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Structure paper

TitleStructure-Based Design of Selective Fat Mass and Obesity Associated Protein (FTO) Inhibitors.
Journal, issue, pagesJ. Med. Chem., Vol. 64, Page 16609-16625, Year 2021
Publish dateMay 28, 2014 (structure data deposition date)
AuthorsShishodia, S. / Demetriades, M. / Zhang, D. / Tam, N.Y. / Maheswaran, P. / Clunie-O'Connor, C. / Tumber, A. / Leung, I.K.H. / Ng, Y.M. / Leissing, T.M. ...Shishodia, S. / Demetriades, M. / Zhang, D. / Tam, N.Y. / Maheswaran, P. / Clunie-O'Connor, C. / Tumber, A. / Leung, I.K.H. / Ng, Y.M. / Leissing, T.M. / El-Sagheer, A.H. / Salah, E. / Brown, T. / Aik, W.S. / McDonough, M.A. / Schofield, C.J.
External linksJ. Med. Chem. / PubMed:34762429
MethodsX-ray diffraction
Resolution1.25 - 2.55 Å
Structure data

PDB-4qho:
Crystal structure of the human fat mass and obesity associated protein (FTO) in complex with CCO10
Method: X-RAY DIFFRACTION / Resolution: 2.37 Å

PDB-7e8z:
Crystal structure of the human fat mass and obesity associated protein (FTO) in complex with SS81
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

PDB-7nro:
Crystal structure of AlkB in complex with manganese and N-(4-((6-((carboxymethyl)carbamoyl)-5-hydroxypyridin-2-yl)amino)phenyl)-N-oxohydroxylammonium
Method: X-RAY DIFFRACTION / Resolution: 1.25 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-NKG:
N-{[3-hydroxy-6-(naphthalen-1-yl)pyridin-2-yl]carbonyl}glycine

ChemComp-HOH:
WATER

ChemComp-HZX:
2-[[6-[(4-nitrophenyl)amino]-3-oxidanyl-pyridin-2-yl]carbonylamino]ethanoic acid

ChemComp-UPW:
2-[[6-[(4-nitrophenyl)amino]-3-oxidanyl-pyridin-2-yl]carbonylamino]ethanoic acid

ChemComp-MN:
Unknown entry

Source
  • homo sapiens (human)
  • escherichia coli k-12 (bacteria)
KeywordsOXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / jelly-roll motif / oxidoreductase / dioxygenase / double-stranded beta helix fold / nucleic acid demethylase / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex / Double-stranded beta helix / 2OG and Fe(II)-dependent oxygenase / RNA demethylase / Alpha ketoglutarate and iron dependent oxygenase / DNA Demethylase / inhibitor complex

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