Zobrazeno 1 - 10
of 32
pro vyhledávání: '"Ekachai, Jenwitheesuk"'
Autor:
Joshua M Costin, Ekachai Jenwitheesuk, Shee-Mei Lok, Elizabeth Hunsperger, Kelly A Conrads, Krystal A Fontaine, Craig R Rees, Michael G Rossmann, Sharon Isern, Ram Samudrala, Scott F Michael
Publikováno v:
PLoS Neglected Tropical Diseases, Vol 4, Iss 6, p e721 (2010)
Viral fusogenic envelope proteins are important targets for the development of inhibitors of viral entry. We report an approach for the computational design of peptide inhibitors of the dengue 2 virus (DENV-2) envelope (E) protein using high-resoluti
Externí odkaz:
https://doaj.org/article/f2a1eca4a9a5439db0bff740f5d6cbf3
Publikováno v:
Bioinformation
Pyruvate decarboxylase (PDC) is a key enzyme in homoethanol fermentation process, which decarboxylates 2-keto acid pyruvate into acetaldehyde and carbon dioxide. PDC enzymes from potential ethanol-producing bacteria such as Zymomonas mobilis, Zymobac
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::012f8fcb02cd82883f72e69255fe2fb0
http://europepmc.org/articles/PMC2951667
http://europepmc.org/articles/PMC2951667
Publikováno v:
Bioinformation
Human thiopurine S-methyltransferase (TPMT) is an essential protein in 6-mercaptopurine (6MP) drug metabolism. To understand the pharmacogenetics of TPMT and 6MP, X-ray co-crystal structures of TPMT complexes with S-adenosyl-L-methionine (AdoMet) and
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::450ec73de6f60a1a99e892606b8bc87a
https://doi.org/10.6026/97320630004059
https://doi.org/10.6026/97320630004059
Publikováno v:
Bioinformation
Virtual drug screening using protein-ligand docking techniques is a time-consuming process, which requires high computational power for binding affinity calculation. There are millions of chemical compounds available for docking. Eliminating compound
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0ce30a3d45715f7ae0e7582670fc0297
https://doi.org/10.6026/97320630003189
https://doi.org/10.6026/97320630003189
Autor:
Ram Samudrala, Ekachai Jenwitheesuk
Publikováno v:
Antiviral Therapy. 10:157-166
Emergence of drug resistance remains one of the most challenging issues in the treatment of HIV-1 infection. Here we focus on resistance to HIV-1 protease inhibitors (PIs) at a molecular level, which can be analysed genotypically or phenotypically. G
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::09974c417d7c9cb3d425aae88e8c685c
https://doi.org/10.1177/135965350501000115
https://doi.org/10.1177/135965350501000115
Autor:
Ekachai Jenwitheesuk, Ram Samudrala
Publikováno v:
Bioorganic & Medicinal Chemistry Letters
The Severe Acute Respiratory Syndrome (SARS) is a serious respiratory illness that has recently been reported in parts of Asia and Canada. In this study, we use molecular dynamics (MD) simulations and docking techniques to screen 29 approved and expe
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::551d1f1dfc058fdf5a15fac239a61c7c
http://europepmc.org/articles/PMC7119134
http://europepmc.org/articles/PMC7119134
Publikováno v:
Antiviral Therapy. 9:343-352
Drug resistance is a major obstacle to the successful treatment of HIV-1 infection. Genotypic assays are used widely to provide indirect evidence of drug resistance, but the performance of these assays has been mixed. We used standard stepwise linear
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d9797426e1275526e46b7f0393a8a615
https://doi.org/10.1177/135965350400900307
https://doi.org/10.1177/135965350400900307
Autor:
Ekachai Jenwitheesuk, Ram Samudrala
Publikováno v:
Bioinformatics. 23:2797-2799
Summary: Minocycline, a broad spectrum antibiotic, has been discovered to have inhibitory activity against HIV-1 in vitro, but the targets inhibited are unknown. We used a docking with dynamics protocol developed by us to predict the binding affiniti
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ff13acd5552c36187e8d24cb98b71fd9
https://doi.org/10.1093/bioinformatics/btm424
https://doi.org/10.1093/bioinformatics/btm424
Publikováno v:
Asian Pacific journal of cancer prevention : APJCP. 12(11)
The estrogen molecule is the major risk factor related to mammary gland tumors, with estrogen receptor alpha (ER- α) as the important target stimulating growth. Therefore one alternative approach to treatment of breast cancer is to use selective est
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::4ca339115659e20afcc1ffc9197569eb
https://pubmed.ncbi.nlm.nih.gov/22393957
https://pubmed.ncbi.nlm.nih.gov/22393957
Autor:
Shee-Mei Lok, Elizabeth Hunsperger, Kelly A. Conrads, Joshua M. Costin, Scott F. Michael, Michael G. Rossmann, Ekachai Jenwitheesuk, Craig R. Rees, Ram Samudrala, Krystal A. Fontaine, Sharon Isern
Publikováno v:
PLoS Neglected Tropical Diseases
PLoS Neglected Tropical Diseases, Vol 4, Iss 6, p e721 (2010)
PLoS Neglected Tropical Diseases, Vol 4, Iss 6, p e721 (2010)
Viral fusogenic envelope proteins are important targets for the development of inhibitors of viral entry. We report an approach for the computational design of peptide inhibitors of the dengue 2 virus (DENV-2) envelope (E) protein using high-resoluti
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8a279ebcce4032511e50ef389b302e1a