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4ZFY

Structural studies on a non-toxic homologue of type II RIPs from Momordica charantia (bitter gourd) in complex with ALPHA-METHYL-D-GALACTOSIDE

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2014-03-18
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54179
Spacegroup nameP 21 21 2
Unit cell lengths110.300, 136.990, 44.400
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution58.190 - 2.420
R-factor0.224
Rwork0.221
R-free0.28700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4z8s
RMSD bond length0.010
RMSD bond angle1.468
Data scaling softwareSCALA (3.3.20)
Phasing softwarePHASER (2.5.1)
Refinement softwareREFMAC (5.8.0107)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]68.5002.550
High resolution limit [Å]2.4202.420
Rmerge0.131
Number of reflections25685
<I/σ(I)>9.21.8
Completeness [%]97.397
Redundancy5.75.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.32980.1M HEPES, 20% w/v PEG 10000

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