6YL4
Soluble epoxide hydrolase in complex with 3-((R)-3-(1-hydroxyureido)but-1-yn-1-yl)-N-((S)-3-phenyl-3-(4-trifluoromethoxy)phenyl)propyl)benzamide
Summary for 6YL4
Entry DOI | 10.2210/pdb6yl4/pdb |
Descriptor | Bifunctional epoxide hydrolase 2, 3-[(3~{R})-3-[aminocarbonyl(oxidanyl)amino]but-1-ynyl]-~{N}-[(3~{S})-3-phenyl-3-[4-(trifluoromethyloxy)phenyl]propyl]benzamide (3 entities in total) |
Functional Keywords | inhibitor, complex, seh, hydrolase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 40174.05 |
Authors | Kramer, J.S.,Pogoryelov, D.,Hiesinger, K.,Proschak, E. (deposition date: 2020-04-06, release date: 2020-10-21, Last modification date: 2024-05-15) |
Primary citation | Hiesinger, K.,Kramer, J.S.,Beyer, S.,Eckes, T.,Brunst, S.,Flauaus, C.,Wittmann, S.K.,Weizel, L.,Kaiser, A.,Kretschmer, S.B.M.,George, S.,Angioni, C.,Heering, J.,Geisslinger, G.,Schubert-Zsilavecz, M.,Schmidtko, A.,Pogoryelov, D.,Pfeilschifter, J.,Hofmann, B.,Steinhilber, D.,Schwalm, S.,Proschak, E. Design, Synthesis, and Structure-Activity Relationship Studies of Dual Inhibitors of Soluble Epoxide Hydrolase and 5-Lipoxygenase. J.Med.Chem., 63:11498-11521, 2020 Cited by PubMed: 33044073DOI: 10.1021/acs.jmedchem.0c00561 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.001 Å) |
Structure validation
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