6WBZ

Structure of Human HDAC2 in complex with an ethyl ketone inhibitor containing a spiro-bicyclic group

Summary for 6WBZ

Entry DOI	10.2210/pdb6wbz/pdb
Descriptor	Histone deacetylase 2, ZINC ION, SULFATE ION, ... (7 entities in total)
Functional Keywords	histone deacetylase, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens (Human)
Total number of polymer chains	3
Total formula weight	133017.32
Authors	Klein, D.J.,Yu, W. (deposition date: 2020-03-28, release date: 2020-05-06, Last modification date: 2024-03-06)
Primary citation	Yu, W.,Liu, J.,Yu, Y.,Zhang, V.,Clausen, D.,Kelly, J.,Wolkenberg, S.,Beshore, D.,Duffy, J.L.,Chung, C.C.,Myers, R.W.,Klein, D.J.,Fells, J.,Holloway, K.,Wu, J.,Wu, G.,Howell, B.J.,Barnard, R.J.O.,Kozlowski, J. Discovery of ethyl ketone-based HDACs 1, 2, and 3 selective inhibitors for HIV latency reactivation. Bioorg.Med.Chem.Lett., 30:127197-127197, 2020 Cited by PubMed: 32331932 DOI: 10.1016/j.bmcl.2020.127197 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.32 Å)

Structure validation