{"ymdb_id":"YMDB00811","created_at":"2011-05-29T18:55:03.000Z","updated_at":"2016-09-08T18:35:56.000Z","name":"N-Formylanthranilic acid","cas":"3342-77-6","state":"Solid","melting_point":null,"description":"Formylanthranilic acid is a polar acid metabolite of anthranilic acid. Anthranilic acid is an amino acid with a sweetish taste precursor to the amino acid tryptophan. Anthranilic acid is biosynthesized from chorismic acid, an important biochemical intermediate in plants and microorganisms. [Biocyc TRPSYN-PWY]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":"Prashad, Mahavir; Har, Denis; Repic, Oljan; Blacklock, Thomas J.; Chin, Jefferson A.; Shapiro, Michael J. Reaction of benzoyleneurea and isatoic anhydride with the Vilsmeier reagent. Tetrahedron Letters (1997), 38(8), 1313-1316.","chebi_id":"36575","hmdb_id":"HMDB04089","kegg_id":"C05653","pubchem_id":"101399","cs_id":"91624","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"2-formamidobenzoic acid","traditional_iupac":"formylanthranilic acid","logp":"1.4698403833333331","pka":"15.005557567731586","alogps_solubility":"2.33e+00 g/l","alogps_logp":"0.28","alogps_logs":"-1.85","acceptor_count":"3","donor_count":"2","rotatable_bond_count":"2","polar_surface_area":"66.4","refractivity":"43.6867","polarizability":"15.478287361935156","formal_charge":"0","physiological_charge":"-1","pka_strongest_basic":"-4.538389350624696","pka_strongest_acidic":"3.566281304176154","bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["2-(Formylamino)-benzoate","2-(formylamino)-benzoic acid","2-(formylamino)benzoate","2-(formylamino)benzoic acid","2-formamidobenzoate","2-formamidobenzoic acid","formylanthranilate","N-Formylanthranilate"],"pathways":[{"name":"Tryptophan metabolism","kegg_map_id":"00380"}],"growth_conditions":[],"references":[{"pubmed_id":21062828,"citation":"Scheer, M., Grote, A., Chang, A., Schomburg, I., Munaretto, C., Rother, M., Sohngen, C., Stelzer, M., Thiele, J., Schomburg, D. (2011). \"BRENDA, the enzyme information system in 2011.\" Nucleic Acids Res 39:D670-D676."},{"pubmed_id":92861,"citation":"Bode, R., Birnbaum, D. (1979). \"[Occurrence and distribution of multiple forms of formamidase in various yeasts].\" Z Allg Mikrobiol 19:221-222."}],"proteins":[{"created_at":"2011-05-27T05:24:20.000Z","updated_at":"2011-05-27T15:01:24.000Z","name":"Probable kynurenine formamidase","uniprot_id":"Q04066","uniprot_name":"BNA7_YEAST","enzyme":true,"transporter":false,"gene_name":"BNA7","num_residues":261,"molecular_weight":"29991.0","theoretical_pi":"4.98","general_function":"Involved in hydrolase activity","specific_function":"Catalyzes the hydrolysis of N-formyl-L-kynurenine to L- kynurenine, the second step in the conversion of tryptophan to nicotinic acid, NAD(H) and NADP(H)","reactions":[{"id":2770,"direction":"\u003e","locations":"Cytoplasmic","altext":"N-formyl-L-kynurenine + H(2)O = formate + L-kynurenine.","export":false,"pw_reaction_id":null,"source":null},{"id":4188,"direction":"\u003e","locations":null,"altext":null,"export":true,"pw_reaction_id":"PW_R006488","source":"Smpdb"}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":"1VKH","cellular_location":"Cytoplasmic","genbank_gene_id":"U33007","genbank_protein_id":"927719","gene_card_id":"BNA7","chromosome_location":"chromosome 4","locus":"YDR428C","synonyms":["Biosynthesis of nicotinic acid protein 7","Probable N-formylkynurenine formamidase"],"enzyme_classes":["3.5.1.9"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" catalytic activity"},{"category":"Function","description":" hydrolase activity"},{"category":"Process","description":" metabolic process"}],"pfams":[{"name":"Abhydrolase_3","identifier":"PF07859"}],"pathways":[{"name":"Tryptophan metabolism","kegg_map_id":"00380"},{"name":"Glyoxylate and dicarboxylate metabolism","kegg_map_id":"00630"},{"name":"NAD metabolism","kegg_map_id":null}],"gene_sequence":"ATGTCAAATACCGTAAGAGCCATTTCACCAGATATAACACTATTCAACAAGACATTGACATTCCAAGAAATCTCACAAAACACTAGAGAGGCTGTCATATACATTCATGGAGGTGCATGGAACGATCCTGAGAATACGCCCAATGATTTTAATCAATTAGCCAATACCATCAAATCAATGGATACTGAGTCAACGGTTTGTCAATACTCTATAGAATACAGGTTATCACCAGAGATCACAAATCCAAGAAACTTATATGATGCTGTGTCAAATATAACAAGGCTTGTTAAAGAAAAGGGATTAACGAACATTAATATGGTGGGACATTCCGTTGGAGCTACCTTTATTTGGCAGATATTAGCTGCACTCAAAGATCCTCAAGAAAAAATGAGTGAAGCGCAATTGCAAATGTTGGGACTTTTGCAGATCGTGAAGAGAGTATTTCTATTGGATGGTATATACTCGTTAAAGGAACTGTTGGTAGAATACCCAGAGTATGATTGTTTTACAAGACTTGCCTTCCCTGATGGTATTCAAATGTACGAGGAAGAGCCCTCGAGAGTAATGCCTTACGTGAAGAAAGCCCTTTCTCGCTTCAGTATTGATATGCACCTAGTGCATTCTTATAGCGACGAGTTATTAACGTTAAGACAAACTAATTGTTTAATTTCTTGTCTTCAGGATTATCAGTTAAGTTTCAAGTTGTATTTGGACGATTTGGGTTTGCATAATGATGTTTATAAGAATGGTAAAGTTGCGAAGTATATTTTTGACAATATTTGTTGA","protein_sequence":"MSNTVRAISPDITLFNKTLTFQEISQNTREAVIYIHGGAWNDPENTPNDFNQLANTIKSMDTESTVCQYSIEYRLSPEITNPRNLYDAVSNITRLVKEKGLTNINMVGHSVGATFIWQILAALKDPQEKMSEAQLQMLGLLQIVKRVFLLDGIYSLKELLVEYPEYDCFTRLAFPDGIQMYEEEPSRVMPYVKKALSRFSIDMHLVHSYSDELLTLRQTNCLISCLQDYQLSFKLYLDDLGLHNDVYKNGKVAKYIFDNIC"}]}