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Structure paper

TitleDesign, synthesis and SAR of novel ethylenediamine and phenylenediamine derivatives as factor Xa inhibitors.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 21, Page 2133-2140, Year 2011
Publish dateDec 22, 2010 (structure data deposition date)
AuthorsYoshikawa, K. / Yoshino, T. / Yokomizo, Y. / Uoto, K. / Naito, H. / Kawakami, K. / Mochizuki, A. / Nagata, T. / Suzuki, M. / Kanno, H. ...Yoshikawa, K. / Yoshino, T. / Yokomizo, Y. / Uoto, K. / Naito, H. / Kawakami, K. / Mochizuki, A. / Nagata, T. / Suzuki, M. / Kanno, H. / Takemura, M. / Ohta, T.
External linksBioorg. Med. Chem. Lett. / PubMed:21345673
MethodsX-ray diffraction
Resolution2 Å
Structure data

PDB-3q3k:
Factor Xa in complex with a phenylenediamine derivative
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-CA:
Unknown entry

ChemComp-D90:
N-(2-{[(5-chloro-1H-indol-2-yl)carbonyl]amino}phenyl)-5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridine-2-carboxamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
Keywordshydrolase/hydrolase inhibitor / protein inhibitor complex / blood coaggulation / cleavage of basic residues / disulfide bond / EGF-like domain / hydroxylation / protease / secreted / zymogen / glycoprotein / hydrolase / blood coaggulation factor / serine protease / gamma-carboxyglutamic acid / plasma / hydrolase-hydrolase inhibitor complex

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