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5YA8

Crystal structure of scyllo-inositol dehydrogenase with L-glucose dehydrogenase activity complexed with myo-inositol

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]95
Detector technologyCCD
Collection date2010-11-06
DetectorADSC QUANTUM 210r
Wavelength(s)1.0000
Spacegroup nameP 21 21 21
Unit cell lengths86.211, 120.152, 140.596
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution49.300 - 2.300
R-factor0.19394
Rwork0.192
R-free0.22434
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5yab
RMSD bond length0.014
RMSD bond angle1.652
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0107)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.340
High resolution limit [Å]2.3002.300
Rmerge0.2030.952
Number of reflections64176
<I/σ(I)>7.81.8
Completeness [%]98.395.8
Redundancy3.63.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2930.1 M sodium acetate pH 4.8 - 5.4, and 12 - 35% PEG3350

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