Ligand · O9E

O9E · ~{N}-[(1-ethyl-1,2,3-triazol-4-yl)methyl]-~{N},5-dimethyl-4-[2-[2-methyl-5-[methyl-[(1-propyl-1,2,3-triazol-4-yl)methyl]carbamoyl]thiophen-3-yl]cyclopenten-1-yl]thiophene-2-carboxamide

O9E, ~{N}-[(1-ethyl-1,2,3-triazol-4-yl)methyl]-~{N},5-dimethyl-4-[2-[2-methyl-5-[methyl-[(1-propyl-1,2,3-triazol-4-yl)methyl]carbamoyl]thiophen-3-yl]cyclopenten-1-yl]thiophene-2-carboxamide (C30 H38 N8 O2 S2, 606.8 g/mol), in the MolNFT…

Component: O9E
Formula: C30 H38 N8 O2 S2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

O9E in 2 structures; the first of them:

6Y4Q · Structure of a stapled peptide bound to MDM2 · O9E C1001 · binds LYS51, LEU54, PHE55, GLN59, MET62, THR2, PHE3, GLY4 and 5 more
6Y4Q · Structure of a stapled peptide bound to MDM2 · O9E C1001 · binds LYS51, LEU54, PHE55, GLN59, MET62, THR2, PHE3, GLY4 and 4 more

Residues it binds most

ALA 4, PHE 4, GLN 4, GLU 4, GLY 4, LEU 4, LYS 4, TRP 4, MET 3, THR 3 (residue and the binding sites it lines).

Found with

ACE · Acetyl group

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