{"id":"W2044189561","doi":"10.1021/ja1077574","title":"Crystal Structures of Urate Bound Form of Xanthine Oxidoreductase: Substrate Orientation and Structure of the Key Reaction Intermediate","year":2010,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Gout, Hyperuricemia, Uric Acid","field":"Medicine","cited_by":48,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto; University Health Network","funders":"","keywords":"Chemistry; Xanthine; Oxidoreductase; Substrate (aquarium); Xanthine dehydrogenase; Crystal structure; Xanthine oxidase; Enzyme; Stereochemistry; Crystallography; Metal; Biochemistry; Organic 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":[0.0001981023,0.000141159,0.0004672012,0.00002349316,0.00004379318,0.000007398524,0.000242651,0.00009489267,0.00001942978],"category_scores_gemma":[0.0002913859,0.00007369483,0.0003421639,0.0003152444,0.001208108,0.0001097933,0.00008678906,0.0007861049,3.705627e-8],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006414116,"about_ca_system_score_gemma":0.0001576882,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00008707639,"about_ca_topic_score_gemma":0.000005266281,"domain_scores_codex":[0.998596,0.00003376821,0.0006011382,0.0001176128,0.0005060727,0.0001453894],"domain_scores_gemma":[0.997211,0.00008744992,0.002039178,0.0002819067,0.0002955056,0.00008491269],"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":[0.0002455775,0.00004736392,0.01465776,0.00009014335,0.0002115598,6.131837e-7,0.002167022,0.000002802685,0.9816576,0.00001638125,0.000366747,0.0005364162],"study_design_scores_gemma":[0.0007487639,0.0001353399,0.1718696,0.00005854991,0.0003239839,0.0002914404,0.001474825,0.00004281325,0.8241286,0.0008211518,0.00004625204,0.00005859091],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9987671,0.00005739047,0.00001070171,0.0006692148,0.000308644,0.0001263096,0.00004261713,0.00000335928,0.00001470296],"genre_scores_gemma":[0.9979621,0.00005922262,0.001599649,0.0001349129,0.0002161372,3.819928e-7,0.000003990773,0.00001410644,0.000009454862],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.157529,"threshold_uncertainty_score":0.4451324,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.005740569750447378,"score_gpt":0.252720693957365,"score_spread":0.2469801242069176,"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."}}