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Structure paper

TitlePKA based studies of ligand interactions with a methionine gatekeeper.
Journal, issue, pagesTo Be Published
Publish dateJun 8, 2015 (structure data deposition date)
AuthorsNarayanan, D. / Gani, O.A. / Alam, K.A. / Engh, R.A.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.89 Å
Structure data

PDB-5bx6:
PKA in complex with a halogenated phthalazinone fragment compound.
Method: X-RAY DIFFRACTION / Resolution: 1.89 Å

PDB-5bx7:
PKA in complex with a benzothiophene fragment compound.
Method: X-RAY DIFFRACTION / Resolution: 1.89 Å

Chemicals

ChemComp-495:
4-chlorophthalazin-1(2H)-one

ChemComp-MPD:
(4S)-2-METHYL-2,4-PENTANEDIOL / precipitant*YM

ChemComp-HOH:
WATER

ChemComp-4W1:
1-benzothiophen-3-ylmethanol

ChemComp-EDO:
1,2-ETHANEDIOL

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Inhibitor / protein kinase / structure-guided / fragment-based

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