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Ligand · MJP

MJP · 2-azanyl-N-[4-[(3-cyano-1H-indol-5-yl)oxy]phenyl]ethanamide

MJP, 2-azanyl-N-[4-[(3-cyano-1H-indol-5-yl)oxy]phenyl]ethanamide (C17 H14 N4 O2, 306.3 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…

Component
MJP
Formula
C17 H14 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

MJP in 2 structures; the first of them:

  • 5AJZ · Human PFKFB3 in complex with an indole inhibitor 5 · MJP A1449 · binds ALA44, ARG45, GLY46, TYR49, ILE50, SER152, CYS154, VAL159 and 10 more
  • 5AJZ · Human PFKFB3 in complex with an indole inhibitor 5 · MJP A1449 · binds ALA44, ARG45, GLY46, TYR49, ILE50, SER152, CYS154, VAL159 and 10 more

Residues it binds most

VAL 2, GLY 2, ILE 2, ALA 2, ARG 2, ASN 2, CYS 2, HIS 2, LEU 2, MET 2 (residue and the binding sites it lines).

Found with

  • F6P · 6-O-phosphono-beta-D-fructofuranose
  • PHS · Phosphonic acid
  • PO4 · Phosphate ion

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