6NRG
Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT57
Summary for 6NRG
Entry DOI | 10.2210/pdb6nrg/pdb |
Related | 6NRF |
Descriptor | Poly [ADP-ribose] polymerase 1, 2-{[3-fluoro-4-(1H-tetrazol-5-yl)phenyl]methyl}-3-hydroxy-1-benzofuran-7-carboxamide, SULFATE ION, ... (5 entities in total) |
Functional Keywords | parp-1, poly(adp-ribose) polymerase, parp inhibitor, parp1, artd1, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 31071.30 |
Authors | Langelier, M.F.,Pascal, J.M. (deposition date: 2019-01-23, release date: 2019-08-14, Last modification date: 2023-10-11) |
Primary citation | Velagapudi, U.K.,Langelier, M.F.,Delgado-Martin, C.,Diolaiti, M.E.,Bakker, S.,Ashworth, A.,Patel, B.A.,Shao, X.,Pascal, J.M.,Talele, T.T. Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity. J.Med.Chem., 62:5330-5357, 2019 Cited by PubMed: 31042381DOI: 10.1021/acs.jmedchem.8b01709 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.7 Å) |
Structure validation
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