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Ligand · HTB

HTB · N-(1-benzofuran-2-ylmethyl)-N'-(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine

HTB, N-(1-benzofuran-2-ylmethyl)-N'-(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine (C29 H35 N3 O, 441.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
HTB
Formula
C29 H35 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

HTB in 2 structures; the first of them:

  • 4W63 · Torpedo californica acetylcholinesterase in complex with a tacrine-benzofuran hybrid… · HTB A605 · binds TRP84, GLY117, GLY118, GLY119, TYR121, TYR130, GLU199, SER200 and 15 more
  • 4W63 · Torpedo californica acetylcholinesterase in complex with a tacrine- benzofuran hybrid… · HTB A605 · binds TRP84, GLY117, GLY118, GLY119, TYR121, TYR130, GLU199, SER200 and 15 more

Residues it binds most

GLY 2, TYR 2, PHE 2, TRP 2, GLU 2, VAL 2, ALA 2, ASN 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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