PDB ligand accession: 1E5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JGGHMGTXTAKFQV-UHFFFAOYSA-N
SMILES: c1cc(ncc1C(=O)O)c2cc(cc(c2)F)OCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4I9N | Download | Experimental | e4i9nA4 e4i9nA1 e4i9nB4 e4i9nB2 e4i9nC3 e4i9nC2 e4i9nD1 e4i9nD2 e4i9nE1 e4i9nE2 e4i9nF1 e4i9nF2 e4i9nG1 e4i9nG2 e4i9nH1 e4i9nH2 | Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like | LigPlot |