[HTML][HTML] KRAS interaction with RAF1 RAS-binding domain and cysteine-rich domain provides insights into RAS-mediated RAF activation
The first step of RAF activation involves binding to active RAS, resulting in the recruitment of
RAF to the plasma membrane. To understand the molecular details of RAS-RAF interaction, …
RAF to the plasma membrane. To understand the molecular details of RAS-RAF interaction, …
Covalent inhibitors for eradication of drug-resistant HIV-1 reverse transcriptase: From design to protein crystallography
AH Chan, WG Lee, KA Spasov… - Proceedings of the …, 2017 - National Acad Sciences
Development of resistance remains a major challenge for drugs to treat HIV-1 infections,
including those targeting the essential viral polymerase, HIV-1 reverse transcriptase (RT). …
including those targeting the essential viral polymerase, HIV-1 reverse transcriptase (RT). …
Discovery of Staphylococcus aureus Sortase A Inhibitors Using Virtual Screening and the Relaxed Complex Scheme
AH Chan, J Wereszczynski, BR Amer… - Chemical biology & …, 2013 - Wiley Online Library
Staphylococcus aureus is the leading cause of hospital‐acquired infections in the U nited S
tates. The emergence of multidrug‐resistant strains of S . aureus has created an urgent need …
tates. The emergence of multidrug‐resistant strains of S . aureus has created an urgent need …
[HTML][HTML] Reduced dynamic complexity allows structure elucidation of an excited state of KRASG13D
FA Chao, AH Chan, S Dharmaiah… - Communications …, 2023 - nature.com
Localized dynamics of RAS, including regions distal to the nucleotide-binding site, is of high
interest for elucidating the mechanisms by which RAS proteins interact with effectors and …
interest for elucidating the mechanisms by which RAS proteins interact with effectors and …
[PDF][PDF] Exploring CRD mobility during RAS/RAF engagement at the membrane
During the activation of mitogen-activated protein kinase (MAPK) signaling, the RAS-binding
domain (RBD) and cysteine-rich domain (CRD) of RAF bind to active RAS at the plasma …
domain (RBD) and cysteine-rich domain (CRD) of RAF bind to active RAS at the plasma …
Asynchronous reciprocal coupling of Martini 2.2 coarse-grained and CHARMM36 all-atom simulations in an automated multiscale framework
The appeal of multiscale modeling approaches is predicated on the promise of combinatorial
synergy. However, this promise can only be realized when distinct scales are combined …
synergy. However, this promise can only be realized when distinct scales are combined …
[HTML][HTML] Structural studies and structure activity relationships for novel computationally designed non-nucleoside inhibitors and their interactions with HIV-1 reverse …
KM Frey, N Bertoletti, AH Chan, JA Ippolito… - Frontiers in Molecular …, 2022 - frontiersin.org
Reverse transcriptase (RT) from the human immunodeficiency virus continues to be an attractive
drug target for antiretroviral therapy. June 2022 will commemorate the 30th anniversary …
drug target for antiretroviral therapy. June 2022 will commemorate the 30th anniversary …
[HTML][HTML] Structure of the Bacillus anthracis Sortase A enzyme bound to its sorting signal: A flexible amino-terminal appendage modulates substrate access
AH Chan, SW Yi, AL Terwilliger, AW Maresso… - Journal of Biological …, 2015 - ASBMB
The endospore forming bacterium Bacillus anthracis causes lethal anthrax disease in humans
and animals. The ability of this pathogen to replicate within macrophages is dependent …
and animals. The ability of this pathogen to replicate within macrophages is dependent …
Structural insights into the recognition of nucleoside reverse transcriptase inhibitors by HIV‐1 reverse transcriptase: First crystal structures with reverse transcriptase …
N Bertoletti, AH Chan, RF Schinazi, YW Yin… - Protein …, 2019 - Wiley Online Library
The retrovirus HIV‐1 has been a major health issue since its discovery in the early 80s. In
2017, over 37 million people were infected with HIV‐1, of which 1.8 million were new …
2017, over 37 million people were infected with HIV‐1, of which 1.8 million were new …
Design, conformation, and crystallography of 2-naphthyl phenyl ethers as potent anti-HIV agents
WG Lee, AH Chan, KA Spasov… - ACS Medicinal …, 2016 - ACS Publications
Catechol diethers that incorporate a 7-cyano-2-naphthyl substituent are reported as non-nucleoside
inhibitors of HIV-1 reverse transcriptase (NNRTIs). Many of the compounds have 1–…
inhibitors of HIV-1 reverse transcriptase (NNRTIs). Many of the compounds have 1–…