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Ligand · 988

988 · 8-(3-nitrophenyl)-6-(pyridin-4-ylmethyl)quinoline

988, 8-(3-nitrophenyl)-6-(pyridin-4-ylmethyl)quinoline (C21 H15 N3 O2, 341.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
988
Formula
C21 H15 N3 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

988 in 4 structures; the first of them:

  • 3G45 · Crystal structure of human phosphodiesterase 4b with regulatory domain and d155988 · 988 A901 · binds VAL271, TYR274, THR278, PHE279, TYR405, HIS406, MET519, LEU565 and 11 more
  • 3G58 · Crystal structure of human phosphodiesterase 4d with d155988/pmnpq · 988 A901 · binds TYR325, HIS326, MET439, LEU485, ASN487, TYR495, TRP498, THR499 and 8 more
  • 3G45 · Crystal structure of human phosphodiesterase 4B with regulatory domain and D155988 · 988 A901 · binds VAL271, TYR274, THR278, PHE279, TYR405, HIS406, MET519, LEU565 and 11 more
  • 3G58 · Crystal structure of human phosphodiesterase 4D with D155988/PMNPQ · 988 A901 · binds TYR325, HIS326, MET439, LEU485, ASN487, TYR495, TRP498, THR499 and 8 more

Residues it binds most

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

Found with

  • MG · Magnesium ion
  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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