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3VIM

Crystal structure of beta-glucosidase from termite Neotermes koshunensis in complex with a new glucopyranosidic product

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSRRC BEAMLINE BL13B1
Synchrotron siteNSRRC
BeamlineBL13B1
Temperature [K]100
Detector technologyCCD
Collection date2009-03-26
DetectorADSC QUANTUM 315r
Wavelength(s)0.80000
Spacegroup nameC 1 2 1
Unit cell lengths93.124, 68.557, 75.455
Unit cell angles90.00, 95.72, 90.00
Refinement procedure
Resolution19.200 - 1.030
R-factor0.12832
Rwork0.128
R-free0.14299
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ahz
RMSD bond length0.006
RMSD bond angle1.382
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.070
High resolution limit [Å]1.0301.030
Rmerge0.0450.536
Number of reflections223573
<I/σ(I)>312.5
Completeness [%]96.494.5
Redundancy4.84.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52980.1M Bis-Tris, 18-21%(w/v) PEG 3350, 0.1-0.25M MgCl2, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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