3RGT

Crystal structure of d-mannonate dehydratase from Chromohalobacter salexigens complexed with D-Arabinohydroxamate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2011-03-18
Detector	ADSC QUANTUM 4
Wavelength(s)	0.97915
Spacegroup name	P 21 21 2
Unit cell lengths	110.712, 179.657, 85.422
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.848 - 1.900
R-factor	0.1798
Rwork	0.178
R-free	0.22190
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ow1
RMSD bond length	0.007
RMSD bond angle	1.058
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	BALBES
Refinement software	PHENIX ((phenix.refine: 1.6.4_486))

Data quality characteristics

	Overall
Low resolution limit [Å]	39.848
High resolution limit [Å]	1.900
Number of reflections	133334
Completeness [%]	99.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	20% Polyvinylpyrrolidone, 0.1M Tris, 0.01M Cobalt chloride, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K