Turning high-throughput structural biology into predictive inhibitor design
A common challenge in drug design pertains to finding chemical modifications to a ligand that increases its affinity to the target protein. An underutilized advance is the increase in structural biology throughput, which has progressed from an artisanal endeavor to a monthly throughput of hundreds o...
主要な著者: | Saar, KL, McCorkindale, W, Fearon, D, Boby, M, Barr, H, Ben-Shmuel, A, London, N, von Delft, F, Chodera, JD, Lee, AA, Koekemoer, L, Krojer, T, Fairhead, M, MacLean, EM, Thompson, A, Smilova, MD, Wright, N, von Delft, A, Gileadi, C, Schofield, CJ, Salah, E, Malla, TR, Tumber, A, John, T, Vakonakis, I, Kantsadi, AL, Zitzmann, N, Brun, J, Kiappes, JL, Hill, M, Witt, KD, Alonzi, DS, Makower, LL, Giroud, C, Bennett, J, Fedorov, O, Morris, GM, Ferla, M, Carbery, A, Cattermole, E, Taylor, JC, Brewitz, L |
---|---|
その他の著者: | COVID Moonshot Consortium |
フォーマット: | Journal article |
言語: | English |
出版事項: |
National Academy of Sciences
2023
|
類似資料
-
Assessment of repurposed compounds against coronaviruses highlights the antiviral broad-spectrum activity of host-targeting iminosugars and confirms the activity of potent directly acting antivirals
著者:: Brun, J, 等
出版事項: (2025) -
Assessment of radiation damage behaviour in a large collection of empirically optimized datasets highlights the importance of unmeasured complicating effects.
著者:: Krojer, T, 等
出版事項: (2011) -
Proper modelling of ligand binding requires an ensemble of bound and unbound states
著者:: Pearce, N, 等
出版事項: (2017) -
Squeezing the most from every crystal: the fine details of data collection.
著者:: Krojer, T, 等
出版事項: (2013) -
Fragment libraries designed to be functionally diverse recover protein binding information more efficiently than standard structurally diverse libraries
著者:: Carbery, A, 等
出版事項: (2022)