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Ligand · PIL

PIL · 3-(cyclopentyloxy)-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzamide

PIL, 3-(cyclopentyloxy)-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzamide (C18 H18 Cl2 N2 O3, 381.2 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
PIL
Formula
C18 H18 Cl2 N2 O3
Class
ligand
Structures
6
PDB entries
3

Binding sites

PIL in 6 structures; the first of them:

  • 1XM4 · Catalytic Domain Of Human Phosphodiesterase 4B In Complex With Piclamilast · PIL A1003 · binds TYR233, HIS234, THR345, MET347, ASP392, LEU393, ASN395, TYR403 and 9 more
  • 1XON · Catalytic Domain Of Human Phosphodiesterase 4D In Complex With Piclamilast · PIL A501 · binds TYR159, HIS160, THR271, MET273, ASP318, LEU319, ASN321, TYR329 and 9 more
  • 4PHL · TbrPDEB1-inhibitor complex · PIL A1003 · binds TYR668, HIS669, THR783, MET785, ASP822, ILE823, ASN825, TRP836 and 8 more
  • 1XM4 · Catalytic domain of human phosphodiesterase 4B in complex with piclamilast · PIL A1003 · binds TYR233, HIS234, THR345, MET347, ASP392, LEU393, ASN395, TYR403 and 9 more
  • 1XON · Catalytic domain of human phosphodiesterase 4D in complex with piclamilast · PIL A501 · binds TYR159, HIS160, THR271, MET273, ASP318, LEU319, ASN321, TYR329 and 9 more
  • 4PHL · TBRPDEB1-inhibitor complex · PIL A1003 · binds TYR668, HIS669, THR783, MET785, ASP822, ILE823, ASN825, TRP836 and 8 more

Residues it binds most

MET 12, PHE 12, THR 12, TYR 12, ASN 12, ASP 12, GLN 12, HIS 12, ILE 12, TRP 12 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion
  • GAI · Guanidine
  • B3P · 2-[3-(2-hydroxy-1,1-dihydroxymethyl-ethylamino)-propylamino]-2-hydroxymethyl-propane-1,3-diol
  • EDO · 1,2-ethanediol
  • EOH · Ethanol
  • GOL · Glycerol

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