Ligand name: yatakemycin-adenine nucleobase adduct
PDB ligand accession: YTA
DrugBank: n/a
PubChem: 137350198
ChEMBL: n/a
InChI Key: FJMCEQLVMJYVHU-QGZVFWFLSA-N
SMILES: COc1cc2c(cc1O)cc([nH]2)C(=O)N3CC(c4c3cc(c5c4cc([nH]5)C(=O)N6CCc7c6c(c(c8c7cc([nH]8)C(=O)SC)OC)O)O)Cn9cnc(c-1ncnc91)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Pyrroloindoles

List of PDB structures and/or AlphaFold models with target protein C2T7T7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5UUF	Download	Experimental	e5uufA1	Repetitive alpha hairpins	LigPlot
5UUH	Download	Experimental	e5uuhA1	Repetitive alpha hairpins	LigPlot
5UUG	Download	Experimental	e5uugA1	Repetitive alpha hairpins	LigPlot