{"ymdb_id":"YMDB00855","created_at":"2011-05-29T18:58:37.000Z","updated_at":"2016-09-08T18:35:59.000Z","name":"N-Acetyl-D-alanine","cas":"97-69-8","state":"Solid","melting_point":null,"description":"N-Acetyl-D-alanine is an N-acetyl aminoacid. It is a detoxified version of D-alanine. D-Amino acids inhibit the growth of S. cerevisiae. D-amino acid-N-acetyltransferase detoxifies D-amino acids by the addition of an acetyl group. [PMID: 16362288]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":"Vanzura, Jiri; Kasafirek, Evzen; Hrabalek, Alexandr; Vinsova, Jarmila; Krepelka, Jiri.  Process for preparing highly pure N-acetyl-L- or -D-alanine. Czech.  (1989),  4 pp. ","chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"132213","cs_id":"116777","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(2R)-2-acetamidopropanoic acid","traditional_iupac":"N-acetylalanine","logp":"-0.7598647116666665","pka":"15.629254426140424","alogps_solubility":"4.36e+01 g/l","alogps_logp":"-0.53","alogps_logs":"-0.48","acceptor_count":"3","donor_count":"2","rotatable_bond_count":"2","polar_surface_area":"66.4","refractivity":"29.941100000000002","polarizability":"12.534688970376688","formal_charge":"0","physiological_charge":"-1","pka_strongest_basic":"-1.4537837099465278","pka_strongest_acidic":"3.8892290118162567","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["(S)-(-)-N-Acetylalanine","(S)-2-(acetylamino)pentanedioic acid","(S)-N-Acetylalanine","2-acetamidopropionic acid","2-Acetylaminopropionic acid","Acetyl-L-alanine","Acetylalanine","acetylglutamic acid","Alanine, N-acetyl-, L-","CH3CONHCH(CH3)COOH","DL-Alanine, N-acetyl-","L-Alanine, N-acetyl-","L-N-Acetylalanine","L-N-acetylglutamic acid","N-Acetyl-(S)-alanine","N-Acetyl-L-alanine","N-Acetyl-L-alpha-alanine","N-Acetyl-L-glutamate","n-acetyl-l-glutamic acid","N-Acetyl-S-alanine","N-Acetylalanine"],"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."},{"pubmed_id":16362288,"citation":"Yow, G. Y., Uo, T., Yoshimura, T., Esaki, N. (2006). \"Physiological role of D-amino acid-N-acetyltransferase of Saccharomyces cerevisiae: detoxification of D-amino acids.\" Arch Microbiol 185:39-46."}],"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"},{"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":"Process","description":" metabolic process"}],"pfams":[{"name":"Acetyltransf_1","identifier":"PF00583"}],"pathways":[],"gene_sequence":"ATGAAAAAGACCCCAGACCCATCTCCACCTTTTGCAAGCACGAAGAACGTAGGCATGTCAAACGAAGAACCGGAAAAAATGGTTAACGATCGAATTGTGGTGAAGGCCATCGAGCCAAAAGATGAGGAAGCCTGGAACAAACTGTGGAAGGAGTATCAGGGTTTCCAAAAAACGGTTATGCCTCCGGAAGTAGCCACCACTACCTTCGCAAGGTTTATAGACCCTACGGTCAAACTATGGGGTGCTCTAGCCTTTGACACCGAGACCGGCGATGCAATTGGCTTTGCACACTACCTGAACCATTTGACGTCGTGGCATGTCGAAGAAGTTGTCTACATGAATGACTTATATGTCACTGAACGCGCAAGAGTCAAAGGCGTAGGTAGAAAGCTCATAGAATTTGTATACAGCCGTGCCGATGAGCTCGGTACGCCTGCAGTGTACTGGGTTACAGACCATTACAATCACCGCGCACAGTTGCTGTACACCAAAGTGGCTTACAAGACAGATAAGGTTCTTTACAAGAGAAACGGATACTGA","protein_sequence":"MKKTPDPSPPFASTKNVGMSNEEPEKMVNDRIVVKAIEPKDEEAWNKLWKEYQGFQKTVMPPEVATTTFARFIDPTVKLWGALAFDTETGDAIGFAHYLNHLTSWHVEEVVYMNDLYVTERARVKGVGRKLIEFVYSRADELGTPAVYWVTDHYNHRAQLLYTKVAYKTDKVLYKRNGY"}]}