4NL1

Crystal structure of B. anthracis DHPS with compound 11: (E)-N-[4-(trifluoromethyl)benzyl]-1-[4-(trifluoromethyl)phenyl]methanimine

Summary for 4NL1

Entry DOI	10.2210/pdb4nl1/pdb
Related	4NHV 4NIL 4NIR
Descriptor	Dihydropteroate Synthase, (E)-N-[4-(trifluoromethyl)benzyl]-1-[4-(trifluoromethyl)phenyl]methanimine, SULFATE ION, ... (4 entities in total)
Functional Keywords	tim barrel, tim barel, transferase, pterin, paba, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Bacillus anthracis (anthrax, anthrax bacterium)
Total number of polymer chains	2
Total formula weight	67198.48
Authors	Hammoudeh, D.I.,White, S.W. (deposition date: 2013-11-13, release date: 2014-05-14, Last modification date: 2023-09-20)
Primary citation	Hammoudeh, D.I.,Date, M.,Yun, M.K.,Zhang, W.,Boyd, V.A.,Viacava Follis, A.,Griffith, E.,Lee, R.E.,Bashford, D.,White, S.W. Identification and characterization of an allosteric inhibitory site on dihydropteroate synthase. Acs Chem.Biol., 9:1294-1302, 2014 Cited by PubMed: 24650357 DOI: 10.1021/cb500038g PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.3 Å)

Structure validation