{"id":"W1991004420","doi":"10.1371/journal.pone.0007113","title":"Structural Basis for Substrate Specificity in Human Monomeric Carbonyl Reductases","year":2009,"lang":"en","type":"article","venue":"PLoS ONE","topic":"Aldose Reductase and Taurine","field":"Biochemistry, Genetics and Molecular Biology","cited_by":57,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Canadian Institutes of Health Research; Karolinska Institutet; Stiftelsen för Strategisk Forskning; Knut och Alice Wallenbergs Stiftelse; GlaxoSmithKline; Ontario Innovation Trust; Deutsche Forschungsgemeinschaft; Ontario Genomics Institute; Ontario Genomics; Genome Canada; Grantová Agentura České Republiky; Wellcome Trust","keywords":"Xenobiotic; Active site; Enzyme; Chemistry; Stereochemistry; Binding site; Reductase; Mutagenesis; Biochemistry; Substrate (aquarium); Docking (animal); Directed evolution; Saturated mutagenesis; Biology; Mutant; Gene","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001857639,0.0003932619,0.0003186523,0.0001080215,0.000129509,0.0003186718,0.000448855,0.0004092554,0.002685464],"category_scores_gemma":[0.0002010469,0.0001070911,0.0003878137,0.0001631598,0.0002195396,0.0001081506,0.0001819581,0.0003464491,0.001318714],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003068135,"about_ca_system_score_gemma":0.0002006312,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005070606,"about_ca_topic_score_gemma":0.0003969402,"domain_scores_codex":[0.9998652,0.00002333188,0.000009124608,0.00004418404,0.00003076221,0.00002737199],"domain_scores_gemma":[0.9998259,0.00003765191,0.00005082613,0.00001516341,0.00003096672,0.00003951901],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.001033742,0.0001192645,0.003072624,0.0001883114,0.00004668159,0.0006137445,0.00006805242,0.001188453,0.9858794,0.0005421958,0.0004857478,0.006761905],"study_design_scores_gemma":[0.0001455676,0.0006920682,0.01948576,0.0000230479,0.00009611811,0.004639643,0.00007560257,0.006455463,0.957403,0.0005111881,0.01044008,0.00003249877],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9870034,0.003609738,0.006382373,0.000255269,0.00004402934,0.00003794264,0.0005318152,0.0002441915,0.001891267],"genre_scores_gemma":[0.9951047,0.0003763193,0.002451767,0.00010198,0.00001191952,0.00001612809,0.001107828,0.00002476363,0.0008045935],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002685464,"threshold_uncertainty_score":0.008983731,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04129732399379113,"score_gpt":0.2547121974183421,"score_spread":0.213414873424551,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}