PDB ligand accession: BE2
DrugBank: DB04166
PubChem: 227;3734162;
ChEMBL:
InChI Key: RWZYAGGXGHYGMB-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)C(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2GVQ | Download | Experimental | e2gvqA2 e2gvqA1 e2gvqB2 e2gvqC2 e2gvqC1 e2gvqD2 e2gvqD1 | Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase-N Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase-N Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase-N | LigPlot |
1ZYK | Download | Experimental | e1zykA2 e1zykA1 e1zykB2 e1zykC2 e1zykD2 e1zykD1 | Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase-N Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase catalytic domain Nucleoside phosphorylase/phosphoribosyltransferase-N | LigPlot |