Zobrazeno 1 - 7
of 7
pro vyhledávání: '"Tamar Traube"'
Autor:
Michael Shokhen, Netaly Khazanov, Rachel Ozeri, Nurit Perlman, Tamar Traube, Michal Hirsch, Amnon Albeck, S. Vijayakumar
Publikováno v:
Israel Journal of Chemistry. 54:1137-1151
Mechanistic studies of catalysis and the inhibition of serine and cysteine proteases afford new and sometimes surprising insights, challenging conventional dogmas in enzymology. The intrinsic source of the difference in the catalytic mechanisms of se
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::046927094636308d1e9b255ed2cc94b0
https://doi.org/10.1002/ijch.201300144
https://doi.org/10.1002/ijch.201300144
Publikováno v:
Journal of Chemical Information and Modeling. 50:2256-2265
We introduce an enzyme mechanism-based method, EMBM, aimed at rational design of chemical sites, CS, of reaction coordinate analog inhibitors. The energy of valence reorganization of CS, caused by the formation of the enzyme-inhibitor covalent comple
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::160da4033b2da8a838b5263a88370f8e
https://doi.org/10.1021/ci100330y
https://doi.org/10.1021/ci100330y
Publikováno v:
International Journal of Peptide Research and Therapeutics. 14:183-192
A simple and convenient synthesis of orthogonally protected multi-tethered, optically pure 2-ketopiperazine and 2,5-diketopiperazine scaffolds for Fmoc and Boc combinatorial chemistry was achieved, starting from accessible chiral amino acid precursor
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8452c7717f5571d435a39b2a9f0cf511
https://doi.org/10.1007/s10989-008-9129-0
https://doi.org/10.1007/s10989-008-9129-0
Publikováno v:
European journal of medicinal chemistry. 77
In light of the major contribution of the reactive warhead to the binding energy trend in reversible covalent transition-state analog inhibitors of serine and cysteine hydrolases, would it be possible to rationally design and quickly filter such warh
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::be73d2a48c921db6be2d351a39c30b10
https://pubmed.ncbi.nlm.nih.gov/24631732
https://pubmed.ncbi.nlm.nih.gov/24631732
Publikováno v:
Molecular informatics. 33(1)
Most CADD tools handle non-covalent enzyme inhibitors, despite the growing interest of the pharma industry in covalent inhibitors. We have recently introduced an enzyme mechanism-based method, EMBM, as a computational tool for binding trend analysis
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::326682bec1674a39460756ebb1e27f00
https://pubmed.ncbi.nlm.nih.gov/27485197
https://pubmed.ncbi.nlm.nih.gov/27485197
In the first catalytic step in serine proteases, the attacking Ser nucleophile forms an unstable covalent anionic tetrahedral complex, TC(O-), with the carbonyl group of the substrate (Fig. 1a).[1] In the case of reaction coordinate analog inhibitors
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ebfed83a477e1ef51622a64d38027ed6
https://europepmc.org/articles/PMC3088911/
https://europepmc.org/articles/PMC3088911/
Autor:
Tamar Traube, Subramaniam Vijayakumar, Michal Hirsch, Neta Uritsky, Michael Shokhen, Amnon Albeck
Publikováno v:
Journal of Chemical Information & Modeling; Dec2010, Vol. 50 Issue 12, p2256-2265, 10p