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Ligand · TU3

TU3 · [6-(3-hydroxy-4-methylphenyl)pyrazin-2-yl](3,4,5-trimethoxyphenyl)methanone

TU3, [6-(3-hydroxy-4-methylphenyl)pyrazin-2-yl](3,4,5-trimethoxyphenyl)methanone (C21 H20 N2 O5, 380.4 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…

Component
TU3
Formula
C21 H20 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

TU3 in 2 structures; the first of them:

  • 6XES · Tubulin-RB3_SLD in complex with compound 40a · TU3 B503 · binds ASN101, THR179, ALA180, VAL181, TYR200, VAL236, CYS239, LEU240 and 18 more
  • 6XES · Tubulin-RB3_SLD in complex with compound 40A · TU3 B503 · binds ASN101, THR179, ALA180, VAL181, VAL236, CYS239, LEU240, LEU246 and 13 more

Residues it binds most

ALA 4, ASN 4, VAL 4, LEU 4, ILE 4, LYS 4, THR 4, ASP 4, CYS 4, MET 4 (residue and the binding sites it lines).

Found with

  • GDP · Guanosine-5'-diphosphate
  • GTP · Guanosine-5'-triphosphate
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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