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Ligand · 9C8

9C8 · 2-[4-(diethylamino)phenyl]-3~{H}-quinazolin-4-one

9C8, 2-[4-(diethylamino)phenyl]-3~{H}-quinazolin-4-one (C18 H19 N3 O, 293.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and…

Component
9C8
Formula
C18 H19 N3 O
Class
ligand
Structures
1
PDB entries
1

Binding sites

9C8 in 1 structure; the first of them:

  • 5NWD · Crystal structure of TNKS2 in complex with 2-[4-(DIETHYLAMINO)PHENYL]… · 9C8 A1201 · binds HIS1031, GLY1032, SER1033, PRO1034, PHE1035, ARG1047, HIS1048, ALA1049 and 10 more

Residues it binds most

TYR 2, ALA 2, HIS 2, PHE 2, SER 2, GLY 2, ARG 2, GLU 2, ILE 2, LYS 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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