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Ligand · C8I

C8I · (3S)-3-(4-chlorophenyl)-N,5-dihydroxypentanamide

C8I, (3S)-3-(4-chlorophenyl)-N,5-dihydroxypentanamide (C11 H14 Cl N O3, 243.7 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…

Component
C8I
Formula
C11 H14 Cl N O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

C8I in 2 structures; the first of them:

  • 7N18 · Clostridium botulinum Neurotoxin Serotype A Light Chain Inhibited by a Chiral Hydroxamic… · C8I B503 · binds VAL70, ILE161, PHE163, GLU164, PHE194, THR220, HIS223, GLU224 and 6 more
  • 7N18 · Clostridium botulinum neurotoxin serotype a light chain inhibited by a chiral hydroxamic… · C8I B503 · binds ILE161, PHE163, PHE194, HIS223, GLU224, HIS227, GLU262, GLU351 and 3 more

Residues it binds most

GLU 2, PHE 2, HIS 2, ARG 2, ILE 2, TYR 2, THR 1, VAL 1 (residue and the binding sites it lines).

Found with

  • C7I · (3R)-3-(4-chlorophenyl)-N,5-dihydroxypentanamide
  • ZN · Zinc ion

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