3V5F

Crystal structure of the mutant E234A of Galacturonate Dehydratase from GEOBACILLUS SP. complexed with Mg

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2011-11-04
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.075
Spacegroup name	I 21 21 21
Unit cell lengths	105.986, 122.853, 134.263
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.747 - 2.000
R-factor	0.1954
Rwork	0.194
R-free	0.21840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3p3b
RMSD bond length	0.007
RMSD bond angle	1.100
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	BALBES
Refinement software	PHENIX ((phenix.refine: 1.6.4_486))

Data quality characteristics

	Overall
Low resolution limit [Å]	45.747
High resolution limit [Å]	2.000
Number of reflections	58153
Completeness [%]	97.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	4.3M Sodium Chloride, 0.1M Hepes, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K