7KK5

Structure of the catalytic domain of PARP1 in complex with niraparib

Summary for 7KK5

• Entry DOI: 10.2210/pdb7kk5/pdb
• Descriptor: Poly [ADP-ribose] polymerase 1, 2-{4-[(3S)-piperidin-3-yl]phenyl}-2H-indazole-7-carboxamide, SULFATE ION, ... (4 entities in total)
• Functional Keywords: parp1, transferase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 4
• Total formula weight: 160470.70

Authors

Gajiwala, K.S.,Ryan, K. (deposition date: 2020-10-27, release date: 2021-01-06, Last modification date: 2023-10-18)

• Primary citation: Ryan, K.,Bolanos, B.,Smith, M.,Palde, P.B.,Cuenca, P.D.,VanArsdale, T.L.,Niessen, S.,Zhang, L.,Behenna, D.,Ornelas, M.A.,Tran, K.T.,Kaiser, S.,Lum, L.,Stewart, A.,Gajiwala, K.S.; Dissecting the molecular determinants of clinical PARP1 inhibitor selectivity for tankyrase1.; J.Biol.Chem., 296:100251-100251, 2021; PubMed: 33361107; DOI: 10.1074/jbc.RA120.016573

Experimental method

X-RAY DIFFRACTION (1.7 Å)