Candito, David A.; Simov, Vladimir; Gulati, Anmol; Kattar, Solomon; Chau, Ryan W. et al. (2022). Discovery and Optimization of Potent, Selective, and Brain-Penetrant 1-Heteroaryl-1H-Indazole LRRK2 Kinase Inhibitors for the Treatment of Parkinson’s Disease. Journal of Medicinal Chemistry 65(24) , 16801-16817. 10.1021/acs.jmedchem.2c01605. [PDB: 8e80] |
CMCF-ID |
Peer-Reviewed Article |
Health |
Forrester, Taylor J. B.; Ovchinnikova, Olga G.; Li, Zhixiong; Kitova, Elena N.; Nothof, Jeremy T. et al. (2022). The retaining β-Kdo glycosyltransferase WbbB uses a double-displacement mechanism with an intermediate adduct rearrangement step. Nature Communications 13(1) . 10.1038/s41467-022-33988-1. [PDB: 8csb, 8csc, 8csd, 8cse, 8csf] |
CMCF-BM, CMCF-ID |
Peer-Reviewed Article |
Health |
Gheorghita, Andreea A.; Li, Yancheng E.; Kitova, Elena N.; Bui, Duong T.; Pfoh, Roland et al. (2022). Structure of the AlgKX modification and secretion complex required for alginate production and biofilm attachment in Pseudomonas aeruginosa. Nature Communications 13(1) . 10.1038/s41467-022-35131-6. [PDB: 7ula] |
CMCF-BM |
Peer-Reviewed Article |
Health |
Hallett, Robin M.; Bonfill-Teixidor, Ester; Iurlaro, Raffaella; Arias, Alexandra; Raman, Swetha et al. (2022). Therapeutic Targeting of LIF Overcomes Macrophage-mediated Immunosuppression of the Local Tumor Microenvironment. Clinical Cancer Research 29(4) , 791-804. 10.1158/1078-0432.ccr-21-1888. |
CMCF-ID |
Peer-Reviewed Article |
Health |
Kim, Hyeong Jin; Black, Mazzen; Edwards, Ross A.; Peillard-Fiorente, Flora; Panigrahi, Rashmi et al. (2022). Structural basis for recognition of transcriptional terminator structures by ProQ/FinO domain RNA chaperones. Nature Communications 13(1) . 10.1038/s41467-022-34875-5. [PDB: 7rgt] |
CMCF-ID |
Peer-Reviewed Article |
Health |
Kuttiyatveetil, Jijin R.A.; Soufari, Heddy; Dasovich, Morgan; Uribe, Isabel R.; Mirhasan, Manija et al. (2022). Crystal structures and functional analysis of the ZnF5-WWE1-WWE2 region of PARP13/ZAP define a distinctive mode of engaging poly(ADP-ribose). Cell Reports 41(4) , 111529. 10.1016/j.celrep.2022.111529. [PDB: 7sz2, 7sz3] |
CMCF-BM |
Peer-Reviewed Article |
Health |
Li, Kunhua; Tokareva, Olena S.; Thomson, Ty M.; Wahl, Sebastian C. T.; Travaline, Tara L. et al. (2022). De novo mapping of α-helix recognition sites on protein surfaces using unbiased libraries. Proceedings of the National Academy of Sciences of the United States of America 119(52) . 10.1073/pnas.2210435119. [PDB: 7uwi] |
CMCF-ID |
Peer-Reviewed Article |
Health |
Lorente Cobo, Neil; Sibinelli-Sousa, Stephanie; Biboy, Jacob; Vollmer, Waldemar; Bayer-Santos, Ethel et al. (2022). Molecular characterization of the type VI secretion system effector Tlde1a reveals a structurally altered LD-transpeptidase fold. Journal of Biological Chemistry 298(11) , 102556. 10.1016/j.jbc.2022.102556. [PDB: 7uo3, 7uo8] |
CMCF-BM |
Peer-Reviewed Article |
Health |
Luan, Xiaodong; Li, Xinming; Li, Yufan; Su, Gengchen; Yin, Wanchao et al. (2022). Antiviral drug design based on structural insights into the N-terminal domain and C-terminal domain of the SARS-CoV-2 nucleocapsid protein. Science Bulletin 67(22) , 2327-2335. 10.1016/j.scib.2022.10.021. [PDB: 7xwz] |
CMCF-ID |
Peer-Reviewed Article |
Health |
Mabanglo, Mark F.; Wong, Keith S.; Barghash, Marim M.; Leung, Elisa; Chuang, Stephanie H.W. et al. (2022). Potent ClpP agonists with anticancer properties bind with improved structural complementarity and alter the mitochondrial N-terminome. Structure . 10.1016/j.str.2022.12.002. [PDB: 7uvm, 7uvn, 7uvr, 7uvu, 7uw0] |
CMCF-BM |
Peer-Reviewed Article |
Health |
Schoepfer, Valerie A.; Lindsay, Matthew B.J. (2022). Repartitioning of co-precipitated Mo(VI) during Fe(II) and S(-II) driven ferrihydrite transformation. Chemical Geology 610, 121075. 10.1016/j.chemgeo.2022.121075. |
BIOXAS-MAIN, CMCF-BM, SXRMB |
Peer-Reviewed Article |
Environment |
Schoepfer, Valerie A.; Lindsay, Matthew B.J. (2022). X-ray absorption spectroscopy and X-ray diffraction data for molybdenum minerals and compounds. Data in Brief 45, 108576. 10.1016/j.dib.2022.108576. |
BIOXAS-MAIN, CMCF-BM, SXRMB |
Peer-Reviewed Article |
Environment |
Sharon, Itai; Grogg, Marcel; Hilvert, Donald; Schmeing, T. Martin (2022). The structure of cyanophycinase in complex with a cyanophycin degradation intermediate. Biochimica et Biophysica Acta - General Subjects 1866(11) , 130217. 10.1016/j.bbagen.2022.130217. [PDB: 7uqv] |
CMCF-BM |
Peer-Reviewed Article |
Health |
van Vliet, Vera J. E.; Huynh, Nhan; Palà, Judith; Patel, Ankoor; Singer, Alex et al. (2022). Ubiquitin variants potently inhibit SARS-CoV-2 PLpro and viral replication via a novel site distal to the protease active site. PLoS Pathogens 18(12) , e1011065. 10.1371/journal.ppat.1011065. |
CMCF |
Peer-Reviewed Article |
Health |
Ayanath Kuttiyatveetil, J.R.; Pascal, J.M. (2022). Mouse PARP13/ZAP ZnF5-WWE1-WWE2 bound to ADPr. Protein Data Bank: 7sz3. |
CMCF-BM |
PDB Deposition |
Agriculture |