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TitleIdentification of inhibitors targeting substrate-binding site in Mycobacterium tuberculosis FAD-dependent Thymidylate synthase (ThyX) through Virtual Screening: A New study de-fining the binding mechanism of Inhibitors
Journal, issue, pagesTo Be Published
Publish dateJul 10, 2015 (structure data deposition date)
AuthorsSurade, S.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.7 Å
Structure data

PDB-5chp:
T. maritima ThyX in complex with TyC5-03
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

Chemicals

ChemComp-FAD:
FLAVIN-ADENINE DINUCLEOTIDE / FAD*YM

ChemComp-51Q:
(2S)-2-[(3-hydroxy-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)sulfanyl]propanoic acid

ChemComp-HOH:
WATER

Source
  • thermotoga maritima (bacteria)
KeywordsHYDROLASE / ThyX in complex with inhibitor

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