7NTG

Bdellovibrio bacteriovorus PGI in complex with fructose-6-phosphate

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	2019-08-09
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97951
Spacegroup name	P 31 2 1
Unit cell lengths	101.200, 101.200, 76.380
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.820 - 1.670
R-factor	0.1799
Rwork	0.178
R-free	0.21670
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7nss
RMSD bond length	0.011
RMSD bond angle	1.630
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.820	1.700
High resolution limit [Å]	1.670	1.670
Rmerge	0.057	1.966
Rmeas	0.060	2.073
Rpim	0.019	0.655
Number of reflections	52651	3855
<I/σ(I)>	25	1.5
Completeness [%]	99.9	99.9
Redundancy	19.6	19.4
CC(1/2)	1.000	0.822

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	291	0.2 M ammonium acetate 0.1 M sodium acetate pH 5.0 20% PEG 4000