6HVH

Human PFKFB3 in complex with a N-Aryl 6-Aminoquinoxaline inhibitor 1

Summary for 6HVH

• Entry DOI: 10.2210/pdb6hvh/pdb
• Descriptor: 6-phosphofructo-2-kinase/fructose-2,6-bisphosphatase 3, 3-[[8-(1-methylindol-6-yl)quinoxalin-6-yl]amino]-~{N}-(oxan-4-yl)pyridine-4-carboxamide, PYROPHOSPHATE 2-, ... (6 entities in total)
• Functional Keywords: kinase, complex, metabolism, cancer, transferase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 60797.88

Authors

Banaszak, K.,Jakubiec, K.,Bialas, A.,Fabritius, C.H.,Nowak, M. (deposition date: 2018-10-11, release date: 2018-11-14, Last modification date: 2020-07-29)

• Primary citation: Boutard, N.,Bialas, A.,Sabiniarz, A.,Guzik, P.,Banaszak, K.,Biela, A.,Bien, M.,Buda, A.,Bugaj, B.,Cieluch, E.,Cierpich, A.,Dudek, L.,Eggenweiler, H.M.,Fogt, J.,Gaik, M.,Gondela, A.,Jakubiec, K.,Jurzak, M.,Kitlinska, A.,Kowalczyk, P.,Kujawa, M.,Kwiecinska, K.,Les, M.,Lindemann, R.,Maciuszek, M.,Mikulski, M.,Niedziejko, P.,Obara, A.,Pawlik, H.,Rzymski, T.,Sieprawska-Lupa, M.,Sowinska, M.,Szeremeta-Spisak, J.,Stachowicz, A.,Tomczyk, M.M.,Wiklik, K.,Wloszczak, L.,Ziemianska, S.,Zarebski, A.,Brzozka, K.,Nowak, M.,Fabritius, C.H.; Discovery and Structure-Activity Relationships of N-Aryl 6-Aminoquinoxalines as Potent PFKFB3 Kinase Inhibitors.; ChemMedChem, 14:169-181, 2019; PubMed: 30378281; DOI: 10.1002/cmdc.201800569

Experimental method

X-RAY DIFFRACTION (2.36 Å)