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1VFM

Crystal structure of Thermoactinomyces vulgaris R-47 alpha-amylase 2/alpha-cyclodextrin complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44XU
Synchrotron siteSPring-8
BeamlineBL44XU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2003-03-10
DetectorMACSCIENCE
Wavelength(s)0.9
Spacegroup nameP 21 21 21
Unit cell lengths115.395, 118.428, 113.690
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution40.490 - 2.900
R-factor0.191
Rwork0.191
R-free0.24800
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle1.300
Data reduction softwareMOSFLM
Data scaling softwareCCP4 ((SCALA))
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.5003.060
High resolution limit [Å]2.9002.900
Number of reflections89750
Completeness [%]100.093.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.1298PEG20000, calcium chloride, MES, pH 6.1, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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