Ligand name: N-[2(R)-HYDROXY-1(S)-INDANYL]-5-[(2(S)-TERTIARY BUTYLAMINOCARBONYL)-4(3-PYRIDYLMETHYL)PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYLPENTANAMIDE
PDB ligand accession: MK1
DrugBank: DB00224
PubChem: 5362440
ChEMBL: CHEMBL115
InChI Key: CBVCZFGXHXORBI-PXQQMZJSSA-N
SMILES: CC(C)(C)NC(=O)C1CN(CCN1CC(CC(Cc2ccccc2)C(=O)NC3c4ccccc4CC3O)O)Cc5cccnc5
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 PDB structures and/or AlphaFold models with target protein P03367

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1SGU	Download	Experimental	e1sguB1 e1sguA1	cradle loop barrel cradle loop barrel	LigPlot
1SDV	Download	Experimental	e1sdvA1 e1sdvB1	cradle loop barrel cradle loop barrel	LigPlot
2B7Z	Download	Experimental	e2b7zB1 e2b7zA1	cradle loop barrel cradle loop barrel	LigPlot
1SDU	Download	Experimental	e1sduB1 e1sduA1	cradle loop barrel cradle loop barrel	LigPlot
1HSG	Download	Experimental	e1hsgA1 e1hsgB1	cradle loop barrel cradle loop barrel	LigPlot
1SDT	Download	Experimental	e1sdtA1 e1sdtB1	cradle loop barrel cradle loop barrel	LigPlot