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Structure paper

TitleIdentification of orally bioavailable, non-amidine inhibitors of Urokinase Plasminogen Activator (uPA)
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 19, Page 5712-5715, Year 2009
Publish dateJul 27, 2009 (structure data deposition date)
AuthorsWest, C.W. / Adler, M. / Arnaiz, D. / Chen, D. / Chu, K. / Gualtieri, G. / Ho, E. / Huwe, C. / Light, D. / Phillips, G. ...West, C.W. / Adler, M. / Arnaiz, D. / Chen, D. / Chu, K. / Gualtieri, G. / Ho, E. / Huwe, C. / Light, D. / Phillips, G. / Pulk, R. / Sukovich, D. / Whitlow, M. / Yuan, S. / Bryant, J.
External linksBioorg. Med. Chem. Lett. / PubMed:19703768
MethodsX-ray diffraction
Resolution1.83 Å
Structure data

PDB-3ig6:
Low molecular weigth human Urokinase type Plasminogen activator 2-[6-(3'-Aminomethyl-biphenyl-3-yloxy)-4-(3-dimethylamino-pyrrolidin-1-yl)-3,5-difluoro-pyridin-2-yloxy]-4-dimethylamino-benzoic acid complex
Method: X-RAY DIFFRACTION / Resolution: 1.83 Å

Chemicals

ChemComp-438:
2-[(6-{[3'-(aminomethyl)biphenyl-3-yl]oxy}-4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-3,5-difluoropyridin-2-yl)oxy]-4-(dimethylamino)benzoic acid

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / SELECTIVE / S1 SITE INHIBITOR / STRUCTURE-BASED DRUG DESIGN / UROKINASE / Blood coagulation / Disulfide bond / EGF-like domain / Fibrinolysis / Glycoprotein / Kringle / Pharmaceutical / Phosphoprotein / Plasminogen activation / Polymorphism / Protease / Secreted / Serine protease / Zymogen

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