{"id":"W2005967422","doi":"10.1021/bi401349d","title":"Crystal and Solution Structure Analysis of FhuD2 from <i>Staphylococcus aureus</i> in Multiple Unliganded Conformations and Bound to Ferrioxamine-B","year":2014,"lang":"en","type":"article","venue":"Biochemistry","topic":"Bacterial Genetics and Biotechnology","field":"Biochemistry, Genetics and Molecular Biology","cited_by":41,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"Natural Sciences and Engineering Research Council of Canada; Canadian Institutes of Health Research; National Institutes of Health; U.S. Department of Energy","keywords":"Siderophore; Chemistry; Small-angle X-ray scattering; Ligand (biochemistry); Crystallography; Stereochemistry; Crystal structure; Hydrogen bond; Bacillus cereus; Receptor; Molecule; Biochemistry; Biology; Bacteria; Scattering; Organic chemistry","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":[0.00006334524,0.0001331912,0.0002091041,0.00008537903,0.00004060336,0.00002213668,0.0001029819,0.0003153147,0.000009219911],"category_scores_gemma":[0.0000889193,0.0001318712,0.00003926118,0.0001892375,0.000118602,0.00000261526,0.0001400051,0.00006692537,1.650208e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00000842081,"about_ca_system_score_gemma":0.00002459987,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001552544,"about_ca_topic_score_gemma":0.0006558075,"domain_scores_codex":[0.9992561,0.000015455,0.0002227541,0.0002898994,0.00006270748,0.0001530753],"domain_scores_gemma":[0.9995154,0.00001322923,0.00008245747,0.0002674399,0.00004674397,0.00007469921],"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":[0.00004603354,0.00001736117,0.009292996,0.00001624785,0.00009889628,1.867011e-7,0.00003827545,0.00001953097,0.9897355,0.000008489242,0.00008554463,0.0006408884],"study_design_scores_gemma":[0.0005035773,0.00007445065,0.04049895,0.000008895276,0.00008504633,9.995972e-7,0.0000573433,0.0007980565,0.9562501,0.00004240575,0.001524914,0.0001552457],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9987307,0.0002416384,0.0003436681,0.0001253684,0.00004216982,0.00009515396,0.0003670718,0.0000065227,0.00004772353],"genre_scores_gemma":[0.9985909,0.00005232165,0.0005499257,0.00009377071,0.00007481818,0.000005134568,0.0006019665,0.000007242108,0.00002392161],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.03348543,"threshold_uncertainty_score":0.5377552,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.005207518373739099,"score_gpt":0.2069543948440347,"score_spread":0.2017468764702957,"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."}}