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Ligand · 0E9

0E9 · benzyl [(1R,4S,6S,9R)-4,6-dibenzyl-5-hydroxy-1,9-bis(1-methylethyl)-2,8,11-trioxo-13-phenyl-12-oxa-3,7,10-triazatridec-1-yl]carbamate

0E9, benzyl [(1R,4S,6S,9R)-4,6-dibenzyl-5-hydroxy-1,9-bis(1-methylethyl)-2,8,11-trioxo-13-phenyl-12-oxa-3,7,10-triazatridec-1-yl]carbamate (C43 H52 N4 O7, 736.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
0E9
Formula
C43 H52 N4 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

0E9 in 2 structures; the first of them:

  • 9HVP · Design, activity and 2.8 Angstroms crystal structure of a C2 symmetric inhibitor… · 0E9 A100 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 23 more
  • 9HVP · Design, activity and 2.8 ångströms crystal structure of a C2 symmetric inhibitor… · 0E9 A100 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 23 more

Residues it binds most

ASP 2, GLY 2, ILE 2, VAL 2, ALA 2, LEU 2, PRO 2, ARG 2, MET 2, PHE 2 (residue and the binding sites it lines).

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