5EN4
Complex of 17-beta-hydroxysteroid dehydrogenase type 14 with inhibitor.
Summary for 5EN4
Entry DOI | 10.2210/pdb5en4/pdb |
Related | 1YDE |
Descriptor | 17-beta-hydroxysteroid dehydrogenase 14, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, [2,3-bis(oxidanyl)phenyl]-[6-(2-fluoranyl-3-oxidanyl-phenyl)pyridin-2-yl]methanone, ... (5 entities in total) |
Functional Keywords | inhibitor complex, steroid dehydrogenase, oxidoreductase |
Biological source | Homo sapiens (Human) |
Cellular location | Cytoplasm : Q9BPX1 |
Total number of polymer chains | 1 |
Total formula weight | 29355.13 |
Authors | Bertoletti, N.,Braun, F.,Marchais-Oberwinkler, S.,Heine, A.,Klebe, G. (deposition date: 2015-11-09, release date: 2016-11-23, Last modification date: 2024-01-10) |
Primary citation | Braun, F.,Bertoletti, N.,Moller, G.,Adamski, J.,Steinmetzer, T.,Salah, M.,Abdelsamie, A.S.,van Koppen, C.J.,Heine, A.,Klebe, G.,Marchais-Oberwinkler, S. First Structure-Activity Relationship of 17 beta-Hydroxysteroid Dehydrogenase Type 14 Nonsteroidal Inhibitors and Crystal Structures in Complex with the Enzyme. J. Med. Chem., 59:10719-10737, 2016 Cited by PubMed: 27933965DOI: 10.1021/acs.jmedchem.6b01436 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.52 Å) |
Structure validation
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