4DV8

Anthrax Lethal Factor metalloproteinase in complex with the Hydroxamic acid based small molecule PT8421

Summary for 4DV8

Entry DOI	10.2210/pdb4dv8/pdb
Descriptor	Lethal factor, ZINC ION, (2S)-6-[(4-fluorobenzyl)amino]-2-[(2R)-2-(4-fluorophenyl)-2-methoxyethyl]-N-hydroxyhexanamide, ... (5 entities in total)
Functional Keywords	endopeptidase, zinc dependent, hydrolase
Biological source	Bacillus anthracis (anthrax,anthrax bacterium)
Cellular location	Secreted: P15917
Total number of polymer chains	1
Total formula weight	61965.03
Authors	Margosiak, S.A.,Sankaran, B. (deposition date: 2012-02-22, release date: 2012-03-14, Last modification date: 2024-02-28)
Primary citation	Jiao, G.S.,Kim, S.,Moayeri, M.,Crown, D.,Thai, A.,Cregar-Hernandez, L.,McKasson, L.,Sankaran, B.,Lehrer, A.,Wong, T.,Johns, L.,Margosiak, S.A.,Leppla, S.H.,Johnson, A.T. Antidotes to anthrax lethal factor intoxication. Part 3: Evaluation of core structures and further modifications to the C2-side chain. Bioorg.Med.Chem.Lett., 22:2242-, 2012 Cited by PubMed: 22342144 DOI: 10.1016/j.bmcl.2012.01.095 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.632 Å)

Structure validation