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Ligand · 8NT

8NT · 3-[5-[(3~{S})-1,2-dithiolan-3-yl]pentanoylamino]propane-1-sulfonic acid

8NT, 3-[5-[(3~{S})-1,2-dithiolan-3-yl]pentanoylamino]propane-1-sulfonic acid (C11 H21 N O4 S3, 327.5 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…

Component
8NT
Formula
C11 H21 N O4 S3
Class
ligand
Structures
2
PDB entries
1

Binding sites

8NT in 2 structures; the first of them:

  • 5N5J · Human MMP12 in complex with 3-(5-(1,2-dithiolan-3-yl)pentanamido)propane-1-sulfonate · 8NT A307 · binds GLY179, ILE180, LEU181, ALA182, LEU214, THR215, HIS218, GLU219 and 7 more
  • 5N5J · Human MMP12 in complex with 3-(5-(1,2-dithiolan-3-YL)PENTANAMIDO) propane-1-sulfonate · 8NT A307 · binds GLY179, ILE180, LEU181, ALA182, LEU214, THR215, HIS218, GLU219 and 6 more

Residues it binds most

LEU 2, THR 2, ALA 2, GLU 2, GLY 2, HIS 2, ILE 2, LYS 2, PHE 2, PRO 2 (residue and the binding sites it lines).

Found with

  • HAE · Acetohydroxamic acid
  • CA · Calcium ion
  • ZN · Zinc ion

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