6B7F
Crystal structure of E.coli Phosphopantetheine Adenylyltransferase (PPAT/CoaD) in complex with (R)-3,3-dimethyl-4-(5-vinyl-1H-imidazol-1-yl)isochroman-1-one
Summary for 6B7F
| Entry DOI | 10.2210/pdb6b7f/pdb |
| Descriptor | Phosphopantetheine adenylyltransferase, DIMETHYL SULFOXIDE, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ... (8 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 | 38951.48 |
| 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 (2.562 Å) |
Structure validation
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