6GXU
Crystal structure of Schistosoma mansoni HDAC8 complexed with an hydroxamate 3
Summary for 6GXU
Entry DOI | 10.2210/pdb6gxu/pdb |
Descriptor | Histone deacetylase, ZINC ION, POTASSIUM ION, ... (7 entities in total) |
Functional Keywords | epigenetics, histone deacetylase, hdac8, selective inhibitor, pathogen, hydrolase |
Biological source | Schistosoma mansoni (Blood fluke) |
Total number of polymer chains | 4 |
Total formula weight | 206325.37 |
Authors | Shaik, T.B.,Marek, M.,Romier, C. (deposition date: 2018-06-27, release date: 2018-08-15, Last modification date: 2024-01-17) |
Primary citation | Bayer, T.,Chakrabarti, A.,Lancelot, J.,Shaik, T.B.,Hausmann, K.,Melesina, J.,Schmidtkunz, K.,Marek, M.,Erdmann, F.,Schmidt, M.,Robaa, D.,Romier, C.,Pierce, R.J.,Jung, M.,Sippl, W. Synthesis, Crystallization Studies, and in vitro Characterization of Cinnamic Acid Derivatives as SmHDAC8 Inhibitors for the Treatment of Schistosomiasis. ChemMedChem, 13:1517-1529, 2018 Cited by PubMed: 29806110DOI: 10.1002/cmdc.201800238 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.917 Å) |
Structure validation
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