6B7E
Crystal structure of E.coli Phosphopantetheine Adenylyltransferase (PPAT/CoaD) in complex with (R)-4-(5-(difluoromethyl)-1H-imidazol-1-yl)-3,3-dimethylisochroman-1-one
Summary for 6B7E
Entry DOI | 10.2210/pdb6b7e/pdb |
Descriptor | Phosphopantetheine adenylyltransferase, SULFATE ION, DIMETHYL SULFOXIDE, ... (5 entities in total) |
Functional Keywords | coad, transferase |
Biological source | Escherichia coli (strain K12) |
Cellular location | Cytoplasm : P0A6I6 |
Total number of polymer chains | 2 |
Total formula weight | 38926.44 |
Authors | Proudfoot, A.W.,Bussiere, D.,Lingel, A. (deposition date: 2017-10-03, release date: 2017-12-27, Last modification date: 2023-10-04) |
Primary citation | Proudfoot, A.,Bussiere, D.E.,Lingel, A. High-Confidence Protein-Ligand Complex Modeling by NMR-Guided Docking Enables Early Hit Optimization. J. Am. Chem. Soc., 139:17824-17833, 2017 Cited by PubMed: 29190085DOI: 10.1021/jacs.7b07171 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.104 Å) |
Structure validation
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