4DAF
Crystal structure of B. anthracis DHPS with compound 19
Summary for 4DAF
Entry DOI | 10.2210/pdb4daf/pdb |
Related | 1TWS 4D8A 4D8Z 4D9P 4DAI 4DB7 |
Descriptor | Dihydropteroate Synthase, (2R)-2-(7-amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid, SULFATE ION, ... (4 entities in total) |
Functional Keywords | tim barrel, dhps inhibitor, transferase, paba, dhpp, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Bacillus anthracis (anthrax) |
Total number of polymer chains | 2 |
Total formula weight | 67038.37 |
Authors | Hammoudeh, D.,Lee, R.E.,White, S.W. (deposition date: 2012-01-12, release date: 2012-04-04, Last modification date: 2023-09-13) |
Primary citation | Zhao, Y.,Hammoudeh, D.,Yun, M.K.,Qi, J.,White, S.W.,Lee, R.E. Structure-Based Design of Novel Pyrimido[4,5-c]pyridazine Derivatives as Dihydropteroate Synthase Inhibitors with Increased Affinity. Chemmedchem, 7:861-870, 2012 Cited by PubMed: 22416048DOI: 10.1002/cmdc.201200049 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.501 Å) |
Structure validation
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