6GTV

Crystal structure of a FimH*DsG complex from E.coli F18 with bound trimannose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-10-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.00001
Spacegroup name	C 2 2 2
Unit cell lengths	116.690, 119.210, 120.090
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.727 - 2.100
R-factor	0.1892
Rwork	0.188
R-free	0.21720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4xoe
RMSD bond length	0.004
RMSD bond angle	0.832
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.727	2.220
High resolution limit [Å]	2.100	2.100
Rmeas	0.106	1.151
Number of reflections	49075	7428
<I/σ(I)>	13	1.8
Completeness [%]	99.9	99.7
Redundancy	6.6	6.4
CC(1/2)	0.998	0.729

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.2 M CaCl2, 0.1 M Hepes pH 7.5, 28% PEG 400