Structure of PDB 2d3r Chain A Binding Site BS01

Receptor Information
>2d3r Chain A (length=236) Species: 83131 (Cratylia argentea) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADTIVAVELDTYPNTDIGDPNYQHIGINIKSIRSKATTRWNVQDGKVGTA
HISYNSVAKRLSAIVSYPGGSSATVSYDVDLNNILPEWVRVGLSASTGLY
KETNTILSWSFTSKLKTNSTADAQSLHFTFNQFSQNPKDLILQGDASTDS
DGNLQLTRVSNGSPQSNSVGRALYYAPVHVWDKSAVVASFDATFTFLIKS
TDSDIADGIAFFIANTDSSIPHGSGGRLLGLFPDAN
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain2d3r Chain A Residue 237 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2d3r Crystal structures of Cratylia floribunda seed lectin at acidic and basic pHs. Insights into the structural basis of the pH-dependent dimer-tetramer transition.
Resolution2.9 Å
Binding residue
(original residue number in PDB)
D10 Y12 N14 D19
Binding residue
(residue number reindexed from 1)
D10 Y12 N14 D19
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005537 D-mannose binding
GO:0030246 carbohydrate binding
GO:0046872 metal ion binding
GO:0090729 toxin activity
Biological Process
GO:0008150 biological_process
GO:0035821 modulation of process of another organism
Cellular Component
GO:0005575 cellular_component

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Molecular Function

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Biological Process

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Cellular Component
External links
PDB RCSB:2d3r, PDBe:2d3r, PDBj:2d3r
PDBsum2d3r
PubMed17251039
UniProtP81517|LECA_CRAAG Lectin alpha chain

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