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Ligand · 2S7

2S7 · 4-(3-{4-[(S)-cyclopentyl(hydroxy)pyridin-2-ylmethyl]piperidin-1-yl}propoxy)benzonitrile

2S7, 4-(3-{4-[(S)-cyclopentyl(hydroxy)pyridin-2-ylmethyl]piperidin-1-yl}propoxy)benzonitrile (C26 H33 N3 O2, 419.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
2S7
Formula
C26 H33 N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

2S7 in 2 structures; the first of them:

  • 4OG5 · Human menin with bound inhibitor MIV-5 · 2S7 A601 · binds SER155, LEU177, SER178, GLU179, ASP180, HIS181, ALA182, PHE238 and 12 more
  • 4OG5 · Human menin with bound inhibitor miv-5 · 2S7 A601 · binds SER155, LEU177, SER178, GLU179, ASP180, HIS181, ALA182, PHE238 and 12 more

Residues it binds most

ALA 2, TYR 2, GLU 2, MET 2, SER 2, ASP 2, CYS 2, GLY 2, HIS 2, LEU 2 (residue and the binding sites it lines).

Found with

  • TBF · Tert-butyl formate
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • PEG · Di(hydroxyethyl)ether
  • PG4 · Tetraethylene glycol

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