4HCD

Crystal structure of D-glucarate dehydratase from agrobacterium tumefaciens complexed with magnesium

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X9A
Synchrotron site	NSLS
Beamline	X9A
Temperature [K]	100
Detector technology	CCD
Collection date	2003-11-20
Detector	MARRESEARCH
Wavelength(s)	0.979
Spacegroup name	I 4 2 2
Unit cell lengths	118.733, 118.733, 133.199
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.913 - 1.700
R-factor	0.155
Rwork	0.153
R-free	0.18550
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	1.100
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall
Low resolution limit [Å]	24.913
High resolution limit [Å]	1.700
Number of reflections	52225
Completeness [%]	99.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	3.0M SODIUM CHLORIDE, 0.1M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K