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Ligand · A1AE7

A1AE7 · (6M)-6-(6-fluoro-1H-indol-3-yl)-1-[2-(piperazin-1-yl)ethyl]-1H-benzotriazole

A1AE7, (6M)-6-(6-fluoro-1H-indol-3-yl)-1-[2-(piperazin-1-yl)ethyl]-1H-benzotriazole (C20 H21 F N6, 364.4 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
A1AE7
Formula
C20 H21 F N6
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1AE7 in 1 structure; the first of them:

  • 8W2K · Crystal Structure of human Tryptophan 2,3-dioxygenase in complex with PAN3F inhibitor · A1AE7 A403 · binds PHE72, HIS76, PHE140, ARG144, LEU147, SER148, PRO149, ALA150 and 6 more

Residues it binds most

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

Found with

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

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