PDB ligand accession: ITR
DrugBank: DB02988
PubChem: n/a
ChEMBL: n/a
InChI Key: LKYWXXAVLLVJAS-XFXZXTDPSA-N
SMILES: c1ccc2c(c1)c(c[nH]2)CC(=N)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indolyl carboxylic acids and derivatives
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1DDO | Download | Experimental | e1ddoA1 e1ddoA2 e1ddoB1 e1ddoB2 e1ddoC1 e1ddoC2 e1ddoD1 e1ddoD2 e1ddoE1 e1ddoE2 e1ddoF1 e1ddoF2 e1ddoG1 e1ddoG2 e1ddoH1 e1ddoH2 | FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |