5NGE

Crystal structure of USP7 in complex with the non-covalent inhibitor, FT671

Summary for 5NGE

• Entry DOI: 10.2210/pdb5nge/pdb
• Descriptor: Ubiquitin carboxyl-terminal hydrolase 7, 5-[[1-[(3~{S})-4,4-bis(fluoranyl)-3-(3-fluoranylpyrazol-1-yl)butanoyl]-4-oxidanyl-piperidin-4-yl]methyl]-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one (3 entities in total)
• Functional Keywords: deubiquitination, hydrolase
• Biological source: Homo sapiens (Human)
• Cellular location: Nucleus : Q93009
• Total number of polymer chains: 2
• Total formula weight: 83363.90

Authors

Turnbull, A.P.,Krajewski, W.W.,Ioannidis, S.,Kessler, B.M.,Komander, D. (deposition date: 2017-03-17, release date: 2017-10-18, Last modification date: 2024-01-17)

• Primary citation: Turnbull, A.P.,Ioannidis, S.,Krajewski, W.W.,Pinto-Fernandez, A.,Heride, C.,Martin, A.C.L.,Tonkin, L.M.,Townsend, E.C.,Buker, S.M.,Lancia, D.R.,Caravella, J.A.,Toms, A.V.,Charlton, T.M.,Lahdenranta, J.,Wilker, E.,Follows, B.C.,Evans, N.J.,Stead, L.,Alli, C.,Zarayskiy, V.V.,Talbot, A.C.,Buckmelter, A.J.,Wang, M.,McKinnon, C.L.,Saab, F.,McGouran, J.F.,Century, H.,Gersch, M.,Pittman, M.S.,Marshall, C.G.,Raynham, T.M.,Simcox, M.,Stewart, L.M.D.,McLoughlin, S.B.,Escobedo, J.A.,Bair, K.W.,Dinsmore, C.J.,Hammonds, T.R.,Kim, S.,Urbe, S.,Clague, M.J.,Kessler, B.M.,Komander, D.; Molecular basis of USP7 inhibition by selective small-molecule inhibitors.; Nature, 550:481-486, 2017; PubMed: 29045389; DOI: 10.1038/nature24451

Experimental method

X-RAY DIFFRACTION (2.35 Å)