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2E8Y

Crystal structure of pullulanase type I from Bacillus subtilis str. 168

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]173
Detector technologyCCD
Collection date2005-01-01
DetectorRIGAKU JUPITER 210
Wavelength(s)0.8000
Spacegroup nameP 21 21 21
Unit cell lengths70.562, 127.682, 189.251
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution15.000 - 2.110
R-factor0.201
Rwork0.201
R-free0.23800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2fgz
RMSD bond length0.005
RMSD bond angle1.200
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.3002.180
High resolution limit [Å]2.1002.100
Rmerge0.0780.314
Number of reflections99003
<I/σ(I)>6.8
Completeness [%]99.699.6
Redundancy65.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.229310% PEG 4000, 0.1M sodium acetate buffer, 0.2M magnesium acetate, pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

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