{"id":"W2885806560","doi":"10.1016/j.str.2018.07.001","title":"Insights into Heptosyltransferase I Catalysis and Inhibition through the Structure of Its Ternary Complex","year":2018,"lang":"en","type":"article","venue":"Structure","topic":"Escherichia coli research studies","field":"Biochemistry, Genetics and Molecular Biology","cited_by":26,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of British Columbia","funders":"British Columbia Knowledge Development Fund; Canadian Glycomics Network; Canadian Institutes of Health Research; Austrian Science Fund; Canada Foundation for Innovation","keywords":"Ternary complex; Chemistry; Transferase; Acceptor; Stereochemistry; Carboxylate; Crystallography; Protein structure; Residue (chemistry); Crystal structure; Biochemistry; Enzyme","routes":{"ca_aff":true,"ca_fund":true,"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":[0.00002078806,0.0001547795,0.0001514016,0.00002389436,0.0002176436,0.00001793484,0.0001520439,0.0001195706,0.00004995245],"category_scores_gemma":[0.00005616929,0.00009813836,0.00004591509,0.0001474879,0.0004806983,0.000008418621,0.0001710152,0.0001288985,6.716819e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000007923814,"about_ca_system_score_gemma":0.00003639488,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00006729231,"about_ca_topic_score_gemma":0.0008606507,"domain_scores_codex":[0.9991803,0.00007162359,0.0001460938,0.0002726561,0.0001731672,0.0001561958],"domain_scores_gemma":[0.9994225,0.00001237676,0.00005095704,0.0002931259,0.0001812954,0.00003974809],"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":[0.00005878037,0.000006910342,0.0006813268,0.00005407819,0.0001031965,0.000001324064,0.001241633,0.000004574591,0.9964252,0.0002786035,0.0006687837,0.0004755696],"study_design_scores_gemma":[0.0003574457,0.0002687642,0.009677709,0.00001403953,0.00003134695,0.00000885888,0.0003285427,0.00004448227,0.9765988,0.002952062,0.009576905,0.0001410258],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9972166,0.001689934,0.0001553517,0.000369432,0.00005755498,0.0001935835,0.00007912297,0.000006700231,0.0002317584],"genre_scores_gemma":[0.998329,0.0002918388,0.0005507943,0.0002933787,0.0003332656,0.000002678781,0.0001490727,0.00001385214,0.00003607854],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0198264,"threshold_uncertainty_score":0.4001966,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01070884496925051,"score_gpt":0.2745493353090517,"score_spread":0.2638404903398012,"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."}}