Publication Beamlines Strategic Pillar
Bailey-Elkin, Ben A.; Knaap, Robert C. M.; De Silva, Anuradha; Boekhoud, Ilse M.; Mous, Sandra et al. (2023). Demonstrating the importance of porcine reproductive and respiratory syndrome virus papain-like protease 2 deubiquitinating activity in viral replication by structure-guided mutagenesis. PLoS Pathogens 19(12) , e1011872. 10.1371/journal.ppat.1011872. [PDB: 8ehn] CMCF-ID Health
Cole, Andrew G.; Kultgen, Steven G.; Mani, Nagraj; Quintero, Jorge G.; Yi Fan, Kristi et al. (2023). Design, synthesis, and structure-activity relationship of a bicyclic HBV capsid assembly modulator chemotype leading to the identification of clinical candidate AB-506. Bioorganic and Medicinal Chemistry Letters 94, 129456. 10.1016/j.bmcl.2023.129456. [PDB: 8gbu] CMCF-ID Health
Kalliokoski, Tuomo; Kettunen, Henna; Kumpulainen, Esa; Kettunen, Emilia; Thieulin-Pardo, Gabriel et al. (2023). Discovery of novel methionine adenosyltransferase 2A (MAT2A) allosteric inhibitors by structure-based virtual screening. Bioorganic and Medicinal Chemistry Letters 94, 129450. 10.1016/j.bmcl.2023.129450. [PDB: 8p1t, 8p1v] CMCF-ID Health
Kattar, Solomon D.; Gulati, Anmol; Margrey, Kaila A.; Keylor, Mitchell H.; Ardolino, Michael et al. (2023). Discovery of MK-1468: A Potent, Kinome-Selective, Brain-Penetrant Amidoisoquinoline LRRK2 Inhibitor for the Potential Treatment of Parkinson’s Disease. Journal of Medicinal Chemistry . 10.1021/acs.jmedchem.3c01486. [PDB: 8six] CMCF-ID Health
Smith, Christopher R.; Chen, Dan; Christensen, James G.; Coulombe, René; Féthière, James et al. (2023). Discovery of Five SOS2 Fragment Hits with Binding Modes Determined by SOS2 X-Ray Cocrystallography. Journal of Medicinal Chemistry 67(1) , 774-781. 10.1021/acs.jmedchem.3c02140. [PDB: 8t5g, 8t5m, 8t5r] CMCF-BM, CMCF-ID Health
Thai, Elaine; Murugan, Rajagopal; Binter, Špela; Burn Aschner, Clare; Prieto, Katherine et al. (2023). Molecular determinants of cross-reactivity and potency by VH3-33 antibodies against the Plasmodium falciparum circumsporozoite protein. Cell Reports 42(11) , 113330. 10.1016/j.celrep.2023.113330. [PDB: 8fb5] CMCF-ID Health
Varkaris, Andreas; Pazolli, Ermira; Gunaydin, Hakan; Wang, Qi; Pierce, Levi et al. (2023). Discovery and clinical proof-of-concept of RLY-2608, a first-in-class mutant-selective allosteric PI3Ka inhibitor that decouples anti-tumor activity from hyperinsulinemia. Cancer Discovery . 10.1158/ [PDB: 8ts7] CMCF-ID Health
Bailey-Elkin, B.A.; Mark, B.L. (2023). PRRSV-1 PLP2 domain. Protein Data Bank: 8ehn. CMCF-ID Health
Frota, N.F.; Pistofidis, A.; Folger, I.B.; Hilvert, D.; Schmeing, T.M. et al. (2023). The condensation domain of surfactin A synthetase C in space group P212121. Protein Data Bank: 8f7g. CMCF-ID Agriculture
Frota, N.; Pistofidis, A.; Folger, I.B.; Hilvert, D.; Schmeing, T.M. et al. (2023). The condensation domain of surfactin A synthetase C in space group P43212. Protein Data Bank: 8f7f. CMCF-ID Agriculture
Gui, W.; Wang, F.; Cheng, W.; Gao, J.; Huang, Y. et al. (2023). The Crystal Structure of CDK3 and CyclinE1 Complex with Dinaciclib from Biortus. Protein Data Bank: 8h4r. CMCF-ID Agriculture
Holliday, M.; Tang, Y.; Bulku, A.; Wilbur, J.; Fraser, J. et al. (2023). Human PI3K p85alpha/p110alpha. Protein Data Bank: 8ts7. CMCF-ID Agriculture
Kang, R.W.; Thai, E.; Julien, J.P. (2023). Crystal structure of Ky15.11-S100IK Fab in complex with circumsporozoite protein KQPA peptide. Protein Data Bank: 8fb5. CMCF-ID Agriculture
Kariolis, M.S.; Lexa, K.; Liau, N.P.D.; Srivastava, D.; Tran, H. et al. (2023). Structure of complex between TV6.6 and CD98hc ECD. Protein Data Bank: 8g0m. CMCF-ID Agriculture
Kozlov, G.; Gehring, K. (2023). LaM domain of human LARP1 in complex with AAAAGA RNA. Protein Data Bank: 8ey8. CMCF-ID Agriculture