Metal Fluorides: Tools for Structural and Computational Analysis of Phosphoryl Transfer Enzymes

por Jin, Yi, Molt, Robert W., Blackburn, G. Michael
Publicado 2017

(19)F NMR and DFT Analysis Reveal Structural and Electronic Transition State Features for RhoA‐Catalyzed GTP Hydrolysis

por Jin, Yi, Molt, Robert W., Waltho, Jonathan P., Richards, Nigel G. J., Blackburn, G. Michael
Publicado 2016

Octahedral Trifluoromagnesate, an Anomalous Metal Fluoride Species, Stabilizes the Transition State in a Biological Motor

por Ge, Mengyu, Molt, Robert W., Jenkins, Huw T., Blackburn, G. Michael, Jin, Yi, Antson, Alfred A.
Publicado 2021

X-ray crystallographic studies reveal that the incorporation of spacer groups in carbonic anhydrase inhibitors causes alternate binding modes

por Fisher, S. Zoë, Govindasamy, Lakshmanan, Boyle, Nicholas, Agbandje-McKenna, Mavis, Silverman, David N., Blackburn, G. Michael, McKenna, Robert
Publicado 2006

Thermokinetic profile of NDM-1 and its inhibition by small carboxylic acids

por Wang, Qian, He, Yuan, Lu, Rui, Wang, Wen-Ming, Yang, Ke-Wu, Fan, Hai Ming, Jin, Yi, Blackburn, G. Michael
Publicado 2018

Assessing the Influence of Mutation on GTPase Transition States by Using X‐ray Crystallography, (19)F NMR, and DFT Approaches

por Jin, Yi, Molt, Robert W., Pellegrini, Erika, Cliff, Matthew J., Bowler, Matthew W., Richards, Nigel G. J., Blackburn, G. Michael, Waltho, Jonathan P.
Publicado 2017

Robotic QM/MM-driven maturation of antibody combining sites

por Smirnov, Ivan V., Golovin, Andrey V., Chatziefthimiou, Spyros D., Stepanova, Anastasiya V., Peng, Yingjie, Zolotareva, Olga I., Belogurov, Alexey A., Kurkova, Inna N., Ponomarenko, Natalie A., Wilmanns, Matthias, Blackburn, G. Michael, Gabibov, Alexander G., Lerner, Richard A.
Publicado 2016

Multiscale computation delivers organophosphorus reactivity and stereoselectivity to immunoglobulin scavengers

por Mokrushina, Yuliana A., Golovin, Andrey V., Smirnov, Ivan V., Chatziefthimiou, Spyros D., Stepanova, Anastasia V., Bobik, Tatyana V., Zalevsky, Arthur O., Zlobin, Alexander S., Konovalov, Kirill A., Terekhov, Stanislav S., Stepanov, Alexey V., Pipiya, Sofiya O., Shamborant, Olga G., Round, Ekaterina, Belogurov, Alexey A., Bourenkov, Gleb, Makarov, Alexander A., Wilmanns, Matthias, Xie, Jia, Blackburn, G. Michael, Gabibov, Alexander G., Lerner, Richard A.
Publicado 2020