{"id":"W2071151402","doi":"10.1210/mend.15.11.0730","title":"Critical Residues for the Specificity of Cofactors and Substrates in Human Estrogenic 17β-Hydroxysteroid Dehydrogenase 1: Variants Designed from the Three-Dimensional Structure of the Enzyme","year":2001,"lang":"en","type":"article","venue":"Molecular Endocrinology","topic":"Estrogen and related hormone effects","field":"Biochemistry, Genetics and Molecular Biology","cited_by":63,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université Laval; Medical Council of Canada","funders":"","keywords":"Cofactor; NAD+ kinase; Biochemistry; Enzyme; Biology; Dehydrogenase; Oxidoreductase; Reductase; Lysine; Amino acid; Cysteine; Stereochemistry; Chemistry","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00009961549,0.0002054113,0.0002478573,0.00002951264,0.0001486104,0.00001222391,0.0003906832,0.0002071825,0.00001354972],"category_scores_gemma":[0.0001587644,0.0001142473,0.0001496552,0.0001067193,0.0006037288,0.000004389482,0.0001680996,0.0002192993,3.363293e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000009343494,"about_ca_system_score_gemma":0.00005790075,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002799463,"about_ca_topic_score_gemma":0.000574508,"domain_scores_codex":[0.9986132,0.0002287667,0.0003282926,0.000342407,0.0001388983,0.0003484747],"domain_scores_gemma":[0.9989895,0.0002589467,0.0001190565,0.000515219,0.0000737398,0.00004351836],"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":[0.0001924212,0.00005469444,0.02186725,0.000009580795,0.0001680416,0.00002568732,0.00003325996,0.0003094607,0.9756481,0.001559051,0.00004000045,0.00009246363],"study_design_scores_gemma":[0.0008332764,0.00026808,0.03940661,0.00001812837,0.0000975285,0.0001115548,0.00003587374,0.0001643426,0.9568417,0.002046455,0.00006012757,0.0001163029],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9913315,0.007137692,0.0004784606,0.0003708917,0.0001023665,0.000481165,0.0000791001,0.00000516356,0.00001372051],"genre_scores_gemma":[0.999511,0.00007359124,0.0001672456,0.0001141305,0.00004832467,0.0000168051,0.00004016683,0.00002201367,0.000006691298],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01880636,"threshold_uncertainty_score":0.4658869,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01031026580177557,"score_gpt":0.2490713694401353,"score_spread":0.2387611036383597,"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."}}