9EU8
The FK1 domain of FKBP51 in complex with SAFit-analog 15h
This is a non-PDB format compatible entry.
Summary for 9EU8
Entry DOI | 10.2210/pdb9eu8/pdb |
Descriptor | Peptidyl-prolyl cis-trans isomerase FKBP5, (4-methyl-1,3-thiazol-5-yl)methyl (2S)-1-[(2S)-2-cyclohexyl-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidine-2-carboxylate (3 entities in total) |
Functional Keywords | fkbp51, inhibitor, complex, isomerase |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 2 |
Total formula weight | 29069.40 |
Authors | Meyners, C.,Buffa, V.,Hausch, F. (deposition date: 2024-03-27, release date: 2024-06-12, Last modification date: 2024-09-11) |
Primary citation | Buffa, V.,Meyners, C.,Sugiarto, W.O.,Bauder, M.,Gaali, S.,Hausch, F. 1,4-Pyrazolyl-Containing SAFit-Analogues are Selective FKBP51 Inhibitors With Improved Ligand Efficiency and Drug-Like Profile. Chemmedchem, 19:e202400264-e202400264, 2024 Cited by PubMed: 38818693DOI: 10.1002/cmdc.202400264 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.3 Å) |
Structure validation
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