{"id":"W2057041280","doi":"10.1016/j.jmb.2013.02.022","title":"Discovery and Structural Characterization of a New Inhibitor Series of HIV-1 Nucleocapsid Function: NMR Solution Structure Determination of a Ternary Complex Involving a 2:1 Inhibitor/NC Stoichiometry","year":2013,"lang":"en","type":"article","venue":"Journal of Molecular Biology","topic":"HIV Research and Treatment","field":"Immunology and Microbiology","cited_by":41,"is_retracted":false,"has_abstract":false,"ca_institutions":"Boehringer Ingelheim (Canada)","funders":"","keywords":"Chemistry; Oligonucleotide; Capsid; Small molecule; Nucleic acid; Ternary complex; Stereochemistry; Binding site; Biochemistry; DNA; Enzyme","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0006465378,0.0004349847,0.0006248081,0.0003233304,0.0005705043,0.0009825502,0.001008255,0.000408806,0.0009136944],"category_scores_gemma":[0.001090458,0.0003990189,0.0002020518,0.000269775,0.0005092346,0.0005524307,0.0002463986,0.0009198442,0.000242273],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001610479,"about_ca_system_score_gemma":0.001161339,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004393957,"about_ca_topic_score_gemma":0.005001639,"domain_scores_codex":[0.9996574,0.00004814523,0.0000361002,0.00008141918,0.0001262184,0.00005069902],"domain_scores_gemma":[0.999692,0.00006942039,0.00004751256,0.00003206103,0.00009043994,0.00006858479],"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":[0.0001897257,0.00008569592,0.000358282,0.00004557678,0.00001738609,0.00004505744,0.00003991864,0.001006699,0.9951089,0.000495603,0.000209557,0.002397603],"study_design_scores_gemma":[0.00001910469,0.00008300685,0.0004021265,0.000002663783,0.00002419501,0.00007875556,0.00001315257,0.005035566,0.9923589,0.00004468617,0.001926596,0.00001137367],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9740238,0.002365449,0.01832098,0.000410799,0.00009073011,0.000166615,0.0005778319,0.0002898868,0.003754043],"genre_scores_gemma":[0.9826946,0.0007055724,0.01419758,0.0001373578,0.00001584223,0.00006397747,0.0006762425,0.00007255213,0.00143636],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004393957,"threshold_uncertainty_score":0.01168483,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.009831857888360104,"score_gpt":0.2416244368641452,"score_spread":0.2317925789757851,"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."}}