Ligand name: (2R,3R)-N-[(1-{(3S,3aR,6S,6aR)-6-[4-({[(2R,3R)-2,3-dihydroxy-4-oxo-4-{[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]amino}butanoyl]amino}methyl)-1H-1,2,3-triazol-1-yl]hexahydrofuro[3,2-b]furan-3-yl}-1H-1,2,3-triazol-4-yl)methyl]-2,3-dihydroxy-N'-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]butanediamide (non-preferred name)
PDB ligand accession: QSG
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: JJYDUQGILJLGLW-XRTDXAHQSA-N
SMILES: c1c(nnn1C2COC3C2OCC3n4cc(nn4)CNC(=O)C(C(C(=O)NC5C(C(C(C(O5)CO)O)O)O)O)O)CNC(=O)C(C(C(=O)NC6C(C(C(C(O6)CO)O)O)O)O)O
Drug action: n/a
No PTM data available
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List of PDB structures and/or AlphaFold models with target protein P02872
| PDB/AF Accession |
PyMOL script |
Experimental / Predicted |
Interacting ECOD domains |
ECOD X-group name |
LigPlot |
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6V95
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Experimental
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e6v95A1 e6v95B1 e6v95C1 e6v95D1 |
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LigPlot
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