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1WDP

The role of an inner loop in the catalytic mechanism of soybean beta-amylase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL41XU
Synchrotron siteSPring-8
BeamlineBL41XU
Temperature [K]298
Detector technologyIMAGE PLATE
Collection date2003-11-29
DetectorRIGAKU RAXIS V
Wavelength(s)0.71
Spacegroup nameP 31 2 1
Unit cell lengths84.888, 84.888, 143.397
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution10.000 - 1.270
R-factor0.134
R-free0.17370
Structure solution methodAB INITIO
RMSD bond length0.014
RMSD bond angle0.030
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS (1.1)
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.290
High resolution limit [Å]1.2501.250
Number of reflections163644
Completeness [%]99.0100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.4277ammonium sulfate, sodium acetate, 2-mercaptoethanol, EDTA, pH 5.4, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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