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Ligand · 3QI

3QI · 5,6-dimethyl-3-(4-methyl-2-pyridinyl)-2-thioxo-2,3-dihydrothieno[2,3- d]pyrimidin-4(1H)-one

3QI, 5,6-dimethyl-3-(4-methyl-2-pyridinyl)-2-thioxo-2,3-dihydrothieno[2,3- d]pyrimidin-4(1H)-one (C14 H13 N3 O S2, 303.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
3QI
Formula
C14 H13 N3 O S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

3QI in 2 structures; the first of them:

  • 4ANP · Crystal structure of human phenylalanine hydroxylase in complex with a pharmacological… · 3QI A1427 · binds LEU248, LEU249, SER251, PHE254, PHE263, PRO279, GLU280, PRO281 and 5 more
  • 4ANP · Crystal structure of human phenylalanine hydroxylase in complex with a pharmacological… · 3QI A1427 · binds LEU248, LEU249, SER251, PHE254, PHE263, PRO279, GLU280, PRO281 and 5 more

Residues it binds most

GLU 2, HIS 2, LEU 2, PHE 2, PRO 2, SER 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • FE · Fe (III) ion

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