Ligand name: 2-(OXALYL-AMINO)-4,5,6,7-TETRAHYDRO-THIENO[2,3-C]PYRIDINE-3-CARBOXYLIC ACID
PDB ligand accession: OTA
DrugBank: DB03670
PubChem: 444766
ChEMBL: CHEMBL139393
InChI Key: ZIBMATWHOAGNTR-UHFFFAOYSA-N
SMILES: C1CNCc2c1c(c(s2)NC(=O)C(=O)O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P18031

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5KA7	Download	Experimental	e5ka7A1	Flavodoxin-like	LigPlot
5KAB	Download	Experimental	e5kabA1	Flavodoxin-like	LigPlot
7MOW	Download	Experimental	e7mowA1	Flavodoxin-like	LigPlot
5KAD	Download	Experimental	e5kadA1 e5kadB1	Flavodoxin-like Flavodoxin-like	LigPlot
5K9W	Download	Experimental	e5k9wA1	Flavodoxin-like	LigPlot
7MND	Download	Experimental	e7mndA1	Flavodoxin-like	LigPlot
7MNB	Download	Experimental	e7mnbA1	Flavodoxin-like	LigPlot
1C88	Download	Experimental	e1c88A1	Flavodoxin-like	LigPlot
5KA1	Download	Experimental	e5ka1A1	Flavodoxin-like	LigPlot
5KA3	Download	Experimental	e5ka3A1	Flavodoxin-like	LigPlot
7MNF	Download	Experimental	e7mnfA1	Flavodoxin-like	LigPlot
7MN7	Download	Experimental	e7mn7A1	Flavodoxin-like	LigPlot
5KA9	Download	Experimental	e5ka9A1	Flavodoxin-like	LigPlot
7MNA	Download	Experimental	e7mnaA1	Flavodoxin-like	LigPlot
7MM1	Download	Experimental	e7mm1A1	Flavodoxin-like	LigPlot