Michino, Mayako; Beautrait, Alexandre; Boyles, Nicholas A.; Nadupalli, Aparna; Dementiev, Alexey et al. (2023). Shape-Based Virtual Screening of a Billion-Compound Library Identifies Mycobacterial Lipoamide Dehydrogenase Inhibitors. ACS Bio and Med Chem Au 3(6) , 507-515. 10.1021/acsbiomedchemau.3c00046. [PDB: 8u0q] |
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Miranda-Zaragoza, Beatriz; Huerta-Miranda, Guillermo A.; García-García, Wendy I.; Hernández-Álvarez, Elizabeth; Solano-Peralta, Alejandro et al. (2025). Structure-Function Relationship of the β-Hairpin of Thermus thermophilus HB27 Laccase. International Journal of Molecular Sciences 26(2) , 735. 10.3390/ijms26020735. [PDB: 9cpm] |
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Muna, T.H.; Prehna, G. (2025). Crystal structure of Esub1. Protein Data Bank: 8vsq. |
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Nakhla, Mina C.; Comita, Janelle; Shapiro, Adam B.; Moussa, Samir H.; Chen, April et al. (2025). Small molecule inhibitors of mannan-binding lectin-associated serine Proteases-2 and-3. European Journal of Medicinal Chemistry 289, 117238. 10.1016/j.ejmech.2025.117238. [PDB: 9d17, 9d3y, 9d40, 9d4d] |
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Palte, R.L. (2023). Structure of LRRK2-CHK1 10-pt. mutant complex with heteroaryl-1H-indazole LRRK2 inhibitor 14. Protein Data Bank: 8e80. |
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Pau, V.P.T.; Mao, D.Y.L.; Mader, P.; Maderova, Z.; Zimmermann, M. et al. (2025). Crystal structure of PLK4 and RP1664 complex. Protein Data Bank: 9o63. |
CMCF-ID |
PDB Deposition |
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Perez-Bermejo, Juan A.; Efagene, Oghene; Matern, William M.; Holden, Jeffrey K.; Kabir, Shaheen et al. (2024). Functional screening in human HSPCs identifies optimized protein-based enhancers of Homology Directed Repair. Nature Communications 15(1) . 10.1038/s41467-024-46816-5. [PDB: 8svg, 8svh, 8svi] |
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Pham, N.T.H.; Calmettes, C.; Doucet, N. (2023). Crystal structure of D94A human Galectin-7 mutant in presence of lactose. Protein Data Bank: 7tkz. |
CMCF-ID |
PDB Deposition |
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Pham, N.T.H.; Calmettes, C.; Doucet, N. (2023). Crystal structure of R14A human Galectin-7 mutant. Protein Data Bank: 7tkw. |
CMCF-ID |
PDB Deposition |
Health |
Pham, N.T.H.; Calmettes, C.; Doucet, N. (2023). Crystal structure of R20A human Galectin-7 mutant in presence of lactose. Protein Data Bank: 7n57. |
CMCF-ID |
PDB Deposition |
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Picard, M.-E.; Grenier, J.; Despres, P.C.; Dube, A.K.; Landry, C.R. et al. (2024). Crystal structure of the yeast cytosine deaminase (yCD) M100W mutant. Protein Data Bank: 8vll. |
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Pistofidis, A.; Schmeing, T.M. (2024). The post-condensation state of the dimodular NRPS protein LgrA. Protein Data Bank: 9be4. |
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Pistofidis, A.; Schmeing, T.M. (2024). The pre-condensation state of the dimodular NRPS protein LgrA. Protein Data Bank: 9be3. |
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PDB Deposition |
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Poullennec, Karine G.; Jnoff, Eric; Abendroth, Jan; Bhuma, Naresh; Calmiano, Mark et al. (2024). Discovery of UCB9386: A Potent, Selective, and Brain-Penetrant Nuak1 Inhibitor Suitable for In Vivo Pharmacological Studies. Journal of Medicinal Chemistry 67(23) , 20879-20910. 10.1021/acs.jmedchem.4c01237. [PDB: 8uoj] |
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Puumala, Emily; Sychantha, David; Lach, Elizabeth; Reeves, Shawn; Nabeela, Sunna et al. (2024). Allosteric inhibition of tRNA synthetase Gln4 by N-pyrimidinyl-β-thiophenylacrylamides exerts highly selective antifungal activity. Cell Chemical Biology . 10.1016/j.chembiol.2024.01.010. [PDB: 8uk6] |
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