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Ligand · 2C6

2C6 · 3-[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-[trans-4-(5-phenyl-1,3,4-oxadiazol-2-yl)cyclohexyl]propanamide

2C6, 3-[(4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-[trans-4-(5-phenyl-1,3,4-oxadiazol-2-yl)cyclohexyl]propanamide (C25 H25 N5 O3 S, 475.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
2C6
Formula
C25 H25 N5 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

2C6 in 2 structures; the first of them:

  • 4MSG · Crystal structure of tankyrase 1 with compound 22 · 2C6 A1402 · binds PHE1183, HIS1184, GLY1185, SER1186, PHE1188, ALA1191, ILE1192, LYS1195 and 16 more
  • 4MSG · Crystal structure of tankyrase 1 with compound 22 · 2C6 A1402 · binds PHE1183, HIS1184, GLY1185, SER1186, PHE1188, ALA1191, ILE1192, LYS1195 and 16 more

Residues it binds most

PHE 4, ALA 4, GLY 4, ILE 4, HIS 4, LYS 4, SER 4, TYR 4, ASP 4, GLU 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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