7NSS

Bdellovibrio bacteriovorus PGI in P3121 spacegroup

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	2016-06-08
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9795
Spacegroup name	P 31 2 1
Unit cell lengths	101.030, 101.030, 76.700
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	57.740 - 1.840
R-factor	0.1908
Rwork	0.189
R-free	0.22060
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1b0z
RMSD bond length	0.009
RMSD bond angle	1.476
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.740	1.870
High resolution limit [Å]	1.840	1.840
Rmerge	0.101	1.919
Rmeas	0.106
Rpim	0.034	0.821
Number of reflections	37920	2876
<I/σ(I)>	23.2	1.3
Completeness [%]	95.8
Redundancy	18.7
CC(1/2)	1.000	0.559

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 and 20% PEG 4000