6JQ4

HIGA Escherichia coli-K12

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-01
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0
Spacegroup name	P 62 2 2
Unit cell lengths	79.880, 79.880, 90.530
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.940 - 2.000
R-factor	0.2502
Rwork	0.249
R-free	0.27880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ifg
RMSD bond length	0.007
RMSD bond angle	1.026
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.7.2_869)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.940	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	0.068	0.641
Number of reflections	12045	858
<I/σ(I)>	27.9
Completeness [%]	100.0	100
Redundancy	18.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2M Ca(AC)2, 0.1M sodium cacodylate, pH 6.5, 40% PEG300