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Ligand · T3M

T3M · 4-[3-amino-6-(3,4,5-trimethoxyphenyl)pyrazin-2-yl]benzoic acid

T3M, 4-[3-amino-6-(3,4,5-trimethoxyphenyl)pyrazin-2-yl]benzoic acid (C20 H19 N3 O5, 381.4 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 it…

Component
T3M
Formula
C20 H19 N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

T3M in 2 structures; the first of them:

  • 2XKD · Structure of Nek2 bound to aminopyrazine compound 12 · T3M A1280 · binds ILE14, CYS22, VAL35, LYS37, VAL68, TYR70, MET86, GLU87 and 9 more
  • 2XKD · Structure of NEK2 bound to aminopyrazine compound 12 · T3M A1280 · binds ILE14, CYS22, VAL35, LYS37, VAL68, TYR70, MET86, GLU87 and 9 more

Residues it binds most

ASP 2, CYS 2, GLU 2, GLY 2, TYR 2, VAL 2, ILE 2, LYS 2, MET 2, PHE 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion

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