4R5W
Human artd1 (parp1) - catalytic domain in complex with inhibitor xav939
Summary for 4R5W
Entry DOI | 10.2210/pdb4r5w/pdb |
Related | 4R6E 4UND 4UXB |
Descriptor | Poly [ADP-ribose] polymerase 1, SULFATE ION, 2-[4-(trifluoromethyl)phenyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-ol, ... (4 entities in total) |
Functional Keywords | adp-ribosylation, dna repair, adp-ribosyl transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Nucleus : P09874 |
Total number of polymer chains | 2 |
Total formula weight | 81696.96 |
Authors | Karlberg, T.,Thorsell, A.G.,Schuler, H. (deposition date: 2014-08-22, release date: 2015-09-02, Last modification date: 2023-09-20) |
Primary citation | Thorsell, A.G.,Ekblad, T.,Karlberg, T.,Low, M.,Pinto, A.F.,Tresaugues, L.,Moche, M.,Cohen, M.S.,Schuler, H. Structural Basis for Potency and Promiscuity in Poly(ADP-ribose) Polymerase (PARP) and Tankyrase Inhibitors. J.Med.Chem., 60:1262-1271, 2017 Cited by PubMed: 28001384DOI: 10.1021/acs.jmedchem.6b00990 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.84 Å) |
Structure validation
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