8TXE

Crystal structure of KRAS G12D in complex with GDP and compound 5

Summary for 8TXE

• Entry DOI: 10.2210/pdb8txe/pdb
• Descriptor: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ... (5 entities in total)
• Functional Keywords: molecule, gtpase, kras, inhibitor, oncoprotein, oncoprotein-inhibitor complex, oncoprotein/inhibitor
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 40956.80

Authors

Chen, P.,Irimia, A.,Yang, Z. (deposition date: 2023-08-23, release date: 2023-11-08)

• Primary citation: Cheng, H.,Li, P.,Chen, P.,Irimia, A.,Bae, J.H.,Brooun, A.,Fagan, P.,Lam, R.,Lin, B.,Zhang, J.,Zhan, X.,Wu, X.,Xie, N.,Chiang, G.,Shoemaker, R.,Vernier, J.M.; Structure-Based Design and Synthesis of Potent and Selective KRAS G12D Inhibitors.; Acs Med.Chem.Lett., 14:1351-1357, 2023; PubMed: 37849557; DOI: 10.1021/acsmedchemlett.3c00245

Experimental method

X-RAY DIFFRACTION (1.35 Å)