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Structure paper

TitleInvolvement of DPP-IV catalytic residues in enzyme-saxagliptin complex formation.
Journal, issue, pagesProtein Sci., Vol. 17, Page 240-250, Year 2008
Publish dateDec 4, 2007 (structure data deposition date)
AuthorsMetzler, W.J. / Yanchunas, J. / Weigelt, C. / Kish, K. / Klei, H.E. / Xie, D. / Zhang, Y. / Corbett, M. / Tamura, J.K. / He, B. ...Metzler, W.J. / Yanchunas, J. / Weigelt, C. / Kish, K. / Klei, H.E. / Xie, D. / Zhang, Y. / Corbett, M. / Tamura, J.K. / He, B. / Hamann, L.G. / Kirby, M.S. / Marcinkeviciene, J.
External linksProtein Sci. / PubMed:18227430
MethodsX-ray diffraction
Resolution2.35 Å
Structure data

PDB-3bjm:
Crystal structure of human DPP-IV in complex with (1S,3S, 5S)-2-[(2S)-2-AMINO-2-(3-HYDROXYTRICYCLO[3.3.1.13,7]DEC-1- YL)ACETYL]-2-AZABICYCLO[3.1.0]HEXANE-3-CARBONITRILE (CAS), (1S,3S,5S)-2-((2S)-2-AMINO-2-(3-HYDROXYADAMANTAN-1- YL)ACETYL)-2-AZABICYCLO[3.1.0]HEXANE-3-CARBONITRILE (IUPAC), OR BMS-477118
Method: X-RAY DIFFRACTION / Resolution: 2.35 Å

Chemicals

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

ChemComp-BJM:
(2~{S})-2-azanyl-1-[(1~{S},3~{S},5~{S})-3-(iminomethyl)-2-azabicyclo[3.1.0]hexan-2-yl]-2-[(5~{R},7~{S})-3-oxidanyl-1-ad / inhibitor*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / EXOPEPTIDASE / ALPHA/BETA HYDROLASE FOLD / BETA BARREL / BETA PROPELLER / DPP4 / DIMER / PROTEIN:INHIBITOR COMPLEX / Aminopeptidase / Glycoprotein / Membrane / Protease / Secreted / Serine protease / Signal-anchor / Transmembrane

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