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Ligand · 9AI

9AI · N-prop-2-en-1-ylthioformamide

9AI, N-prop-2-en-1-ylthioformamide (C4 H7 N S, 101.2 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 binds most and the ligands found with…

Component
9AI
Formula
C4 H7 N S
Class
ligand
Structures
2
PDB entries
1

Binding sites

9AI in 2 structures; the first of them:

  • 7BIC · Crystal structure of human GSTA1-1 bound to allyl-isothiocyanate · 9AI B401 · binds LEU108, CYS112, GLU116, LYS120
  • 7BIC · Crystal structure of human GSTA1-1 bound to allyl-isothiocyanate · 9AI B401 · binds LEU108, CYS112, GLU116, LYS120

Residues it binds most

CYS 2, GLU 2, LEU 2, LYS 2 (residue and the binding sites it lines).

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