{"ymdb_id":"YMDB01001","created_at":"2011-06-14T19:35:07.000Z","updated_at":"2016-09-08T18:36:08.000Z","name":"Norleucine","cas":"327-57-1","state":"Solid","melting_point":"298.5 oC","description":"Norleucine (Nle) is an isomer of the alpha-amino acid leucine. It is not found in natural proteins but is used in experimental studies of protein structure and function.","experimental_water_solubility":"12 mg/mL at 25 oC [SEIDELL,A (1941)]","experimental_logp_hydrophobicity":"-1.53 [HANSCH,C ET AL. (1995)]","location":null,"synthesis_reference":"Chibata, Ichiro; Kizumi, Masahiko; Sugiura, Masataka.  Fermentative production of L-norleucine.    Jpn. Kokai Tokkyo Koho  (1977),  4 pp.","chebi_id":"18347","hmdb_id":"HMDB01645","kegg_id":"C01933","pubchem_id":"21236","cs_id":"19964","foodb_id":null,"wikipedia_link":"Norleucine","biocyc_id":null,"iupac":"(2S)-2-aminohexanoic acid","traditional_iupac":"caprine","logp":"-1.4286287541080052","pka":null,"alogps_solubility":"8.92e+01 g/l","alogps_logp":"-1.74","alogps_logs":"-0.17","acceptor_count":"3","donor_count":"2","rotatable_bond_count":"4","polar_surface_area":"63.31999999999999","refractivity":"34.223299999999995","polarizability":"14.457511062054916","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"9.526564602098674","pka_strongest_acidic":"2.7878511623266418","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["(S)-2-amino-Hexanoate","(S)-2-amino-Hexanoic acid","(S)-2-Aminohexanoate","(S)-2-Aminohexanoic acid","(S)-Aminohexanoate","(S)-Aminohexanoic acid","(S)-Norleucine","2-Aminocaproate","2-Aminocaproic acid","2-Aminohexanoate","2-Aminohexanoic acid","alpha-Aminocaproic acid","Caprine","Glycoleucine","Hexanoic acid, 2-amino-, (S)-","L-(+)-Norleucine","L-2-Aminohexanoate","L-2-Aminohexanoic acid","L-Aminohexanoate","L-Aminohexanoic acid","L-Norleucine","L(+)-Norleucine","n-C4H9CH(NH2)COOH","NORLEUCINE","Norleucine, L-"],"pathways":[],"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":15375647,"citation":"Yow, G. Y., Uo, T., Yoshimura, T., Esaki, N. (2004). \"D-amino acid N-acetyltransferase of Saccharomyces cerevisiae: a close homologue of histone acetyltransferase Hpa2p acting exclusively on free D-amino acids.\" Arch Microbiol 182:396-403."}],"proteins":[{"created_at":"2011-05-26T23:37:41.000Z","updated_at":"2011-05-29T14:08:02.000Z","name":"N-acetyltransferase HPA3","uniprot_id":"P39979","uniprot_name":"HPA3_YEAST","enzyme":true,"transporter":false,"gene_name":"HPA3","num_residues":179,"molecular_weight":"20698.5","theoretical_pi":"7.84","general_function":"Involved in N-acetyltransferase activity","specific_function":"N-acetyltransferase whose physiological acetyl acceptor substrate is still unknown. In vitro, histone acetylation is very weak","reactions":[{"id":2617,"direction":"\u003e","locations":"Cytoplasm. Nucleus","altext":"acetyl-CoA + a D-amino acid = CoA + an N-acetyl-D-amino acid","export":false,"pw_reaction_id":null,"source":null}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":null,"cellular_location":"Cytoplasm. Nucleus","genbank_gene_id":"U18795","genbank_protein_id":"603252","gene_card_id":"HPA3","chromosome_location":"chromosome 5","locus":"YEL066W","synonyms":[],"enzyme_classes":["2.3.1.-","2.3.1.36"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" transferase activity, transferring acyl groups"},{"category":"Function","description":" transferase activity, transferring acyl groups other than amino-acyl groups"},{"category":"Function","description":" acyltransferase activity"},{"category":"Function","description":" acetyltransferase activity"},{"category":"Function","description":" N-acetyltransferase activity"},{"category":"Function","description":" catalytic activity"},{"category":"Function","description":" transferase activity"},{"category":"Process","description":" metabolic process"}],"pfams":[{"name":"Acetyltransf_1","identifier":"PF00583"}],"pathways":[],"gene_sequence":"ATGAAAAAGACCCCAGACCCATCTCCACCTTTTGCAAGCACGAAGAACGTAGGCATGTCAAACGAAGAACCGGAAAAAATGGTTAACGATCGAATTGTGGTGAAGGCCATCGAGCCAAAAGATGAGGAAGCCTGGAACAAACTGTGGAAGGAGTATCAGGGTTTCCAAAAAACGGTTATGCCTCCGGAAGTAGCCACCACTACCTTCGCAAGGTTTATAGACCCTACGGTCAAACTATGGGGTGCTCTAGCCTTTGACACCGAGACCGGCGATGCAATTGGCTTTGCACACTACCTGAACCATTTGACGTCGTGGCATGTCGAAGAAGTTGTCTACATGAATGACTTATATGTCACTGAACGCGCAAGAGTCAAAGGCGTAGGTAGAAAGCTCATAGAATTTGTATACAGCCGTGCCGATGAGCTCGGTACGCCTGCAGTGTACTGGGTTACAGACCATTACAATCACCGCGCACAGTTGCTGTACACCAAAGTGGCTTACAAGACAGATAAGGTTCTTTACAAGAGAAACGGATACTGA","protein_sequence":"MKKTPDPSPPFASTKNVGMSNEEPEKMVNDRIVVKAIEPKDEEAWNKLWKEYQGFQKTVMPPEVATTTFARFIDPTVKLWGALAFDTETGDAIGFAHYLNHLTSWHVEEVVYMNDLYVTERARVKGVGRKLIEFVYSRADELGTPAVYWVTDHYNHRAQLLYTKVAYKTDKVLYKRNGY"}]}