6XCF
Structure of the C. botulinum neurotoxin serotype A light chain protease in complex with noncovalent inhibitor 59
Summary for 6XCF
Entry DOI | 10.2210/pdb6xcf/pdb |
Descriptor | Botulinum neurotoxin type A, (3R)-3-(2,4-dichlorophenyl)-N~1~-hydroxy-N~5~-pentylpentanediamide, ZINC ION, ... (4 entities in total) |
Functional Keywords | covalent inhibitor, hydroxamate, toxin, toxin-inhibitor complex, toxin/inhibitor |
Biological source | Clostridium botulinum |
Total number of polymer chains | 1 |
Total formula weight | 50881.55 |
Authors | Tararina, M.A.,Allen, K.N. (deposition date: 2020-06-08, release date: 2020-09-23, Last modification date: 2023-10-18) |
Primary citation | Lin, L.,Olson, M.E.,Sugane, T.,Turner, L.D.,Tararina, M.A.,Nielsen, A.L.,Kurbanov, E.K.,Pellett, S.,Johnson, E.A.,Cohen, S.M.,Allen, K.N.,Janda, K.D. Catch and Anchor Approach To Combat Both Toxicity and Longevity of Botulinum Toxin A. J.Med.Chem., 63:11100-11120, 2020 Cited by PubMed: 32886509DOI: 10.1021/acs.jmedchem.0c01006 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.68 Å) |
Structure validation
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