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Structure paper

TitleCrystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with fragment F2X-Entry H11
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
Resolution1.6 Å
Structure data

PDB-8cg0:
Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment H11
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

Chemicals

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

ChemComp-ADE:
ADENINE

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

ChemComp-REG:
1-cyclopentyl-3-[[(2~{S})-oxolan-2-yl]methyl]urea

ChemComp-K:
Unknown entry

ChemComp-PO4:
PHOSPHATE ION

ChemComp-GOL:
GLYCEROL

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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