6TLD

Crystal structure of Schistosoma mansoni HDAC8 complexed with a triazole hydroxamate inhibitor 2

Summary for 6TLD

Entry DOI	10.2210/pdb6tld/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
Total number of polymer chains	4
Total formula weight	206030.09
Authors	Shaik, T.B.,Romier, C. (deposition date: 2019-12-02, release date: 2019-12-18, Last modification date: 2024-01-24)
Primary citation	Kalinin, D.V.,Jana, S.K.,Pfafenrot, M.,Chakrabarti, A.,Melesina, J.,Shaik, T.B.,Lancelot, J.,Pierce, R.J.,Sippl, W.,Romier, C.,Jung, M.,Holl, R. Structure-Based Design, Synthesis, and Biological Evaluation of Triazole-Based smHDAC8 Inhibitors. Chemmedchem, 15:571-584, 2020 Cited by PubMed: 31816172 DOI: 10.1002/cmdc.201900583 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.61 Å)

Structure validation