| Li, Mingzong; Konteatis, Zenon; Nagaraja, Nelamangala; Chen, Yue; Zhou, Shubao et al. (2022). Leveraging Structure-Based Drug Design to Identify Next-Generation MAT2A Inhibitors, Including Brain-Penetrant and Peripherally Efficacious Leads. Journal of Medicinal Chemistry 65(6) , 4600-4615. 10.1021/acs.jmedchem.1c01595. [PDB: 7rwg] |
CMCF-BM |
Peer-Reviewed Article |
Health |
| Naidu, B. Narasimhulu; Patel, Manoj; McAuliffe, Brian; Ding, Bo; Cianci, Christopher et al. (2022). Design, Synthesis, and Preclinical Profiling of GSK3739936 (BMS-986180), an Allosteric Inhibitor of HIV-1 Integrase with Broad-Spectrum Activity toward 124/125 Polymorphs. Journal of Medicinal Chemistry 65(6) , 4949-4971. 10.1021/acs.jmedchem.1c02169. [PDB: 7t9o] |
CMCF-ID |
Peer-Reviewed Article |
Health |
| Jin, L.; Padyana, A.K. (2022). "Crystal structure of human methionine adenosyltransferase 2A (MAT2A) in complex with SAM and allosteric inhibitor AGI-43192. Protein Data Bank: 7rwg. |
CMCF-BM |
PDB Deposition |
Health |
| Palte, R.L. (2022). Structure of CHK1 10-pt. mutant complex with LRRK2 inhibitor 15. Protein Data Bank: 7suh. |
CMCF-ID |
PDB Deposition |
Health |
| Seattle Structural Genomics Center for Infectious Disease (SSGCID) (2022). Crystal Structure of Human DHFR complexed with NADP and N10-formyl-tetrahydrofolate. Protein Data Bank: 5sdb. |
CMCF-ID |
PDB Deposition |
Health |
| Seattle Structural Genomics Center for Infectious Disease (SSGCID) (2022). Crystal Structure of Dihydrofolate Reductase from Mycobacterium tuberculosis bound to NADP and SDDC Inhibitor SDDC-1236 (enantiomer). Protein Data Bank: 5sd2. |
CMCF-ID |
PDB Deposition |
Health |
| Seattle Structural Genomics Center for Infectious Disease (SSGCID) (2022). Crystal Structure of Dihydrofolate Reductase from Mycobacterium tuberculosis bound to NADP and SDDC Inhibitor SDDC-1235 (enantiomer). Protein Data Bank: 5sd1. |
CMCF-ID |
PDB Deposition |
Health |
| Seattle Structural Genomics Center for Infectious Disease (SSGCID) (2022). Crystal Structure of Dihydrofolate Reductase from Mycobacterium tuberculosis bound to NADP and SDDC Inhibitor SDDC-1225. Protein Data Bank: 5sd0. |
CMCF-ID |
PDB Deposition |
Health |
| Seattle Structural Genomics Center for Infectious Disease (SSGCID) (2022). Crystal Structure of Dihydrofolate Reductase from Mycobacterium tuberculosis bound to NADP and SDDC Inhibitor SDDC-1224. Protein Data Bank: 5scz. |
CMCF-ID |
PDB Deposition |
Health |
| Vajdos, F.F. (2022). Vanin-1 complexed with Compound 27. Protein Data Bank: 7sly. |
CMCF-ID |
PDB Deposition |
Health |