Database of articles cited by EMDB/PDB/SASBDB data

Keywords
Structure methods	All X-ray diffraction NMR electron microscopy small angle scattering neutron diffraction fiber diffraction powder diffraction infrared spectroscopy EPR fluorescence transfer theoretical model Hybrid
Author
Journal
IF	>30 >20 >10 >5 all

Title	Combined Peptide and Small-Molecule Approach toward Nonacidic THIQ Inhibitors of the KEAP1/NRF2 Interaction.
Journal, issue, pages	Acs Med. Chem. Lett., Vol. 11, Page 740-746, Year 2020
Publish date	Aug 30, 2019 (structure data deposition date)
Authors	Ontoria, J.M. / Biancofiore, I. / Fezzardi, P. / Ferrigno, F. / Torrente, E. / Colarusso, S. / Bianchi, E. / Andreini, M. / Patsilinakos, A. / Kempf, G. ...Ontoria, J.M. / Biancofiore, I. / Fezzardi, P. / Ferrigno, F. / Torrente, E. / Colarusso, S. / Bianchi, E. / Andreini, M. / Patsilinakos, A. / Kempf, G. / Augustin, M. / Steinbacher, S. / Summa, V. / Pacifici, R. / Munoz-Sanjuan, I. / Park, L. / Bresciani, A. / Dominguez, C. / Sherman, L.T. / Harper, S.
External links	Acs Med. Chem. Lett. / PubMed:32435379
Methods	X-ray diffraction
Resolution	2.57 - 2.59 Å
Structure data	PDB-6sp1: KEAP1 IN COMPLEX WITH COMPOUND 6 Method: X-RAY DIFFRACTION / Resolution: 2.57 Å PDB-6sp4: KEAP1 IN COMPLEX WITH COMPOUND 23 Method: X-RAY DIFFRACTION / Resolution: 2.59 Å
Chemicals	ChemComp-LQ8: (1~{S},2~{R})-2-[[(1~{S})-1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5-(2-hydroxyethyloxy)-3,4-dihydro-1~{H}-isoquinolin-2-yl]carbonyl]cyclohexane-1-carboxylic acid ChemComp-ACT: ACETATE ION ChemComp-HOH: WATER ChemComp-LQK: (1~{S},2~{R})-2-[[(1~{S})-1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5-(2-hydroxyethyloxy)-3,4-dihydro-1~{H}-isoquinolin-2-yl]carbonyl]cyclobutane-1-carboxamide
Source	homo sapiens (human)
Keywords	PROTEIN BINDING / NRF2 / KEAP1 / protein-protein interactions / Huntingtons disease / tetrahydroisoquinoline