5KYK

Covalent GTP-competitive inhibitors of KRAS G12C: Guanosine bisphosphonate Analogs

Summary for 5KYK

• Entry DOI: 10.2210/pdb5kyk/pdb
• Descriptor: GTPase KRas, 5'-O-[(R)-[({2-[(chloroacetyl)amino]ethyl}sulfamoyl)methyl](hydroxy)phosphoryl]guanosine (3 entities in total)
• Functional Keywords: kras, cancer, covalent inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (Human)
• Cellular location: Cell membrane ; Lipid-anchor ; Cytoplasmic side : P01116
• Total number of polymer chains: 3
• Total formula weight: 59416.80

Authors

Xiong, Y.,Lu, J.,Hunter, J.,Li, L.,Scott, D.,Manandhar, A.,Gondi, S.,Westover, K.D.,Gray, N.S. (deposition date: 2016-07-21, release date: 2017-04-12, Last modification date: 2023-10-04)

• Primary citation: Xiong, Y.,Lu, J.,Hunter, J.,Li, L.,Scott, D.,Choi, H.G.,Lim, S.M.,Manandhar, A.,Gondi, S.,Sim, T.,Westover, K.D.,Gray, N.S.; Covalent Guanosine Mimetic Inhibitors of G12C KRAS.; ACS Med Chem Lett, 8:61-66, 2017; PubMed: 28105276; DOI: 10.1021/acsmedchemlett.6b00373

Experimental method

X-RAY DIFFRACTION (2.702 Å)