4PWP

Crystal structure of DsbA from the Gram positive bacterium Corynebacterium diphtheriae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-06-26
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	48.819, 68.435, 69.139
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.856 - 1.803
R-factor	0.1668
Rwork	0.163
R-free	0.20410
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	1.056
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	2.030	1.830
High resolution limit [Å]	1.480	1.980	1.800
Number of reflections	40982
Completeness [%]	99.7	99.9	99.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	287	30% PEG 2K, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 287K