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Ligand · 20Y

20Y · 4-(acetylamino)-N-[2-amino-5-(thiophen-2-yl)phenyl]benzamide

20Y, 4-(acetylamino)-N-[2-amino-5-(thiophen-2-yl)phenyl]benzamide (C19 H17 N3 O2 S, 351.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
20Y
Formula
C19 H17 N3 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

20Y in 2 structures; the first of them:

  • 4LY1 · Structure of Human HDAC2 in complex with inhibitor… · 20Y A407 · binds TYR29, MET35, ARG39, ASP104, PHE114, GLY143, LEU144, HIS145 and 13 more
  • 4LY1 · Structure of human HDAC2 in complex with inhibitor 4-(acetylamino)-N… · 20Y A407 · binds TYR29, MET35, ARG39, ASP104, PHE114, GLY143, LEU144, HIS145 and 13 more

Residues it binds most

GLY 6, HIS 6, PHE 6, ASP 6, LEU 6, TYR 6, ARG 6, CYS 6, GLN 6, MET 6 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • NA · Sodium ion
  • ZN · Zinc ion
  • NHE · 2-[N-cyclohexylamino]ethane sulfonic acid
  • PG4 · Tetraethylene glycol

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