Attributes
UniProt ID
Protein Name
CD1d1 antigen
Ligand Name
N-[(2S,3S,4R)-3,4-dihydroxy-8-oxo-8-[(6-phenylhexyl)amino]-1-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}octan-2-yl]icosanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XSVXHEMLPLUNSG-DOWKDNTMSA-N
SMILES
CCCCCCCCCCCCCCCCCCCC(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C(CCCC(=O)NCCCCCCc2ccccc2)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6C6C
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Color Legend
Unassigned regionsLigand / hetero atomse6c6cA1e6c6cA2e6c6cB1
ECOD domains from experimental PDB structures interacting with ligand EMG
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A0R4J090 | n/a | EMG | 6c6c | e6c6cA1 | A:7-185 |
| A0A0R4J090 | n/a | EMG | 6cxa | e6cxaA2 | A:7-185 |