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TitleCrystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment D02
Journal, issue, pagesTo be published
Publish dateFeb 3, 2023 (structure data deposition date)
AuthorsMalecki, P.H. / Gawel, M. / Stepniewska, M. / Brzezinski, K.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution2.07 Å
Structure data

PDB-8cfb:
Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment D02
Method: X-RAY DIFFRACTION / Resolution: 2.07 Å

Chemicals

ChemComp-NAD:
NICOTINAMIDE-ADENINE-DINUCLEOTIDE / NAD*YM

ChemComp-ADE:
ADENINE

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-K:
Unknown entry

ChemComp-PO4:
PHOSPHATE ION

ChemComp-SY4:
~{N}-[5-azanyl-2,4-bis(fluoranyl)phenyl]propane-1-sulfonamide

ChemComp-HOH:
WATER

Source
  • pseudomonas aeruginosa pao1 (bacteria)
KeywordsHYDROLASE / Fragment screening / protein-ligand complex / drug discovery / SAM-DEPENDENT METHYLATION REACTIONS / SAHase / AHCY

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