8C7R
Crystal structure of rat autotaxin and compound MEY-003
Summary for 8C7R
Entry DOI | 10.2210/pdb8c7r/pdb |
Descriptor | Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 5,7-bis(oxidanyl)-2-(1-pentylindol-3-yl)chromen-4-one, ... (8 entities in total) |
Functional Keywords | inhibitor, co-crystal, ectonucleotide pyrophosphatase/phosphodiesterase (enpp), hydrolase |
Biological source | Rattus norvegicus (Norway rat) |
Total number of polymer chains | 1 |
Total formula weight | 100735.30 |
Authors | Eymery, M.C.,McCarthy, A.A. (deposition date: 2023-01-17, release date: 2023-11-22, Last modification date: 2023-11-29) |
Primary citation | Eymery, M.C.,Nguyen, K.A.,Basu, S.,Hausmann, J.,Tran-Nguyen, V.K.,Seidel, H.P.,Gutierrez, L.,Boumendjel, A.,McCarthy, A.A. Discovery of potent chromone-based autotaxin inhibitors inspired by cannabinoids. Eur.J.Med.Chem., 263:115944-115944, 2023 Cited by PubMed: 37976710DOI: 10.1016/j.ejmech.2023.115944 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.53 Å) |
Structure validation
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