Ligand name: 4-[2-(3-chlorophenyl)acetamido]-N-methylisoquinoline-7-carboxamide
PDB ligand accession: RK6
DrugBank: n/a
PubChem: 169408356
ChEMBL: n/a
InChI Key: YTZPJQXEGVHVLU-UHFFFAOYSA-N
SMILES: CNC(=O)c1ccc2c(c1)cncc2NC(=O)Cc3cccc(c3)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Isoquinolines and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P0DTD1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7GMI	Download	Experimental	e7gmiA1 e7gmiA2 e7gmiB1 e7gmiA1 e7gmiA2 e7gmiB1 e7gmiB2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot