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dc.contributor.authorKUTZNER, ARNE HOLGER-
dc.date.accessioned2018-03-26T05:12:50Z-
dc.date.available2018-03-26T05:12:50Z-
dc.date.issued2016-04-
dc.identifier.citationMOLECULAR INFORMATICS, v. 35, NO 3-4, Page. 99-108en_US
dc.identifier.issn1868-1743-
dc.identifier.issn1868-1751-
dc.identifier.urihttps://onlinelibrary.wiley.com/doi/abs/10.1002/minf.201500035-
dc.identifier.urihttp://hdl.handle.net/20.500.11754/52337-
dc.description.abstractThe p60 transcription regulator protein (p60TRP) is a basic helix-loop-helix (bHLH) domain-containing neuroprotective protein and a member of the G-protein-coupled receptor (GPCR)-associated sorting protein (GPRASP) family. In the present study, multiple theoretical physico-chemical methods (e. g. Modeller v.9.13, I-TASSER, PROCHECK and ClusPro v2.0 with PIPER) were applied to unveil the three-dimensional (3D) protein structure of the p60TRP homodimer protein and explore potential ligand-protein interactions. Our results suggest a Mg2+-containing 3D p60TRP dimer protein that potentially interacts with 5-(1-aziridinyl)-2,4-dinitrobenzamide (CB1954) and [2-(3-dodecylimidazolidin-1-yl)-1-phosphonoethyl] phosphonic acid (B73). The discovery of CB1954 and B73 may serve as a potential lead for further drug screening tests to normalize the p60TRP signaling pathway in neurodegenerative diseases. Interference with p60TRP signaling via CB1954/B73-related molecules might be a novel option for modifying neurodegenerative signaling pathways (e. g. RIN1, PP2A, RanBP5, CREB and SYNJ1) to treat various brain diseases.en_US
dc.description.sponsorshipThis study was supported by Hanyang University.en_US
dc.language.isoenen_US
dc.publisherWILEY-V C H VERLAG GMBHen_US
dc.subjectBHLHB9en_US
dc.subjectp60TRPen_US
dc.subjectin silicoen_US
dc.subjectinteractionen_US
dc.subjectlead discoveryen_US
dc.subjectbrainen_US
dc.subjectAlzheimer's diseaseen_US
dc.title3D Structure, Dimerization Modeling, and Lead Discovery by Ligand-protein Interaction Analysis of p60 Transcription Regulator Protein (p60TRP)en_US
dc.typeArticleen_US
dc.relation.no3-4-
dc.relation.volume35-
dc.identifier.doi10.1002/minf.201500035-
dc.relation.page99-108-
dc.relation.journalMOLECULAR INFORMATICS-
dc.contributor.googleauthorPramanik, Subrata-
dc.contributor.googleauthorKutzner, Arne-
dc.contributor.googleauthorHeese, Klaus-
dc.relation.code2016000114-
dc.sector.campusS-
dc.sector.daehakCOLLEGE OF ENGINEERING[S]-
dc.sector.departmentDEPARTMENT OF INFORMATION SYSTEMS-
dc.identifier.pidkutzner-
dc.identifier.orcidhttp://orcid.org/0000-0001-5061-6936-
Appears in Collections:
COLLEGE OF ENGINEERING[S](공과대학) > INFORMATION SYSTEMS(정보시스템학과) > Articles
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