3QIY
Crystal Structure of BoNT/A LC complexed with Hydroxamate-based Inhibitor PT-1
Summary for 3QIY
Entry DOI | 10.2210/pdb3qiy/pdb |
Related | 3QIX 3QIZ 3QJ0 |
Descriptor | Botulinum neurotoxin type A, ZINC ION, 4-[bis(4-chlorobenzyl)amino]-N-hydroxybutanamide, ... (5 entities in total) |
Functional Keywords | botulinum, bont, neurotoxin, toxin, hydroxamate, inhibitor, metalloprotease, protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Clostridium botulinum |
Cellular location | Botulinum neurotoxin A light chain: Secreted. Botulinum neurotoxin A heavy chain: Secreted: A5HZZ9 |
Total number of polymer chains | 1 |
Total formula weight | 49932.48 |
Authors | Thompson, A.A.,Han, G.W.,Stevens, R.C. (deposition date: 2011-01-28, release date: 2011-04-13, Last modification date: 2023-09-13) |
Primary citation | Thompson, A.A.,Jiao, G.S.,Kim, S.,Thai, A.,Cregar-Hernandez, L.,Margosiak, S.A.,Johnson, A.T.,Han, G.W.,O'Malley, S.,Stevens, R.C. Structural Characterization of Three Novel Hydroxamate-Based Zinc Chelating Inhibitors of the Clostridium botulinum Serotype A Neurotoxin Light Chain Metalloprotease Reveals a Compact Binding Site Resulting from 60/70 Loop Flexibility. Biochemistry, 50:4019-4028, 2011 Cited by PubMed: 21434688DOI: 10.1021/bi2001483 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.3 Å) |
Structure validation
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