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Title8-(3-(R)-Aminopiperidin-1-yl)-7-but-2-ynyl-3-methyl-1-(4-methyl-quinazolin-2-ylmethyl)-3,7-dihydropurine-2,6-dione (BI 1356), a Highly Potent, Selective, Long-Acting, and Orally Bioavailable DPP-4 Inhibitor for the Treatment of Type 2 Diabetes.
Journal, issue, pagesJ. Med. Chem., Vol. 50, Page 6450-6453, Year 2007
Publish dateOct 5, 2007 (structure data deposition date)
AuthorsEckhardt, M. / Langkopf, E. / Mark, M. / Tadayyon, M. / Thomas, L. / Nar, H. / Pfrengle, W. / Guth, B. / Lotz, R. / Sieger, P. ...Eckhardt, M. / Langkopf, E. / Mark, M. / Tadayyon, M. / Thomas, L. / Nar, H. / Pfrengle, W. / Guth, B. / Lotz, R. / Sieger, P. / Fuchs, H. / Himmelsbach, F.
External linksJ. Med. Chem. / PubMed:18052023
MethodsX-ray diffraction
Resolution2.6 Å
Structure data

PDB-2rgu:
Crystal structure of complex of human DPP4 and inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-356:
8-[(3R)-3-Aminopiperidin-1-yl]-7-but-2-yn-1-yl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-d / medication, inhibitor*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / peptidase / inhibitor / Aminopeptidase / Glycoprotein / Membrane / Protease / Secreted / Serine protease / Signal-anchor / Transmembrane

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