Zobrazeno 1 - 10
of 874
pro vyhledávání: '"J Andrew McCammon"'
Autor:
Christopher T Lee, Justin G Laughlin, Nils Angliviel de La Beaumelle, Rommie E Amaro, J Andrew McCammon, Ravi Ramamoorthi, Michael Holst, Padmini Rangamani
Publikováno v:
PLoS Computational Biology, Vol 16, Iss 4, p e1007756 (2020)
Recent advances in electron microscopy have enabled the imaging of single cells in 3D at nanometer length scale resolutions. An uncharted frontier for in silico biology is the ability to simulate cellular processes using these observed geometries. En
Externí odkaz:
https://doaj.org/article/517c7c181edc4062a0f9f0441ddc7cdb
Publikováno v:
PLoS Computational Biology, Vol 11, Iss 10, p e1004341 (2015)
BACE-1 is the β-secretase responsible for the initial amyloidogenesis in Alzheimer's disease, catalyzing hydrolytic cleavage of substrate in a pH-sensitive manner. The catalytic mechanism of BACE-1 requires water-mediated proton transfer from aspart
Externí odkaz:
https://doaj.org/article/261aa75643204142b0f70265f24bf7eb
Publikováno v:
PLoS ONE, Vol 9, Iss 5, p e97975 (2014)
Transcription factor IIS (TFIIS) is a protein known for catalyzing the cleavage reaction of the 3'-end of backtracked RNA transcript, allowing RNA polymerase II (Pol II) to reactivate the transcription process from the arrested state. Recent structur
Externí odkaz:
https://doaj.org/article/163afbc27c43466db8be3cfe1bc9b41e
Publikováno v:
PLoS Computational Biology, Vol 9, Iss 7, p e1003156 (2013)
Group VI Ca²⁺-independent phospholipase A₂ (iPLA₂) is a water-soluble enzyme that is active when associated with phospholipid membranes. Despite its clear pharmaceutical relevance, no X-ray or NMR structural information is currently available
Externí odkaz:
https://doaj.org/article/bae043e4bf034dd69d3f7bd5989398a8
Publikováno v:
PLoS Computational Biology, Vol 9, Iss 12, p e1003395 (2013)
The nonmevalonate pathway is responsible for isoprenoid production in microbes, including H. pylori, M. tuberculosis and P. falciparum, but is nonexistent in humans, thus providing a desirable route for antibacterial and antimalarial drug discovery.
Externí odkaz:
https://doaj.org/article/904f006145a6418fbd9b09e61ede7065
Autor:
Jacob D Durrant, J Andrew McCammon
Publikováno v:
PLoS Computational Biology, Vol 8, Iss 3, p e1002397 (2012)
Academic researchers and many in industry often lack the financial resources available to scientists working in "big pharma." High costs include those associated with high-throughput screening and chemical synthesis. In order to address these challen
Externí odkaz:
https://doaj.org/article/8e448c1a96464686ab488f653b5d49d3
Autor:
Juan Manuel Ortiz-Sanchez, Sara E Nichols, Jacqueline Sayyah, Joan Heller Brown, J Andrew McCammon, Barry J Grant
Publikováno v:
PLoS ONE, Vol 7, Iss 7, p e40809 (2012)
Rho GTPases are conformational switches that control a wide variety of signaling pathways critical for eukaryotic cell development and proliferation. They represent attractive targets for drug design as their aberrant function and deregulated activit
Externí odkaz:
https://doaj.org/article/2196640ae9314e6fb44c1b9cde9e781b
Autor:
Barry J Grant, Dana M Gheorghe, Wenjun Zheng, Maria Alonso, Gary Huber, Maciej Dlugosz, J Andrew McCammon, Robert A Cross
Publikováno v:
PLoS Biology, Vol 9, Iss 11, p e1001207 (2011)
The minimum motor domain of kinesin-1 is a single head. Recent evidence suggests that such minimal motor domains generate force by a biased binding mechanism, in which they preferentially select binding sites on the microtubule that lie ahead in the
Externí odkaz:
https://doaj.org/article/24ebc1a931464eb2bb03d0c509f23df4
Publikováno v:
PLoS Computational Biology, Vol 7, Iss 10, p e1002178 (2011)
Chagas' disease, caused by the protozoan parasite Trypanosoma cruzi (T. cruzi), is a life-threatening illness affecting 11-18 million people. Currently available treatments are limited, with unacceptable efficacy and safety profiles. Recent studies h
Externí odkaz:
https://doaj.org/article/8e5d3fca2fa44f589ef8d207867ebb7c
Publikováno v:
PLoS Computational Biology, Vol 7, Iss 7, p e1002099 (2011)
Paromomycin is an aminoglycosidic antibiotic that targets the RNA of the bacterial small ribosomal subunit. It binds in the A-site, which is one of the three tRNA binding sites, and affects translational fidelity by stabilizing two adenines (A1492 an
Externí odkaz:
https://doaj.org/article/edf955ca9dc74018a969e51817745c39