Ligand name: amino{[(4S)-5-[(2R,4R)-2-carboxy-4-methylpiperidin-1-yl]-4-({[(3R)-3-methyl-1,2,3,4-tetrahydroquinolin-8-yl]sulfonyl}amino)-5-oxopentyl]amino}methaniminium
PDB ligand accession: MIT
DrugBank: n/a
PubChem: 445426
ChEMBL: n/a
InChI Key: KXNPVXPOPUZYGB-XYVMCAHJSA-O
SMILES: CC1CCN(C(C1)C(=O)O)C(=O)C(CCCNC(=[NH2+])N)NS(=O)(=O)c2cccc3c2NCC(C3)C

ClassyFire chemical classification:

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

List of proteins that are targets for MIT

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P00734_MIT	P00734	n/a
2	P00735_MIT	P00735	n/a