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TitlePolymyxins and quinazolines are LSD1/KDM1A inhibitors with unusual structural features.
Journal, issue, pagesSci Adv, Vol. 2, Page e1601017-e1601017, Year 2016
Publish dateApr 10, 2016 (structure data deposition date)
AuthorsSperanzini, V. / Rotili, D. / Ciossani, G. / Pilotto, S. / Marrocco, B. / Forgione, M. / Lucidi, A. / Forneris, F. / Mehdipour, P. / Velankar, S. ...Speranzini, V. / Rotili, D. / Ciossani, G. / Pilotto, S. / Marrocco, B. / Forgione, M. / Lucidi, A. / Forneris, F. / Mehdipour, P. / Velankar, S. / Mai, A. / Mattevi, A.
External linksSci Adv / PubMed:27626075
MethodsX-ray diffraction
Resolution2.8 - 3.5 Å
Structure data

PDB-5l3e:
LSD1-CoREST1 in complex with quinazoline-derivative reversible inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-5l3f:
LSD1-CoREST1 in complex with polymyxin B
Method: X-RAY DIFFRACTION / Resolution: 3.5 Å

PDB-5l3g:
LSD1-CoREST1 in complex with polymyxin E (colistin)
Method: X-RAY DIFFRACTION / Resolution: 3.1 Å

PDB-5lbq:
LSD1-CoREST1 in complex with quinazoline-derivative reversible inhibitor
Method: X-RAY DIFFRACTION / Resolution: 3.3 Å

Chemicals

ChemComp-FAD:
FLAVIN-ADENINE DINUCLEOTIDE / FAD*YM

ChemComp-E11:
N~4~-(1-benzylpiperidin-4-yl)-N~2~-[3-(dimethylamino)propyl]-6,7-dimethoxyquinazoline-2,4-diamine

ChemComp-NA:
Unknown entry

ChemComp-767:
N2-(3-(dimethylamino)propyl)-6,7-dimethoxy-N4,N4-dimethylquinazoline-2,4-diamine

Source
  • homo sapiens (human)
  • paenibacillus polymyxa (bacteria)
KeywordsOXIDOREDUCTASE/REPRESSOR / OXIDOREDUCTASE-REPRESSOR complex / LSD1 / KDM1A / CoREST1 / chromatin / epigenetic / OXIDOREDUCTASE

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