{"id":"https://openalex.org/W2590591078","doi":"https://doi.org/10.1107/s2059798317016904","title":"Using more than 801 296 small-molecule crystal structures to aid in protein structure refinement and analysis. Addendum","display_name":"Using more than 801 296 small-molecule crystal structures to aid in protein structure refinement and analysis. Addendum","publication_year":2017,"publication_date":"2017-11-30","ids":{"openalex":"https://openalex.org/W2590591078","doi":"https://doi.org/10.1107/s2059798317016904","mag":"2590591078","pmid":"https://pubmed.ncbi.nlm.nih.gov/29199982","pmcid":"https://www.ncbi.nlm.nih.gov/pmc/articles/5713878"},"language":"en","primary_location":{"id":"doi:10.1107/s2059798317016904","doi":"https://doi.org/10.1107/s2059798317016904","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s2059798317016904","pdf_url":"https://journals.iucr.org/d/issues/2017/12/00/rr5154/rr5154.pdf","source":{"id":"https://openalex.org/S4393918103","display_name":"Acta Crystallographica Section D Structural Biology","issn_l":"2059-7983","issn":["2059-7983"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallographica Section D Structural Biology","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"hybrid","oa_url":"https://journals.iucr.org/d/issues/2017/12/00/rr5154/rr5154.pdf","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5006929803","display_name":"Jason C. Cole","orcid":"https://orcid.org/0000-0002-0291-6317","observed_orcids":["https://orcid.org/0000-0002-0291-6317"]},"institutions":[{"id":"https://openalex.org/I4210098980","display_name":"Cambridge Crystallographic Data Centre","ror":"https://ror.org/00zbfm828","country_code":"GB","type":"company","lineage":["https://openalex.org/I4210098980"]}],"countries":["GB"],"is_corresponding":true,"raw_author_name":"Jason C. Cole","raw_affiliation_strings":["Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England","institution_ids":["https://openalex.org/I4210098980"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5030577168","display_name":"Ilenia Giangreco","orcid":"https://orcid.org/0000-0002-3345-0230","observed_orcids":["https://orcid.org/0000-0002-3345-0230"]},"institutions":[{"id":"https://openalex.org/I4210098980","display_name":"Cambridge Crystallographic Data Centre","ror":"https://ror.org/00zbfm828","country_code":"GB","type":"company","lineage":["https://openalex.org/I4210098980"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Ilenia Giangreco","raw_affiliation_strings":["Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England"],"raw_orcid":"https://orcid.org/0000-0002-3345-0230","affiliations":[{"raw_affiliation_string":"Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England","institution_ids":["https://openalex.org/I4210098980"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5048067029","display_name":"Colin R. Groom","orcid":"https://orcid.org/0000-0001-8921-9575","observed_orcids":["https://orcid.org/0000-0001-8921-9575"]},"institutions":[{"id":"https://openalex.org/I4210098980","display_name":"Cambridge Crystallographic Data Centre","ror":"https://ror.org/00zbfm828","country_code":"GB","type":"company","lineage":["https://openalex.org/I4210098980"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Colin R. Groom","raw_affiliation_strings":["Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England"],"raw_orcid":"https://orcid.org/0000-0001-8921-9575","affiliations":[{"raw_affiliation_string":"Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England","institution_ids":["https://openalex.org/I4210098980"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5006929803"],"corresponding_institution_ids":["https://openalex.org/I4210098980"],"apc_list":{"value":5230,"currency":"USD","value_usd":5230},"apc_paid":{"value":5230,"currency":"USD","value_usd":5230},"fwci":0.3613,"has_fulltext":true,"cited_by_count":5,"citation_normalized_percentile":{"value":0.6255116,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":87,"max":96},"biblio":{"volume":"73","issue":"12","first_page":"1029","last_page":"1029"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11162","display_name":"Enzyme Structure and Function","score":0.9531000256538391,"subfield":{"id":"https://openalex.org/subfields/1315","display_name":"Structural Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},"topics":[{"id":"https://openalex.org/T11162","display_name":"Enzyme Structure and Function","score":0.9531000256538391,"subfield":{"id":"https://openalex.org/subfields/1315","display_name":"Structural Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10464","display_name":"Crystal structures of chemical compounds","score":0.023000000044703484,"subfield":{"id":"https://openalex.org/subfields/1604","display_name":"Inorganic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10044","display_name":"Protein Structure and Dynamics","score":0.016599999740719795,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/protein-structure-refinement","display_name":"protein structure refinement","score":0.7599999904632568},{"id":"https://openalex.org/keywords/small-molecule-crystal-structures","display_name":"small-molecule crystal structures","score":0.8519999980926514},{"id":"https://openalex.org/keywords/cambridge-structural-database","display_name":"Cambridge Structural Database","score":0.9909999966621399},{"id":"https://openalex.org/keywords/structural-analysis","display_name":"structural analysis","score":0.38100001215934753},{"id":"https://openalex.org/keywords/smart","display_name":"SMART","score":0.8159999847412109}],"concepts":[{"id":"https://openalex.org/C2778945725","wikidata":"https://www.wikidata.org/wiki/Q352858","display_name":"Addendum","level":2,"score":0.9830318689346313},{"id":"https://openalex.org/C115624301","wikidata":"https://www.wikidata.org/wiki/Q895901","display_name":"Crystal structure","level":2,"score":0.5431436896324158},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.4576181471347809},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.3959924578666687},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.3712960481643677},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3379766345024109},{"id":"https://openalex.org/C138885662","wikidata":"https://www.wikidata.org/wiki/Q5891","display_name":"Philosophy","level":0,"score":0.09272482991218567},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.0686836838722229},{"id":"https://openalex.org/C41895202","wikidata":"https://www.wikidata.org/wiki/Q8162","display_name":"Linguistics","level":1,"score":0.06405481696128845}],"mesh":[],"locations_count":4,"locations":[{"id":"doi:10.1107/s2059798317016904","doi":"https://doi.org/10.1107/s2059798317016904","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s2059798317016904","pdf_url":"https://journals.iucr.org/d/issues/2017/12/00/rr5154/rr5154.pdf","source":{"id":"https://openalex.org/S4393918103","display_name":"Acta Crystallographica Section D Structural Biology","issn_l":"2059-7983","issn":["2059-7983"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallographica Section D Structural Biology","raw_type":"journal-article"},{"id":"pmh:oai:europepmc.org:4640018","doi":null,"is_oa":true,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/5713878","pdf_url":null,"source":{"id":"https://openalex.org/S4306400806","display_name":"Europe PMC (PubMed Central)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1303153112","host_organization_name":"European Bioinformatics Institute","host_organization_lineage":["https://openalex.org/I1303153112"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":null,"raw_type":"Text"},{"id":"pmid:29199982","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/29199982","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,"listed_in":[],"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":"Acta crystallographica. Section D, Structural biology","raw_type":"Journal Article"},{"id":"pmh:oai:pubmedcentral.nih.gov:5713878","doi":null,"is_oa":true,"landing_page_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC5713878/","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,"listed_in":[],"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":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallogr D Struct Biol","raw_type":"Text"}],"best_oa_location":{"id":"doi:10.1107/s2059798317016904","doi":"https://doi.org/10.1107/s2059798317016904","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s2059798317016904","pdf_url":"https://journals.iucr.org/d/issues/2017/12/00/rr5154/rr5154.pdf","source":{"id":"https://openalex.org/S4393918103","display_name":"Acta Crystallographica Section D Structural Biology","issn_l":"2059-7983","issn":["2059-7983"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallographica Section D Structural Biology","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":true,"grobid_xml":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2590591078.pdf","grobid_xml":"https://content.openalex.org/works/W2590591078.grobid-xml"},"referenced_works_count":30,"referenced_works":["https://openalex.org/W1533988144","https://openalex.org/W1969360633","https://openalex.org/W1971251199","https://openalex.org/W1979368277","https://openalex.org/W1994921798","https://openalex.org/W1995808589","https://openalex.org/W2017139828","https://openalex.org/W2020907391","https://openalex.org/W2032842297","https://openalex.org/W2034144274","https://openalex.org/W2053015551","https://openalex.org/W2053211314","https://openalex.org/W2056522145","https://openalex.org/W2058379726","https://openalex.org/W2060074735","https://openalex.org/W2078909339","https://openalex.org/W2095744864","https://openalex.org/W2112613829","https://openalex.org/W2116275717","https://openalex.org/W2119489910","https://openalex.org/W2124026197","https://openalex.org/W2124464974","https://openalex.org/W2143660875","https://openalex.org/W2155350640","https://openalex.org/W2156118208","https://openalex.org/W2288190125","https://openalex.org/W2319902168","https://openalex.org/W2323151428","https://openalex.org/W2323630730","https://openalex.org/W4256374980"],"related_works":["https://openalex.org/W4256374980","https://openalex.org/W2797455511","https://openalex.org/W2314194515","https://openalex.org/W7021086517","https://openalex.org/W1527968270","https://openalex.org/W2332408219","https://openalex.org/W7144051411","https://openalex.org/W4396834811","https://openalex.org/W2081887590","https://openalex.org/W2331948761"],"abstract_inverted_index":{"An":[0],"addendum":[1],"to":[2,16,30],"the":[3,18,26],"Introduction":[4],"of":[5,20,28,33],"Cole":[6],"et":[7],"al.":[8],"[(2017),":[9],"Acta":[10],"Cryst.":[11],"D73,":[12],"234-239]":[13],"is":[14],"made":[15],"recognize":[17],"work":[19],"Bricogne,":[21],"Smart":[22],"and":[23],"others":[24],"in":[25,38],"development":[27],"methods":[29],"make":[31],"use":[32],"Cambridge":[34],"Structural":[35],"Database":[36],"data":[37],"protein":[39],"structure":[40],"solution.":[41]},"counts_by_year":[{"year":2026,"cited_by_count":1},{"year":2021,"cited_by_count":1},{"year":2020,"cited_by_count":3}],"updated_date":"2026-11-10T11:39:43.021295","created_date":"2017-03-03T00:00:00"}