8AFC

CRYSTAL STRUCTURE OF KRAS-G12C IN COMPLEX WITH COMPOUND 12

Summary for 8AFC

Entry DOI	10.2210/pdb8afc/pdb
Related	7U90 8AFB
Descriptor	GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ... (6 entities in total)
Functional Keywords	kras, gtpase, g12c, complex, inhibitor, oncoprotein
Biological source	Homo sapiens (human)
Total number of polymer chains	2
Total formula weight	39816.65
Authors	Boettcher, J.,Kessler, D. (deposition date: 2022-07-16, release date: 2022-11-09, Last modification date: 2024-01-31)
Primary citation	Broker, J.,Waterson, A.G.,Smethurst, C.,Kessler, D.,Bottcher, J.,Mayer, M.,Gmaschitz, G.,Phan, J.,Little, A.,Abbott, J.R.,Sun, Q.,Gmachl, M.,Rudolph, D.,Arnhof, H.,Rumpel, K.,Savarese, F.,Gerstberger, T.,Mischerikow, N.,Treu, M.,Herdeis, L.,Wunberg, T.,Gollner, A.,Weinstabl, H.,Mantoulidis, A.,Kramer, O.,McConnell, D.B.,W Fesik, S. Fragment Optimization of Reversible Binding to the Switch II Pocket on KRAS Leads to a Potent, In Vivo Active KRAS G12C Inhibitor. J.Med.Chem., 65:14614-14629, 2022 Cited by PubMed: 36300829 DOI: 10.1021/acs.jmedchem.2c01120 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.41 Å)

Structure validation