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TitleExpansion of a series of pyrimidine derivatives utilising fragment-based merging showcasing anleads to increased affinity with to Mycobacterium tuberculosis dihydrofolate reductase
Journal, issue, pagesTo Be Published
Publish dateFeb 28, 2023 (structure data deposition date)
AuthorsKirkmna, T.J. / Dias, M.V.B. / Coyne, A.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.8 Å
Structure data

PDB-8cop:
Mycobacterium tuberculosis dihydrofolate reductase in complex with N-(4-(2,6-diamino-5-(cyclopropylethynyl)pyrimidin-4-yl)phenyl)methanesulfonamide
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-NDP:
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-PO4:
PHOSPHATE ION


ChemComp, No image

ChemComp-VCI:
Unknown entry

ChemComp-CO:
Unknown entry

ChemComp-HOH:
WATER

Source
  • mycobacterium tuberculosis (bacteria)
KeywordsBIOSYNTHETIC PROTEIN / Mycobacterium tuberculosis Dihydrofolate reductase

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