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Structure paper

TitleDipeptidyl nitrile inhibitors of Cathepsin L.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 19, Page 4280-4283, Year 2009
Publish dateMay 15, 2009 (structure data deposition date)
AuthorsAsaad, N. / Bethel, P.A. / Coulson, M.D. / Dawson, J.E. / Ford, S.J. / Gerhardt, S. / Grist, M. / Hamlin, G.A. / James, M.J. / Jones, E.V. ...Asaad, N. / Bethel, P.A. / Coulson, M.D. / Dawson, J.E. / Ford, S.J. / Gerhardt, S. / Grist, M. / Hamlin, G.A. / James, M.J. / Jones, E.V. / Karoutchi, G.I. / Kenny, P.W. / Morley, A.D. / Oldham, K. / Rankine, N. / Ryan, D. / Wells, S.L. / Wood, L. / Augustin, M. / Krapp, S. / Simader, H. / Steinbacher, S.
External linksBioorg. Med. Chem. Lett. / PubMed:19515558
MethodsX-ray diffraction
Resolution1.27 Å
Structure data

PDB-3hha:
Crystal structure of cathepsin L in complex with AZ12878478
Method: X-RAY DIFFRACTION / Resolution: 1.27 Å

Chemicals

ChemComp-NOW:
Nalpha-[(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)carbonyl]-N-[(2Z)-2-iminoethyl]-3-methyl-L-phenylalaninamide

ChemComp-PG4:
TETRAETHYLENE GLYCOL / precipitant*YM

ChemComp-ACT:
ACETATE ION

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / PROTEROS BIOSTRUCTURES GMBH / Cathepsin L / Inhibitors / Disulfide bond / Glycoprotein / Lysosome / Protease / Thiol protease / Zymogen

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