GL1X · GenesisL1 explorer

Ligand · 2YI

2YI · Methyl 3-[4-[(4-bromophenyl)methyl]piperazin-1-yl]carbonyl-5-[(2-ethyl-2-methanoyl-butanoyl) amino]benzoate

2YI, Methyl 3-[4-[(4-bromophenyl)methyl]piperazin-1-yl]carbonyl-5-[(2-ethyl-2-methanoyl-butanoyl) amino]benzoate (C27 H32 Br N3 O5, 558.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
2YI
Formula
C27 H32 Br N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

2YI in 2 structures; the first of them:

  • 7OR4 · Crystal structure of DPP8 in complex with a 4-oxo-b-lactam based inhibitor, B142 · 2YI B902 · binds TYR74, MET75, PHE667, TYR669, LYS685, TYR686, ARG688, LEU689 and 14 more
  • 7OR4 · Crystal structure of DPP8 in complex with a 4-oxo-B-lactam based inhibitor, B142 · 2YI B902 · binds TYR74, MET75, PHE667, TYR669, LYS685, TYR686, ARG688, LEU689 and 14 more

Residues it binds most

LEU 4, TYR 4, ARG 4, SER 4, ALA 4, ASP 4, GLU 4, LYS 4, MET 4, PHE 4 (residue and the binding sites it lines).

Found with

  • TMO · trimethylamine oxide

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.