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TitleDiscovery of Cyclohexene-constrained Phenethylamine ABT-341, a Highly Potent, Selective, Orally Bioavailable, Safe and Potential Next-generation Dipeptidyl Peptidase IV Inhibitor for the Treatment of Type 2 Diabetes
Journal, issue, pagesTo be Published
Publish dateAug 30, 2006 (structure data deposition date)
AuthorsPei, Z. / Li, X. / vonGeldern, T.W. / Madar, D.J. / L Longenecker, K. / Yong, H. / Lubben, T.H. / Stewart, K.D. / Zinker, B.A. / Backes, B.J. ...Pei, Z. / Li, X. / vonGeldern, T.W. / Madar, D.J. / L Longenecker, K. / Yong, H. / Lubben, T.H. / Stewart, K.D. / Zinker, B.A. / Backes, B.J. / Judd, A.S. / Mulhern, M. / Ballaron, S.J. / Stashko, M.A. / Mika, A.K. / Beno, D.W.A. / Reinhart, G.A. / Fryer, R.M. / Preusser, L.C. / Kempf-Grote, A.J. / Sham, H.L. / Trevillyan, J.M.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution2.5 Å
Structure data

PDB-2i78:
Crystal structure of human dipeptidyl peptidase IV (DPP IV) complexed with ABT-341, a cyclohexene-constrained phenethylamine inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-KIQ:
(1S,6R)-3-{[3-(TRIFLUOROMETHYL)-5,6-DIHYDRO[1,2,4]TRIAZOLO[4,3-A]PYRAZIN-7(8H)-YL]CARBONYL}-6-(2,4,5-TRIFLUOROPHENYL)CYCLOHEX-3-EN-1-AMINE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / serine peptidase

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