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Structure paper

TitleIdentification of fragments targeting SMYD3 using highly sensitive kinetic and multiplexed biosensor-based screening
Journal, issue, pagesRsc Med Chem, Year 2024
Publish dateDec 20, 2021 (structure data deposition date)
AuthorsFitzGerald, E.A. / Cederfelt, D. / Lund, B.A. / Myers, N. / Zhang, H. / Dobritzsch, D. / Danielson, H.
External linksRsc Med Chem / Search PubMed
MethodsX-ray diffraction
Resolution1.57 - 1.8 Å
Structure data

PDB-7qlb:
SMYD3 in complex with fragment FL06268
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-7qnr:
SMYD3 in complex with fragment FL01791
Method: X-RAY DIFFRACTION / Resolution: 1.57 Å

PDB-7qnu:
SMYD3 in complex with fragment FL08619
Method: X-RAY DIFFRACTION / Resolution: 1.64 Å

PDB-8owo:
SMYD3 in complex with fragment FL01507
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-E4I:
1-methylimidazole-4-sulfonamide

ChemComp-SAM:
S-ADENOSYLMETHIONINE

ChemComp-HOH:
WATER

ChemComp-E45:
3-propan-2-yl-1,2,4-thiadiazol-5-amine

ChemComp-173:
BENZOYL-FORMIC ACID

ChemComp-9W9:
3-oxidanylbenzenecarbonitrile / medication, antiretroviral*YM

ChemComp-GOL:
GLYCEROL

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / methyltransferase / epigenetic / oncogen / histone

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