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Title4-Arylcyclohexylalanine analogs as potent, selective, and orally active inhibitors of dipeptidyl peptidase IV.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 17, Page 5806-5811, Year 2007
Publish dateAug 1, 2007 (structure data deposition date)
AuthorsKaelin, D.E. / Smenton, A.L. / Eiermann, G.J. / He, H. / Leiting, B. / Lyons, K.A. / Patel, R.A. / Patel, S.B. / Petrov, A. / Scapin, G. ...Kaelin, D.E. / Smenton, A.L. / Eiermann, G.J. / He, H. / Leiting, B. / Lyons, K.A. / Patel, R.A. / Patel, S.B. / Petrov, A. / Scapin, G. / Wu, J.K. / Thornberry, N.A. / Weber, A.E. / Duffy, J.L.
External linksBioorg. Med. Chem. Lett. / PubMed:17851076
MethodsX-ray diffraction
Resolution2.1 - 2.25 Å
Structure data

PDB-2qt9:
Human dipeptidyl peptidase iv/cd26 in complex with a 4-aryl cyclohexylalanine inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-2qtb:
Human dipeptidyl peptidase iv/cd26 in complex with a 4-aryl cyclohexylalanine inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

Chemicals

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

ChemComp-NA:
Unknown entry

ChemComp-524:
(2S,3S)-3-AMINO-4-[(3S)-3-FLUOROPYRROLIDIN-1-YL]-N,N-DIMETHYL-4-OXO-2-(TRANS-4-[1,2,4]TRIAZOLO[1,5-A]PYRIDIN-5-YLCYCLOH

ChemComp-HOH:
WATER

ChemComp-474:
(2S,3S)-3-AMINO-4-(3,3-DIFLUOROPYRROLIDIN-1-YL)-N,N-DIMETHYL-4-OXO-2-(TRANS-4-[1,2,4]TRIAZOLO[1,5-A]PYRIDIN-6-YLCYCLOHEXYL)BUTANAMIDE

Source
  • homo sapiens (human)
KeywordsHYDROLASE / ALPHA/BETA / BETA-PROPELLER / DIMER / Aminopeptidase / Glycoprotein / Membrane / Protease / Secreted / Serine protease / Signal-anchor / Transmembrane

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