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Ligand · EK3

EK3 · N-cyclohexyl-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridin-2-amine

EK3, N-cyclohexyl-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridin-2-amine (C20 H21 F N4, 336.4 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…

Component
EK3
Formula
C20 H21 F N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

EK3 in 2 structures; the first of them:

  • 4FV0 · Crystal Structure of the ERK2 complexed with EK3 · EK3 A401 · binds ILE29, GLU31, GLY32, VAL37, ALA50, LYS52, GLN103, ASP104 and 8 more
  • 4FV0 · Crystal structure of the ERK2 complexed with EK3 · EK3 A401 · binds ILE29, GLU31, GLY32, VAL37, ALA50, LYS52, GLN103, ASP104 and 8 more

Residues it binds most

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

Found with

  • EDO · 1,2-ethanediol
  • GOL · Glycerol

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