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Ligand · A1AH9

A1AH9 · (5P)-5-(1H-indol-3-yl)-1-[2-(piperazin-1-yl)ethyl]-1H-1,2,3-benzotriazole

A1AH9, (5P)-5-(1H-indol-3-yl)-1-[2-(piperazin-1-yl)ethyl]-1H-1,2,3-benzotriazole (C20 H22 N6, 346.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
A1AH9
Formula
C20 H22 N6
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1AH9 in 1 structure; the first of them:

  • 9B17 · Crystal Structure of human Tryptophan 2,3-dioxygenase in complex with PAN1 inhibitor · A1AH9 A402 · binds PHE72, HIS76, PHE140, ARG144, LEU147, ALA150, SER151, GLY152 and 4 more

Residues it binds most

TYR 4, LEU 4, PHE 4, ALA 4, ARG 4, GLY 4, HIS 4, SER 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • ZIQ · alpha-methyl-L-tryptophan

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