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3MIU

Structure of Banana Lectin-pentamannose complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2005-08-08
DetectorMARRESEARCH
Wavelength(s)1.54
Spacegroup nameP 32 2 1
Unit cell lengths80.911, 80.911, 147.405
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution24.920 - 2.630
R-factor0.21875
Rwork0.217
R-free0.24335
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1x1v
RMSD bond length0.009
RMSD bond angle1.279
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.720
High resolution limit [Å]2.6302.630
Rmerge0.0660.428
Number of reflections17137
<I/σ(I)>334.9
Completeness [%]99.798.7
Redundancy8.76
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8298ZINC ACETATE DIHYDRATE, SODIUM CACODYLATE, 1,6-HEXANEDIOL, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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