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3KLL

Crystal structure of Lactobacillus reuteri N-terminally truncated glucansucrase GTF180-maltose complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsEMBL/DESY, HAMBURG BEAMLINE BW7A
Synchrotron siteEMBL/DESY, HAMBURG
BeamlineBW7A
Temperature [K]100
Detector technologyCCD
Collection date2006-02-24
DetectorMAR CCD 165 mm
Wavelength(s)0.9760
Spacegroup nameP 1
Unit cell lengths58.165, 65.850, 82.317
Unit cell angles73.44, 78.57, 86.34
Refinement procedure
Resolution20.000 - 2.000
R-factor0.165
Rwork0.163
R-free0.19900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3klk
RMSD bond length0.015
RMSD bond angle1.403
Data reduction softwareXDS
Data scaling softwareSCALA (3.3.9)
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0088)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]38.7472.100
High resolution limit [Å]1.9972.000
Number of reflections75992
<I/σ(I)>4.3
Completeness [%]97.594
Redundancy2.42.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6293PEG 3350, BIS-TRIS propane buffer, CaCl2, pH 6.0, vapor diffusion, hanging drop, temperature 293K

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