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Ligand · 28D

28D · (2Z)-2-(1H-1,2,4-triazol-1-yl)-3-[3-(3,4,5-trimethoxyphenyl)-1H-indazol-5-yl]prop-2-enenitrile

28D, (2Z)-2-(1H-1,2,4-triazol-1-yl)-3-[3-(3,4,5-trimethoxyphenyl)-1H-indazol-5-yl]prop-2-enenitrile (C21 H18 N6 O3, 402.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
28D
Formula
C21 H18 N6 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

28D in 2 structures; the first of them:

  • 4MAO · RSK2 T493M C-Terminal Kinase Domain in Complex with RMM58 · 28D A801 · binds ILE428, GLY429, VAL430, CYS436, ALA449, LYS451, ILE477, MET493 and 10 more
  • 4MAO · RSK2 T493M C-terminal kinase domain in complex with RMM58 · 28D A801 · binds ILE428, GLY429, VAL430, CYS436, ALA449, LYS451, ILE477, MET493 and 10 more

Residues it binds most

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

Found with

  • NA · Sodium ion

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