5J5V

CdiA-CT from uropathogenic Escherichia coli in complex with cognate immunity protein and CysK

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL7-1
Synchrotron site	SSRL
Beamline	BL7-1
Temperature [K]	70
Detector technology	CCD
Collection date	2013-01-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	C 2 2 21
Unit cell lengths	81.251, 195.539, 175.061
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.825 - 2.750
R-factor	0.1976
Rwork	0.196
R-free	0.24810
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5j43
RMSD bond length	0.011
RMSD bond angle	1.072
Data reduction software	HKL-2000
Phasing software	PHENIX ((Phaser-MR: 1.10.1_2155))
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	48.825
High resolution limit [Å]	2.750
Number of reflections	36681
<I/σ(I)>	10.41
Completeness [%]	100.0
Redundancy	14.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.1	293	0.1 M sodium cacodylate (pH 7.1), 0.2 M ammonium sulfate, 17% (w/v) PEG-8000