1M sodium hepes pH 7, 20% PEG8000