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TitleSelectivity and Safety Characterization of a Xanthine-Imidazothiazole Lead Structure: a Novel Tryptophan Hydroxylase Inhibitor of Peripheral Serotonin Synthesis.
Journal, issue, pagesAcs Pharmacol Transl Sci, Vol. 8, Page 1678-1693, Year 2025
Publish dateNov 5, 2024 (structure data deposition date)
AuthorsWesolowski, R. / Schutz, A. / Lisurek, M. / Nazare, M. / Heinemann, U. / Pleimes, D. / Bader, M. / Specker, E.
External linksAcs Pharmacol Transl Sci / PubMed:40534674
MethodsX-ray diffraction
Resolution2.58925907124 - 2.95518755358 Å
Structure data

PDB-9hb7:
Crystal structure of human tryptophan hydroxylase 2 in complex with inhibitor AG-01-128
Method: X-RAY DIFFRACTION / Resolution: 2.95518755358 Å

PDB-9hb8:
Crystal structure of human tryptophan hydroxylase 2 in complex with inhibitor KM-06-098
Method: X-RAY DIFFRACTION / Resolution: 2.89634214817 Å

PDB-9he3:
Crystal structure of human tryptophan hydroxylase 1 in complex with inhibitor LP778902
Method: X-RAY DIFFRACTION / Resolution: 2.58925907124 Å

Chemicals

ChemComp-FE:
Unknown entry

ChemComp-JCR:
8-(1~{H}-benzimidazol-2-ylmethyl)-3-ethyl-7-(phenylmethyl)purine-2,6-dione

ChemComp-HOH:
WATER

ChemComp-UVU:
3-ethyl-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-7-[[4-(1-methylpyrazol-3-yl)phenyl]methyl]purine-2,6-dione

PDB-1it9:
CRYSTAL STRUCTURE OF AN ANTIGEN-BINDING FRAGMENT FROM A HUMANIZED VERSION OF THE ANTI-HUMAN FAS ANTIBODY HFE7A

Source
  • homo sapiens (human)
KeywordsMETAL BINDING PROTEIN / tryptophan hydroxylase 2 / serotonin biosynthesis / catalytic and oligomerization domain / TPH2 / inhibitor / tryptophan hydroxylase

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