Attributes
UniProt ID
Protein Name
PA-I galactophilic lectin
Ligand Name
(2R,3R,4S,5R,6R,2'R,3'R,4'S,5'R,6'R)-2,2'-([(2R,3R,4S,5S,6S)-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2,5-diyl]bis{1H-1,2,3-triazole-1,4-diyl[(2S,3R,4S,5S,6S)-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2,5-diyl]-1H-1,2,3-triazole-1,4-diylpropane-3,1-diyloxy})bis[6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol]
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LHMBJXKVNLAJJD-QFAUSYGLSA-N
SMILES
c1c(nnn1C2C(OC(C(C2O)O)c3cn(nn3)C4C(OC(C(C4O)O)n5cc(nn5)C6C(C(C(C(O6)CO)n7cc(nn7)CCCOC8C(C(C(C(O8)CO)O)O)O)O)O)CO)CO)CCCOC9C(C(C(C(O9)CO)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4YW7
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Color Legend
Unassigned regionsLigand / hetero atomse4yw7A1e4yw7B1e4yw7C1e4yw7D1e4yw7E1e4yw7F1e4yw7G1e4yw7H1e4yw7I1e4yw7J1e4yw7K1e4yw7L1e4yw7M1e4yw7N1e4yw7O1e4yw7P1