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3U4X

Crystal structure of a lectin from Camptosema pedicellatum seeds in complex with 5-bromo-4-chloro-3-indolyl-alpha-D-mannose

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsLNLS BEAMLINE D03B-MX1
Synchrotron siteLNLS
BeamlineD03B-MX1
Temperature [K]100
Detector technologyCCD
Collection date2008-03-18
DetectorMAR CCD 165 mm
Wavelength(s)1.42
Spacegroup nameI 2 2 2
Unit cell lengths65.940, 66.780, 107.700
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution21.510 - 2.160
R-factor0.1925
Rwork0.190
R-free0.23680
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.020
RMSD bond angle1.924
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]21.5102.215
High resolution limit [Å]2.1602.160
Rmerge0.147
Number of reflections12708
Completeness [%]94.794.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5310Hepes, Ammonium sulfate, PEG 400, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 310K

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