6WU8

Structure of human SHP2 in complex with inhibitor IACS-13909

Summary for 6WU8

• Entry DOI: 10.2210/pdb6wu8/pdb
• Descriptor: Tyrosine-protein phosphatase non-receptor type 11, 1-[3-(2,3-dichlorophenyl)-1H-pyrazolo[3,4-b]pyrazin-6-yl]-4-methylpiperidin-4-amine (3 entities in total)
• Functional Keywords: phosphatase, inhibitor, complex, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 123737.34

Authors

Leonard, P.G.,Joseph, S.,Rodenberger, A. (deposition date: 2020-05-04, release date: 2021-03-17, Last modification date: 2023-10-18)

• Primary citation: Sun, Y.,Meyers, B.A.,Czako, B.,Leonard, P.,Mseeh, F.,Harris, A.L.,Wu, Q.,Johnson, S.,Parker, C.A.,Cross, J.B.,Di Francesco, M.E.,Bivona, B.J.,Bristow, C.A.,Burke, J.P.,Carrillo, C.C.,Carroll, C.L.,Chang, Q.,Feng, N.,Gao, G.,Gera, S.,Giuliani, V.,Huang, J.K.,Jiang, Y.,Kang, Z.,Kovacs, J.J.,Liu, C.Y.,Lopez, A.M.,Ma, X.,Mandal, P.K.,McAfoos, T.,Miller, M.A.,Mullinax, R.A.,Peoples, M.,Ramamoorthy, V.,Seth, S.,Spencer, N.D.,Suzuki, E.,Williams, C.C.,Yu, S.S.,Zuniga, A.M.,Draetta, G.F.,Marszalek, J.R.,Heffernan, T.P.,Kohl, N.E.,Jones, P.; Allosteric SHP2 Inhibitor, IACS-13909, Overcomes EGFR-Dependent and EGFR-Independent Resistance Mechanisms toward Osimertinib.; Cancer Res., 80:4840-4853, 2020; PubMed: 32928921; DOI: 10.1158/0008-5472.CAN-20-1634

Experimental method

X-RAY DIFFRACTION (2.4 Å)