{"doi":"10.1039/d4cp01989j","title":"Proton-coupled electron transfer at a mis-metalated zinc site detected with protein charge ladders","abstract":"= -0.09 ± 0.05 per dimer (-0.02 ± 0.01 per copper atom). These values suggest that PCET is taking place at all four Cu atoms of the homodimer. Molecular dynamics and Poisson-Boltzmann calculations suggest that a metal-coordinating histidine at the zinc site (His71) is the proton acceptor. These data show how ligands of a naturally occurring zinc site can help facilitate PCET when the right redox metal is bound.","journal":"Physical Chemistry Chemical Physics","year":2024,"id":481229,"datarank":0.0,"base_score":0.0,"endowment":0.0,"self_citation_contribution":0.0,"citation_network_contribution":0.0,"self_endowment_contribution":0.0,"citer_contribution":0.0,"corpus_percentile":null,"corpus_rank":null,"citation_count":1,"citer_count":0,"citers_with_citation_signal":0,"citers_with_endowment":0,"datacite_reuse_total":0,"is_dataset":false,"is_dataset_confidence":0.9534,"is_data_producer":false,"deposit_databanks":null,"is_oa":true,"file_count":0,"downloads":0,"has_version_chain":false,"published_date":"2024-01-01","fair_score":null,"fair_percentile":null,"algorithm_id":"datarank_citation_only_1hop_v6","ranking_scope":"data_only","authors":[{"id":418254,"name":"Matthew J. Guberman‐Pfeffer","orcid":"0000-0002-1143-0693","position":1,"is_corresponding":false},{"id":769512,"name":"Jordan C. Koone","orcid":"0000-0003-2021-5298","position":2,"is_corresponding":false},{"id":769513,"name":"Chad M. Dashnaw","orcid":"0000-0002-7662-6611","position":3,"is_corresponding":false},{"id":1321321,"name":"Travis J. Lato","orcid":null,"position":4,"is_corresponding":false},{"id":769514,"name":"Bryan F. Shaw","orcid":"0000-0001-8265-5833","position":5,"is_corresponding":false},{"id":1320917,"name":"Mayte Gonzalez","orcid":"0009-0004-6596-4385","position":0,"is_corresponding":true}],"reference_count":62,"raw_metadata":null,"created_at":"2026-07-19T02:07:06.225103Z","pmid":"39193659","pmcid":null,"fwci":null,"citation_percentile":null,"influential_citations":0,"oa_status":null,"license":null,"views":0,"total_file_size_bytes":0,"version_count":0,"fair_f":null,"fair_a":null,"fair_i":null,"fair_r":null,"fair_zscore":null,"fair_rationale":null,"fair_model":null,"fair_agent_version":null,"fair_fulltext_source":null,"fair_has_llm":null,"fair_computed_at":null,"clinical_trials":[],"software_tools":[],"db_accessions":[],"linked_datasets":[],"topics":[]}