4EHE

B-Raf Kinase Domain in Complex with an Aminothienopyrimidine-based Inhibitor

Summary for 4EHE

• Entry DOI: 10.2210/pdb4ehe/pdb
• Related: 4EHG
• Descriptor: Serine/threonine-protein kinase B-raf, 4-amino-N-{2,6-difluoro-3-[(propylsulfonyl)amino]phenyl}thieno[3,2-d]pyrimidine-7-carboxamide (2 entities in total)
• Functional Keywords: kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Nucleus (By similarity): P15056
• Total number of polymer chains: 2
• Total formula weight: 71290.16

Authors

Voegtli, W.C. (deposition date: 2012-04-02, release date: 2013-04-24, Last modification date: 2024-02-28)

• Primary citation: Mathieu, S.,Gradl, S.N.,Ren, L.,Wen, Z.,Aliagas, I.,Gunzner-Toste, J.,Lee, W.,Pulk, R.,Zhao, G.,Alicke, B.,Boggs, J.W.,Buckmelter, A.J.,Choo, E.F.,Dinkel, V.,Gloor, S.L.,Gould, S.E.,Hansen, J.D.,Hastings, G.,Hatzivassiliou, G.,Laird, E.R.,Moreno, D.,Ran, Y.,Voegtli, W.C.,Wenglowsky, S.,Grina, J.,Rudolph, J.; Potent and selective aminopyrimidine-based B-raf inhibitors with favorable physicochemical and pharmacokinetic properties.; J.Med.Chem., 55:2869-2881, 2012; PubMed: 22335519; DOI: 10.1021/jm300016v

Experimental method

X-RAY DIFFRACTION (3.3 Å)