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Ligand · EK5

EK5 · 4-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1H-pyrrole-2-carboxamide

EK5, 4-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1H-pyrrole-2-carboxamide (C23 H19 Cl N4 O2, 418.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
EK5
Formula
C23 H19 Cl N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

EK5 in 2 structures; the first of them:

  • 4FV2 · Crystal Structure of the ERK2 complexed with EK5 · EK5 A401 · binds ILE29, GLY30, GLU31, GLY32, ALA33, TYR34, GLY35, MET36 and 15 more
  • 4FV2 · Crystal structure of the ERK2 complexed with EK5 · EK5 A401 · binds ILE29, GLY30, GLU31, GLY32, ALA33, TYR34, GLY35, MET36 and 15 more

Residues it binds most

ASP 2, GLY 2, ILE 2, ALA 2, GLU 2, LEU 2, LYS 2, MET 2, CYS 2, GLN 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • GOL · Glycerol

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