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Ligand · 9H3

9H3 · 1'-(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)-2H-spiro[1-benzofuran-3,4'-piperidin]-2-one

9H3, 1'-(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)-2H-spiro[1-benzofuran-3,4'-piperidin]-2-one (C20 H21 N3 O3, 351.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
9H3
Formula
C20 H21 N3 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

9H3 in 1 structure; the first of them:

  • 5ZQP · Tankyrase-2 in complex with compound 12 · 9H3 A1202 · binds HIS1031, GLY1032, SER1033, PRO1034, PHE1035, ARG1047, ALA1049, TYR1050 and 9 more

Residues it binds most

TYR 1, ALA 1, GLY 1, PHE 1, SER 1, ARG 1, GLU 1, HIS 1, ILE 1, LYS 1 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • PO4 · Phosphate ion
  • GOL · Glycerol

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