6R8W
Human Cyclophilin D in complex with 2-(exo-3,5-Dioxo-4-aza-tricyclo[5.2.1.02,6]dec-4-yl)-N-((1R,9R,10S)-10-hydroxy-12-oxa-8-aza-tricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ylmethyl)-acetamide
Summary for 6R8W
Entry DOI | 10.2210/pdb6r8w/pdb |
Descriptor | Peptidyl-prolyl cis-trans isomerase F, mitochondrial, 1,4,7,10,13,16-HEXAOXACYCLOOCTADECANE, HEXAETHYLENE GLYCOL, ... (5 entities in total) |
Functional Keywords | cyclophilin, beta barrel, prolyl cis/trans isomerase, mitoc, isomerase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 18624.25 |
Authors | Graedler, U. (deposition date: 2019-04-02, release date: 2019-11-27, Last modification date: 2024-01-24) |
Primary citation | Gradler, U.,Schwarz, D.,Blaesse, M.,Leuthner, B.,Johnson, T.L.,Bernard, F.,Jiang, X.,Marx, A.,Gilardone, M.,Lemoine, H.,Roche, D.,Jorand-Lebrun, C. Discovery of novel Cyclophilin D inhibitors starting from three dimensional fragments with millimolar potencies. Bioorg.Med.Chem.Lett., 29:126717-126717, 2019 Cited by PubMed: 31635932DOI: 10.1016/j.bmcl.2019.126717 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.4 Å) |
Structure validation
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