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Ligand · ISK

ISK · 2-acetamido-N-(3-bromanylprop-2-ynyl)ethanamide

ISK, 2-acetamido-N-(3-bromanylprop-2-ynyl)ethanamide (C7 H9 Br N2 O2, 233.1 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
ISK
Formula
C7 H9 Br N2 O2
Class
ligand
Structures
2
PDB entries
2

Binding sites

ISK in 2 structures; the first of them:

  • 7GQ0 · PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3C Protease in… · ISK B201 · binds TYR31, VAL34, ASP58, ALA59, CYS60, ILE74, VAL75, LYS76 and 2 more
  • 7ZFY · BRD4 in complex with PepLite-Gly · ISK AAA201 · binds VAL87, LEU92, LEU94, TYR97, ASN135, CYS136, TYR139, ASN140 and 3 more

Residues it binds most

TYR 2, VAL 2, ASN 1, ASP 2, CYS 2, ILE 2, LEU 1, LYS 2, ALA 1, PHE 1 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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