Ligand name: 1,4-dihydroxy-2-naphthoic acid
PDB ligand accession: DNA
DrugBank: n/a
PubChem: 671
ChEMBL: CHEMBL1232286
InChI Key: VOJUXHHACRXLTD-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)c(cc(c2O)C(=O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Naphthalenes
      • Subclass: Naphthalenecarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P9WK11

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6O0J	Download	Experimental	e6o0jA1 e6o0jA2 e6o0jD3 e6o0jA1 e6o0jD1 e6o0jD3 e6o0jB2 e6o0jB2 e6o0jB3 e6o0jC1 e6o0jA1 e6o0jB2 e6o0jC1 e6o0jC2	Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like	LigPlot
6O0N	Download	Experimental	e6o0nA2 e6o0nA3 e6o0nB1 e6o0nB3 e6o0nB1 e6o0nC1 e6o0nC2 e6o0nA3 e6o0nD1 e6o0nD2	Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding)	LigPlot
6O0G	Download	Experimental	e6o0gA1 e6o0gA2 e6o0gD2 e6o0gA2 e6o0gD2 e6o0gD3 e6o0gB1 e6o0gB1 e6o0gB3 e6o0gC3 e6o0gB1 e6o0gC1 e6o0gC3	Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding)	LigPlot
6O04	Download	Experimental	e6o04A1 e6o04A3 e6o04D2 e6o04A3 e6o04D1 e6o04D2 e6o04D2 e6o04B1 e6o04B3 e6o04C3 e6o04A3 e6o04B3 e6o04C2 e6o04C3	Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding)	LigPlot