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2D0D

Crystal Structure of a Meta-cleavage Product Hydrolase (CumD) A129V Mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-6A
Synchrotron sitePhoton Factory
BeamlineBL-6A
Temperature [K]100
Detector technologyCCD
Collection date2004-10-22
DetectorADSC QUANTUM 4
Wavelength(s)1.0
Spacegroup nameC 2 2 21
Unit cell lengths76.650, 116.623, 78.640
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution46.840 - 1.650
R-factor0.173
Rwork0.173
R-free0.19100
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1iup
RMSD bond length0.005
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.8401.710
High resolution limit [Å]1.6501.650
Number of reflections42732
<I/σ(I)>265.5
Completeness [%]100.0100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.2298PEG 3000, sodium phosphate/citrate, sodium chloride, pH 4.2, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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