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Structure paper

TitleClavatadine A, a natural product with selective recognition and irreversible inhibition of factor XIa.
Journal, issue, pagesJ. Med. Chem., Vol. 51, Page 3583-3587, Year 2008
Publish dateNov 26, 2007 (structure data deposition date)
AuthorsBuchanan, M.S. / Carroll, A.R. / Wessling, D. / Jobling, M. / Avery, V.M. / Davis, R.A. / Feng, Y. / Xue, Y. / Oster, L. / Fex, T. ...Buchanan, M.S. / Carroll, A.R. / Wessling, D. / Jobling, M. / Avery, V.M. / Davis, R.A. / Feng, Y. / Xue, Y. / Oster, L. / Fex, T. / Deinum, J. / Hooper, J.N. / Quinn, R.J.
External linksJ. Med. Chem. / PubMed:18510371
MethodsX-ray diffraction
Resolution1.6 Å
Structure data

PDB-3bg8:
Crystal structure of Factor XIa in complex with Clavatadine A
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

Chemicals

ChemComp-G0R:
N-(4-carbamimidamidobutyl)ethanamide

ChemComp-BEN:
BENZAMIDINE

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / protease inhibitor / Factor XIa inhibitor complex / covalent inhibitor / Alternative splicing / Blood coagulation / Disease mutation / Glycoprotein / Heparin-binding / Polymorphism / Secreted / Serine protease

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