5J43

CdiA-CT from uropathogenic Escherichia coli in complex with 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	2012-06-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 41
Unit cell lengths	64.010, 64.010, 365.370
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.919 - 2.700
R-factor	0.2016
Rwork	0.200
R-free	0.22420
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1oas
RMSD bond length	0.009
RMSD bond angle	1.225
Data reduction software	iMOSFLM ((iMosflm: 7.2.1))
Phasing software	PHENIX ((Phaser-MR: 1.10.1_2155))
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall
Low resolution limit [Å]	64.010
High resolution limit [Å]	2.700
Number of reflections	39863
<I/σ(I)>	9.9
Completeness [%]	99.4
Redundancy	12.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.2 M sodium sulfate, 0.1 M bis-tris propane, pH 7.9, 20% PEG 3350