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Ligand · 7AC

7AC · 7-(aminomethyl)-6-(2-chlorophenyl)-1-methyl-1H-benzimidazole-5-carbonitrile

7AC, 7-(aminomethyl)-6-(2-chlorophenyl)-1-methyl-1H-benzimidazole-5-carbonitrile (C16 H13 Cl N4, 296.8 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…

Component
7AC
Formula
C16 H13 Cl N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

7AC in 2 structures; the first of them:

  • 3CCC · Crystal Structure of Human DPP4 in complex with a benzimidazole derivative · 7AC A800 · binds ARG125, GLU205, GLU206, TYR547, TRP629, SER630, TYR631, VAL656 and 6 more
  • 3CCC · Crystal structure of human DPP4 in complex with a benzimidazole derivative · 7AC A800 · binds ARG125, GLU205, GLU206, TYR547, TRP629, SER630, TYR631, VAL656 and 6 more

Residues it binds most

TYR 8, GLU 8, VAL 8, TRP 8, ARG 8, ASN 8, HIS 8, SER 8 (residue and the binding sites it lines).

Found with

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

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