{"id":"https://openalex.org/W4417255590","doi":"https://doi.org/10.1021/acs.jcim.5c01871","title":"Multiscale Computational Dissection of CCRL2-Mediated Chemerin Presentation","display_name":"Multiscale Computational Dissection of CCRL2-Mediated Chemerin Presentation","publication_year":2025,"publication_date":"2025-12-11","ids":{"openalex":"https://openalex.org/W4417255590","doi":"https://doi.org/10.1021/acs.jcim.5c01871","pmid":"https://pubmed.ncbi.nlm.nih.gov/41380116"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.5c01871","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jcim.5c01871","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.5c01871?ref=article_openPDF","source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"hybrid","oa_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.5c01871?ref=article_openPDF","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":null,"display_name":"Arianna Migliorini","orcid":null},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Arianna Migliorini","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5095888289","display_name":"Samuele Di Cristofano","orcid":"https://orcid.org/0000-0002-9618-9391"},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Samuele Di Cristofano","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5029483864","display_name":"Klevia Dishnica","orcid":null},"institutions":[{"id":"https://openalex.org/I119439378","display_name":"University of Verona","ror":"https://ror.org/039bp8j42","country_code":"IT","type":"education","lineage":["https://openalex.org/I119439378"]},{"id":"https://openalex.org/I92008406","display_name":"University of Stavanger","ror":"https://ror.org/02qte9q33","country_code":"NO","type":"education","lineage":["https://openalex.org/I92008406"]}],"countries":["IT","NO"],"is_corresponding":false,"raw_author_name":"Klevia Dishnica","raw_affiliation_strings":["Department of Biotechnology, University of Verona, Strada le Grazie 15, Verona 37134, Italy","Department of Chemistry, Bioscience and Environmental Engineering, Faculty of Science and Technology, University of Stavanger, Kristine Bonnevies vei 22, Stavanger 4021, Norway"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Biotechnology, University of Verona, Strada le Grazie 15, Verona 37134, Italy","institution_ids":["https://openalex.org/I119439378"]},{"raw_affiliation_string":"Department of Chemistry, Bioscience and Environmental Engineering, Faculty of Science and Technology, University of Stavanger, Kristine Bonnevies vei 22, Stavanger 4021, Norway","institution_ids":["https://openalex.org/I92008406"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5003793114","display_name":"Alessandro Marchetto","orcid":"https://orcid.org/0000-0001-9857-4376"},"institutions":[{"id":"https://openalex.org/I171892758","display_name":"Forschungszentrum J\u00fclich","ror":"https://ror.org/02nv7yv05","country_code":"DE","type":"facility","lineage":["https://openalex.org/I1305996414","https://openalex.org/I171892758"]},{"id":"https://openalex.org/I887968799","display_name":"RWTH Aachen University","ror":"https://ror.org/04xfq0f34","country_code":"DE","type":"education","lineage":["https://openalex.org/I887968799"]}],"countries":["DE"],"is_corresponding":false,"raw_author_name":"Alessandro Marchetto","raw_affiliation_strings":["Computational Biomedicine, Forschungszentrum J\u00fclich, Wilhelm-Johnen-Stra\u00dfe, J\u00fclich 52428, Germany","Department of Biology, Faculty of Mathematics, Computer Science and Natural Sciences, RWTH Aachen University, Templergraben 59, Aachen D-52062, Germany"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Computational Biomedicine, Forschungszentrum J\u00fclich, Wilhelm-Johnen-Stra\u00dfe, J\u00fclich 52428, Germany","institution_ids":["https://openalex.org/I171892758"]},{"raw_affiliation_string":"Department of Biology, Faculty of Mathematics, Computer Science and Natural Sciences, RWTH Aachen University, Templergraben 59, Aachen D-52062, Germany","institution_ids":["https://openalex.org/I887968799"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5031575323","display_name":"Rui Pedro Ribeiro","orcid":"https://orcid.org/0000-0001-9939-2013"},"institutions":[{"id":"https://openalex.org/I119439378","display_name":"University of Verona","ror":"https://ror.org/039bp8j42","country_code":"IT","type":"education","lineage":["https://openalex.org/I119439378"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Rui Pedro Ribeiro","raw_affiliation_strings":["Department of Biotechnology, University of Verona, Strada le Grazie 15, Verona 37134, Italy"],"raw_orcid":"https://orcid.org/0000-0001-9939-2013","affiliations":[{"raw_affiliation_string":"Department of Biotechnology, University of Verona, Strada le Grazie 15, Verona 37134, Italy","institution_ids":["https://openalex.org/I119439378"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5080087223","display_name":"Mattia Laffranchi","orcid":"https://orcid.org/0000-0002-0556-6068"},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Mattia Laffranchi","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5120777249","display_name":"Elena Cerioni","orcid":"https://orcid.org/0009-0001-1461-8536"},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Elena Cerioni","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":"https://orcid.org/0009-0001-1461-8536","affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5120777250","display_name":"Francesco Quilli","orcid":"https://orcid.org/0009-0003-9635-1808"},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Francesco Quilli","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":"https://orcid.org/0009-0003-9635-1808","affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5120777251","display_name":"Eleonora Bonanni","orcid":null},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Eleonora Bonanni","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101510898","display_name":"Alejandro Giorgetti","orcid":"https://orcid.org/0000-0001-8738-6150"},"institutions":[{"id":"https://openalex.org/I119439378","display_name":"University of Verona","ror":"https://ror.org/039bp8j42","country_code":"IT","type":"education","lineage":["https://openalex.org/I119439378"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Alejandro Giorgetti","raw_affiliation_strings":["Department of Biotechnology, University of Verona, Strada le Grazie 15, Verona 37134, Italy"],"raw_orcid":"https://orcid.org/0000-0001-8738-6150","affiliations":[{"raw_affiliation_string":"Department of Biotechnology, University of Verona, Strada le Grazie 15, Verona 37134, Italy","institution_ids":["https://openalex.org/I119439378"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5026564872","display_name":"Giulia Rossetti","orcid":"https://orcid.org/0000-0002-2032-4630"},"institutions":[{"id":"https://openalex.org/I171892758","display_name":"Forschungszentrum J\u00fclich","ror":"https://ror.org/02nv7yv05","country_code":"DE","type":"facility","lineage":["https://openalex.org/I1305996414","https://openalex.org/I171892758"]},{"id":"https://openalex.org/I4210120689","display_name":"Universit\u00e4tsklinikum Aachen","ror":"https://ror.org/02gm5zw39","country_code":"DE","type":"healthcare","lineage":["https://openalex.org/I4210120689"]},{"id":"https://openalex.org/I887968799","display_name":"RWTH Aachen University","ror":"https://ror.org/04xfq0f34","country_code":"DE","type":"education","lineage":["https://openalex.org/I887968799"]}],"countries":["DE"],"is_corresponding":false,"raw_author_name":"Giulia Rossetti","raw_affiliation_strings":["Computational Biomedicine, Forschungszentrum J\u00fclich, Wilhelm-Johnen-Stra\u00dfe, J\u00fclich 52428, Germany","Department of Neurology, University Hospital Aachen, RWTH Aachen University, Pauwelsstra\u00dfe 30, Aachen 52074, Germany","J\u00fclich Supercomputing Center, Forschungszentrum J\u00fclich, Wilhelm-Johnen-Stra\u00dfe, J\u00fclich 52428, Germany"],"raw_orcid":"https://orcid.org/0000-0002-2032-4630","affiliations":[{"raw_affiliation_string":"Computational Biomedicine, Forschungszentrum J\u00fclich, Wilhelm-Johnen-Stra\u00dfe, J\u00fclich 52428, Germany","institution_ids":["https://openalex.org/I171892758"]},{"raw_affiliation_string":"Department of Neurology, University Hospital Aachen, RWTH Aachen University, Pauwelsstra\u00dfe 30, Aachen 52074, Germany","institution_ids":["https://openalex.org/I887968799","https://openalex.org/I4210120689"]},{"raw_affiliation_string":"J\u00fclich Supercomputing Center, Forschungszentrum J\u00fclich, Wilhelm-Johnen-Stra\u00dfe, J\u00fclich 52428, Germany","institution_ids":["https://openalex.org/I171892758"]}]},{"author_position":"middle","author":{"id":null,"display_name":"Silvano Sozzani","orcid":null},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Silvano Sozzani","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5088294950","display_name":"Tiziana Borsello","orcid":"https://orcid.org/0000-0002-9729-7642"},"institutions":[{"id":"https://openalex.org/I189158943","display_name":"University of Milan","ror":"https://ror.org/00wjc7c48","country_code":"IT","type":"education","lineage":["https://openalex.org/I189158943"]},{"id":"https://openalex.org/I19630809","display_name":"Mario Negri Institute for Pharmacological Research","ror":"https://ror.org/05aspc753","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I19630809","https://openalex.org/I4210110338","https://openalex.org/I4210153126"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Tiziana Borsello","raw_affiliation_strings":["Department of Neuroscience, Mario Negri Institute of Pharmacological Research IRCCS, Via Mario Negri 2, Milan 20156, Italy","Department of Pharmacological and Biomolecular Sciences, University of Milan, Via Balzaretti 9, Milan 20133, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Neuroscience, Mario Negri Institute of Pharmacological Research IRCCS, Via Mario Negri 2, Milan 20156, Italy","institution_ids":["https://openalex.org/I19630809"]},{"raw_affiliation_string":"Department of Pharmacological and Biomolecular Sciences, University of Milan, Via Balzaretti 9, Milan 20133, Italy","institution_ids":["https://openalex.org/I189158943"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5070623531","display_name":"Domenico Raimondo","orcid":"https://orcid.org/0000-0002-1780-7295"},"institutions":[{"id":"https://openalex.org/I4210153523","display_name":"Istituto Pasteur","ror":"https://ror.org/051v7w268","country_code":"IT","type":"nonprofit","lineage":["https://openalex.org/I4210153523"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Domenico Raimondo","raw_affiliation_strings":["Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy"],"raw_orcid":"https://orcid.org/0000-0002-1780-7295","affiliations":[{"raw_affiliation_string":"Department of Molecular Medicine, Laboratory Affiliated to Istituto Pasteur Italia - Fondazione Cenci Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy","institution_ids":["https://openalex.org/I4210153523"]}]}],"institutions":[],"countries_distinct_count":3,"institutions_distinct_count":14,"corresponding_author_ids":["https://openalex.org/A5070623531"],"corresponding_institution_ids":["https://openalex.org/I4210153523"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":true,"cited_by_count":0,"citation_normalized_percentile":{"value":0.49668741,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"65","issue":"24","first_page":"13400","last_page":"13419"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11532","display_name":"Chemokine receptors and signaling","score":0.6863999962806702,"subfield":{"id":"https://openalex.org/subfields/2730","display_name":"Oncology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},"topics":[{"id":"https://openalex.org/T11532","display_name":"Chemokine receptors and signaling","score":0.6863999962806702,"subfield":{"id":"https://openalex.org/subfields/2730","display_name":"Oncology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},{"id":"https://openalex.org/T10528","display_name":"Adipokines, Inflammation, and Metabolic Diseases","score":0.04309999942779541,"subfield":{"id":"https://openalex.org/subfields/2713","display_name":"Epidemiology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},{"id":"https://openalex.org/T11020","display_name":"Immune Cell Function and Interaction","score":0.0284000001847744,"subfield":{"id":"https://openalex.org/subfields/2403","display_name":"Immunology"},"field":{"id":"https://openalex.org/fields/24","display_name":"Immunology and Microbiology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/chemerin","display_name":"Chemerin","score":0.8374000191688538},{"id":"https://openalex.org/keywords/g-protein-coupled-receptor","display_name":"G protein-coupled receptor","score":0.5727999806404114},{"id":"https://openalex.org/keywords/presentation","display_name":"Presentation (obstetrics)","score":0.4729999899864197},{"id":"https://openalex.org/keywords/receptor","display_name":"Receptor","score":0.3808000087738037},{"id":"https://openalex.org/keywords/missense-mutation","display_name":"Missense mutation","score":0.35510000586509705},{"id":"https://openalex.org/keywords/process","display_name":"Process (computing)","score":0.2883000075817108}],"concepts":[{"id":"https://openalex.org/C199901988","wikidata":"https://www.wikidata.org/wiki/Q18031045","display_name":"Chemerin","level":5,"score":0.8374000191688538},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.5877000093460083},{"id":"https://openalex.org/C135285700","wikidata":"https://www.wikidata.org/wiki/Q38173","display_name":"G protein-coupled receptor","level":3,"score":0.5727999806404114},{"id":"https://openalex.org/C2777601897","wikidata":"https://www.wikidata.org/wiki/Q3409113","display_name":"Presentation (obstetrics)","level":2,"score":0.4729999899864197},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.47279998660087585},{"id":"https://openalex.org/C60644358","wikidata":"https://www.wikidata.org/wiki/Q128570","display_name":"Bioinformatics","level":1,"score":0.4250999987125397},{"id":"https://openalex.org/C169760540","wikidata":"https://www.wikidata.org/wiki/Q207011","display_name":"Neuroscience","level":1,"score":0.424699991941452},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.38119998574256897},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.3808000087738037},{"id":"https://openalex.org/C75563809","wikidata":"https://www.wikidata.org/wiki/Q2656896","display_name":"Missense mutation","level":4,"score":0.35510000586509705},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.33480000495910645},{"id":"https://openalex.org/C54355233","wikidata":"https://www.wikidata.org/wiki/Q7162","display_name":"Genetics","level":1,"score":0.29580000042915344},{"id":"https://openalex.org/C98045186","wikidata":"https://www.wikidata.org/wiki/Q205663","display_name":"Process (computing)","level":2,"score":0.2883000075817108},{"id":"https://openalex.org/C113843644","wikidata":"https://www.wikidata.org/wiki/Q901882","display_name":"Interface (matter)","level":4,"score":0.26649999618530273},{"id":"https://openalex.org/C174510640","wikidata":"https://www.wikidata.org/wiki/Q489618","display_name":"HEK 293 cells","level":3,"score":0.26409998536109924},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.259799987077713},{"id":"https://openalex.org/C28406088","wikidata":"https://www.wikidata.org/wiki/Q5571762","display_name":"Extracellular","level":2,"score":0.25600001215934753},{"id":"https://openalex.org/C79879829","wikidata":"https://www.wikidata.org/wiki/Q5571762","display_name":"Intracellular","level":2,"score":0.25589999556541443}],"mesh":[{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011487","descriptor_name":"Protein Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011487","descriptor_name":"Protein Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011487","descriptor_name":"Protein Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D018925","descriptor_name":"Chemokines","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D018925","descriptor_name":"Chemokines","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D018925","descriptor_name":"Chemokines","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D018925","descriptor_name":"Chemokines","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D018925","descriptor_name":"Chemokines","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D018925","descriptor_name":"Chemokines","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D036341","descriptor_name":"Intercellular Signaling Peptides and Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D036341","descriptor_name":"Intercellular Signaling Peptides and Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D036341","descriptor_name":"Intercellular Signaling Peptides and Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D036341","descriptor_name":"Intercellular Signaling Peptides and Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D036341","descriptor_name":"Intercellular Signaling Peptides and Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D036341","descriptor_name":"Intercellular Signaling Peptides and Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D054388","descriptor_name":"Receptors, CCR","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D054388","descriptor_name":"Receptors, CCR","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D054388","descriptor_name":"Receptors, CCR","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D054388","descriptor_name":"Receptors, CCR","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D054388","descriptor_name":"Receptors, CCR","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D054388","descriptor_name":"Receptors, CCR","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D056004","descriptor_name":"Molecular Dynamics Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D056004","descriptor_name":"Molecular Dynamics Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D056004","descriptor_name":"Molecular Dynamics Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true}],"locations_count":5,"locations":[{"id":"doi:10.1021/acs.jcim.5c01871","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jcim.5c01871","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.5c01871?ref=article_openPDF","source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},{"id":"pmid:41380116","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/41380116","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of chemical information and modeling","raw_type":null},{"id":"pmh:oai:air.unimi.it:2434/1225059","is_oa":true,"landing_page_url":"https://hdl.handle.net/2434/1225059","pdf_url":"https://air.unimi.it/bitstream/2434/1225059/4/multiscale-computational-dissection-of-ccrl2-mediated-chemerin-presentation.pdf","source":{"id":"https://openalex.org/S4306400516","display_name":"Archivio Istituzionale della Ricerca (Universita Degli Studi Di Milano)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I189158943","host_organization_name":"University of Milan","host_organization_lineage":["https://openalex.org/I189158943"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"info:eu-repo/semantics/article"},{"id":"pmh:oai:iris.uniroma1.it:11573/1758169","is_oa":true,"landing_page_url":"https://hdl.handle.net/11573/1758169","pdf_url":null,"source":{"id":"https://openalex.org/S4377196107","display_name":"IRIS Research product catalog (Sapienza University of Rome)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"info:eu-repo/semantics/article"},{"id":"pmh:oai:pubmedcentral.nih.gov:12728923","is_oa":true,"landing_page_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC12728923/","pdf_url":null,"source":{"id":"https://openalex.org/S2764455111","display_name":"PubMed Central","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"J Chem Inf Model","raw_type":"Text"}],"best_oa_location":{"id":"doi:10.1021/acs.jcim.5c01871","is_oa":true,"landing_page_url":"https://doi.org/10.1021/acs.jcim.5c01871","pdf_url":"https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.5c01871?ref=article_openPDF","source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[{"id":"https://openalex.org/G1009030464","display_name":null,"funder_award_id":"AIRC IG 2023 - 29244","funder_id":"https://openalex.org/F4320323054","funder_display_name":"Associazione Italiana per la Ricerca sul Cancro"},{"id":"https://openalex.org/G3742904866","display_name":null,"funder_award_id":"20223RYYFC","funder_id":"https://openalex.org/F4320331528","funder_display_name":"Ministero dell'Universit\u00e0 e della Ricerca"},{"id":"https://openalex.org/G4474667827","display_name":null,"funder_award_id":"IG 2023","funder_id":"https://openalex.org/F4320323054","funder_display_name":"Associazione Italiana per la Ricerca sul Cancro"},{"id":"https://openalex.org/G7587422185","display_name":null,"funder_award_id":"RG12419112EC68CB","funder_id":"https://openalex.org/F4320322510","funder_display_name":"Sapienza Universit\u00e0 di Roma"}],"funders":[{"id":"https://openalex.org/F4320315910","display_name":"Consorzio Interuniversitario Biotecnologie","ror":"https://ror.org/03ka4h071"},{"id":"https://openalex.org/F4320322510","display_name":"Sapienza Universit\u00e0 di Roma","ror":"https://ror.org/02be6w209"},{"id":"https://openalex.org/F4320322750","display_name":"Istituto Pasteur-Fondazione Cenci Bolognetti","ror":"https://ror.org/051v7w268"},{"id":"https://openalex.org/F4320323054","display_name":"Associazione Italiana per la Ricerca sul Cancro","ror":"https://ror.org/02g2x7380"},{"id":"https://openalex.org/F4320331528","display_name":"Ministero dell'Universit\u00e0 e della Ricerca","ror":null}],"has_content":{"pdf":true,"grobid_xml":true},"content_urls":{"pdf":"https://content.openalex.org/works/W4417255590.pdf","grobid_xml":"https://content.openalex.org/works/W4417255590.grobid-xml"},"referenced_works_count":92,"referenced_works":["https://openalex.org/W1031578623","https://openalex.org/W1638418641","https://openalex.org/W1724443945","https://openalex.org/W1922705469","https://openalex.org/W1971575413","https://openalex.org/W1976499671","https://openalex.org/W1990771438","https://openalex.org/W1999071481","https://openalex.org/W2010807612","https://openalex.org/W2015466197","https://openalex.org/W2021520922","https://openalex.org/W2023490488","https://openalex.org/W2025816743","https://openalex.org/W2029582401","https://openalex.org/W2029667189","https://openalex.org/W2045761569","https://openalex.org/W2051864856","https://openalex.org/W2057477511","https://openalex.org/W2065283382","https://openalex.org/W2082667898","https://openalex.org/W2100729071","https://openalex.org/W2112878090","https://openalex.org/W2115540209","https://openalex.org/W2118571345","https://openalex.org/W2119695679","https://openalex.org/W2120094482","https://openalex.org/W2128572087","https://openalex.org/W2134762386","https://openalex.org/W2140831051","https://openalex.org/W2142532813","https://openalex.org/W2146950091","https://openalex.org/W2147988069","https://openalex.org/W2154866190","https://openalex.org/W2161151688","https://openalex.org/W2161903740","https://openalex.org/W2168015220","https://openalex.org/W2168269595","https://openalex.org/W2168749685","https://openalex.org/W2327174080","https://openalex.org/W2336600423","https://openalex.org/W2460255279","https://openalex.org/W2528136962","https://openalex.org/W2555870966","https://openalex.org/W2616913126","https://openalex.org/W2731784911","https://openalex.org/W2761058757","https://openalex.org/W2778410020","https://openalex.org/W2783006100","https://openalex.org/W2905232362","https://openalex.org/W2970740744","https://openalex.org/W2972289577","https://openalex.org/W3003257820","https://openalex.org/W3007500173","https://openalex.org/W3029661147","https://openalex.org/W3035076119","https://openalex.org/W3035965352","https://openalex.org/W3038311311","https://openalex.org/W3080287360","https://openalex.org/W3083008290","https://openalex.org/W3112696476","https://openalex.org/W3130637149","https://openalex.org/W3148042916","https://openalex.org/W3158079462","https://openalex.org/W3161211704","https://openalex.org/W3177828909","https://openalex.org/W3199102733","https://openalex.org/W3203735717","https://openalex.org/W3216782976","https://openalex.org/W4205464767","https://openalex.org/W4205853334","https://openalex.org/W4292548469","https://openalex.org/W4298088172","https://openalex.org/W4308450127","https://openalex.org/W4317602506","https://openalex.org/W4323347875","https://openalex.org/W4362548755","https://openalex.org/W4379600147","https://openalex.org/W4381599091","https://openalex.org/W4386861232","https://openalex.org/W4387164156","https://openalex.org/W4388609875","https://openalex.org/W4394629554","https://openalex.org/W4394724069","https://openalex.org/W4398782969","https://openalex.org/W4402253233","https://openalex.org/W4403526085","https://openalex.org/W4403827741","https://openalex.org/W4404641556","https://openalex.org/W4404883046","https://openalex.org/W4405484729","https://openalex.org/W4406027508","https://openalex.org/W4410014300"],"related_works":[],"abstract_inverted_index":{"Chemokine-like":[0],"receptor":[1,14],"CCRL2":[2,96,122],"is":[3],"a":[4,17,42,65,116,156],"nonsignaling":[5],"atypical":[6],"GPCR":[7],"that":[8,47,140],"presents":[9],"chemerin":[10,87,124,161],"to":[11,58,125],"its":[12,170],"cognate":[13],"CMKLR1":[15,91,128],"(ChemerinR1),":[16],"process":[18],"essential":[19],"for":[20,90],"the":[21,30,83,104],"recruitment":[22],"of":[23,33,86,131,159,169],"inflammatory":[24],"cells.":[25],"Despite":[26],"their":[27],"biological":[28],"importance,":[29],"structural":[31,56,157],"determinants":[32],"CCRL2-chemerin":[34,60],"recognition":[35],"remain":[36],"poorly":[37],"defined.":[38],"Here,":[39],"we":[40],"present":[41],"comprehensive":[43],"multiscale":[44],"computational":[45],"study":[46],"integrates":[48],"coarse-grained":[49],"and":[50,77,98,150,163],"all-atom":[51],"molecular":[52],"dynamics":[53],"simulations":[54],"with":[55],"modeling":[57],"investigate":[59],"interaction.":[61],"Our":[62],"results":[63],"reveal":[64],"flexible":[66],"yet":[67],"stable":[68],"binding":[69],"interface":[70,138],"primarily":[71],"mediated":[72],"by":[73],"chemerin's":[74,99],"\u03b21":[75],"strand":[76],"CCRL2's":[78],"extracellular":[79],"loop":[80,100],"2,":[81],"while":[82],"C-terminal":[84],"region":[85],"remains":[88],"accessible":[89],"engagement.":[92],"Electrostatic":[93],"interactions":[94],"between":[95],"N-terminus":[97],"3":[101],"further":[102],"stabilize":[103],"complex":[105,114],"without":[106],"triggering":[107],"intracellular":[108],"signaling.":[109,174],"A":[110],"modeled":[111],"ternary":[112],"CCRL2-chemerin-CMKLR1":[113],"provides":[115],"putative":[117],"mechanistic":[118],"framework":[119],"in":[120,172],"which":[121],"aligns":[123],"promote":[126],"efficient":[127],"activation.":[129],"Mapping":[130],"naturally":[132],"occurring":[133],"missense":[134],"variants":[135],"onto":[136],"this":[137],"suggests":[139],"sequence":[141],"variation":[142],"at":[143],"specific":[144],"residues":[145],"may":[146,164],"influence":[147],"receptor-ligand":[148],"stability":[149],"function.":[151],"Together,":[152],"these":[153],"findings":[154],"suggest":[155],"basis":[158],"CCRL2-mediated":[160],"presentation":[162],"help":[165],"improve":[166],"our":[167],"understanding":[168],"role":[171],"immune":[173]},"counts_by_year":[],"updated_date":"2026-06-15T08:34:33.830935","created_date":"2025-12-11T00:00:00"}
