4NBL
Tailoring Small Molecules for an Allosteric Site on Procaspase-6
Summary for 4NBL
Entry DOI | 10.2210/pdb4nbl/pdb |
Related | 4N5D 4N6G 4N7J 4N7M 4NBK 4NBN |
Descriptor | Caspase-6, 5-fluoro-2-({[3-(pyrimidin-2-yl)pyridin-2-yl]amino}methyl)phenol, PHOSPHATE ION, ... (4 entities in total) |
Functional Keywords | procaspse-6, caspase-6 zymogen, allosteric, structure based drug design, caspase, cysteine protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Cytoplasm: P55212 |
Total number of polymer chains | 2 |
Total formula weight | 65493.84 |
Authors | Murray, J.M.,Steffek, M. (deposition date: 2013-10-23, release date: 2014-01-01, Last modification date: 2024-02-28) |
Primary citation | Murray, J.,Giannetti, A.M.,Steffek, M.,Gibbons, P.,Hearn, B.R.,Cohen, F.,Tam, C.,Pozniak, C.,Bravo, B.,Lewcock, J.,Jaishankar, P.,Ly, C.Q.,Zhao, X.,Tang, Y.,Chugha, P.,Arkin, M.R.,Flygare, J.,Renslo, A.R. Tailoring small molecules for an allosteric site on procaspase-6. Chemmedchem, 9:73-77, 2014 Cited by PubMed: 24259468DOI: 10.1002/cmdc.201300424 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.756 Å) |
Structure validation
Download full validation report