{"ymdb_id":"YMDB00777","created_at":"2011-05-29T18:52:15.000Z","updated_at":"2016-09-08T18:35:53.000Z","name":"ergosteryl 3-beta-D-glucoside","cas":null,"state":null,"melting_point":null,"description":"Ergosteryl 3-beta-D-glucoside is a 3-glucoside of ergosterol. Ergosterol is the biological precursor to vitamin D2. Ergosterol is a component of yeast and fungal cell membranes and does not occur in plant or animal cells.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":"cytoplasm","synthesis_reference":null,"chebi_id":"52973","hmdb_id":null,"kegg_id":null,"pubchem_id":null,"cs_id":"23107093","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(2R,3R,4S,5S,6R)-2-{[(1S,2R,5S,11R,14R,15R)-14-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-7,9-dien-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol","traditional_iupac":"ergosteryl 3-β-D-glucoside","logp":"4.861571343333335","pka":"13.200090024863655","alogps_solubility":"6.48e-03 g/l","alogps_logp":"5.45","alogps_logs":"-4.94","acceptor_count":"6","donor_count":"4","rotatable_bond_count":"7","polar_surface_area":"99.38000000000001","refractivity":"159.545","polarizability":"67.10699112713189","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-2.9810835428539253","pka_strongest_acidic":"12.210561280661553","bioavailability":"1","number_of_rings":"5","rule_of_five":"0","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"1","synonyms":[],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":18846089,"citation":"Herrgard, M. J., Swainston, N., Dobson, P., Dunn, W. B., Arga, K. Y., Arvas, M., Bluthgen, N., Borger, S., Costenoble, R., Heinemann, M., Hucka, M., Le Novere, N., Li, P., Liebermeister, W., Mo, M. L., Oliveira, A. P., Petranovic, D., Pettifer, S., Simeonidis, E., Smallbone, K., Spasic, I., Weichart, D., Brent, R., Broomhead, D. S., Westerhoff, H. V., Kirdar, B., Penttila, M., Klipp, E., Palsson, B. O., Sauer, U., Oliver, S. G., Mendes, P., Nielsen, J., Kell, D. B. (2008). \"A consensus yeast metabolic network reconstruction obtained from a community approach to systems biology.\" Nat Biotechnol 26:1155-1160."},{"pubmed_id":10224056,"citation":"Warnecke, D., Erdmann, R., Fahl, A., Hube, B., Muller, F., Zank, T., Zahringer, U., Heinz, E. (1999). \"Cloning and functional expression of UGT genes encoding sterol glucosyltransferases from Saccharomyces cerevisiae, Candida albicans, Pichia pastoris, and Dictyostelium discoideum.\" J Biol Chem 274:13048-13059."}],"proteins":[{"created_at":"2011-05-27T04:01:50.000Z","updated_at":"2011-05-27T15:01:22.000Z","name":"Sterol 3-beta-glucosyltransferase","uniprot_id":"Q06321","uniprot_name":"ATG26_YEAST","enzyme":true,"transporter":false,"gene_name":"ATG26","num_residues":1198,"molecular_weight":"136053.0","theoretical_pi":"7.6","general_function":"Involved in transferase activity, transferring hexosyl groups","specific_function":"May be involved in decane metabolism and autophagy. Involved in the biosynthesis of sterol glucoside","reactions":[{"id":2029,"direction":"\u003e","locations":"cytoplasm","altext":null,"export":true,"pw_reaction_id":null,"source":null},{"id":2754,"direction":"\u003e","locations":"Cytoplasm. Membrane; Peripheral membrane protein","altext":"UDP-glucose + a sterol = UDP + a sterol 3-beta-D-glucoside.","export":false,"pw_reaction_id":null,"source":null}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":null,"cellular_location":"Cytoplasm. Membrane; Peripheral membrane protein","genbank_gene_id":"U17246","genbank_protein_id":"577215","gene_card_id":"ATG26","chromosome_location":"chromosome 12","locus":"YLR189C","synonyms":["Autophagy-related protein 26","UDP-glycosyltransferase 51"],"enzyme_classes":["2.4.1.173"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" transferase activity, transferring glycosyl groups"},{"category":"Function","description":" transferase activity, transferring hexosyl groups"},{"category":"Function","description":" catalytic activity"},{"category":"Function","description":" transferase activity"},{"category":"Process","description":" metabolic process"},{"category":"Process","description":" primary metabolic process"},{"category":"Process","description":" carbohydrate metabolic process"},{"category":"Process","description":" lipid metabolic process"},{"category":"Process","description":" cellular lipid metabolic process"},{"category":"Process","description":" lipid modification"},{"category":"Process","description":" lipid glycosylation"}],"pfams":[{"name":"PH","identifier":"PF00169"},{"name":"Glyco_transf_28","identifier":"PF03033"},{"name":"GRAM","identifier":"PF02893"},{"name":"UDPGT","identifier":"PF00201"}],"pathways":[],"gene_sequence":"ATGCCCATCACTCAAATCATATCAGCGTCTGATAGCGAGGCGGGGCCAAAACCAAGCATTTCGTTGGTACCTGATAAGCCATCTGAGCCAGAAACTTCCCCTAGGCATCATCGCCTTTCAAGGTCACTTTCGAAGTTCAAGCGCTGGAGAGGAAGATCAAATAGCAGTTTATCGATGGGGTCGTCTGAGCAGCAAGAACTGCAGGACAGTCCAAATGAAGCCCGTAGTGATGATGACGAAAACGGTTACAATAACGATAATGCAGATGACTTGGCGAAATCCAAGTATATGATGAAAAGTATTGCCGGTTTATTAACTACTGCTAGTGTGTATGCAGGGATGAATAATGCTCAAGAAATGAATGTGTTGTCGCAAGTTGATTCTGAAGAATCTGATTCCAGTGATAGTTTCCAGGAAAACATTGGTCGAAATGAGGTAAAAAGCAAAAAGGAAAATCTCAAAACTAAATCGCATCCGGAAGTACCAAGATTAGACAAAAGAAAGCCAACTTTATTCGACTTCTCAATAACTAGGGAAAAACTGTCAAAAGACAATGTGGCTAAGTTGAGACAGCGGTTTTGTTTAGACGAACAGGAACCATTTTTGAATGATTTCCCTGCATGGCTACTTAAAGATGTGTTGGTTCAAGGCCATATTTTTATTACAACAAAACATTTCCTATTCTTTGCATATTTACCTAAGAATCCTCGGTCGGTTAAAATGTCTGGAAACCTTAATATCAGGACAAAACTAATTAGGTCTACCAGGTATTGGTGCGTACTAAAGAATCATTTATTTTCTATGTATACCTCATCAACTGAGCTATACTTTCCGGTTTTAACCATAGATTTGAGGGAGGTCCAAAAAATTGAAACACAAAAACATACCTTAAACGGGAGTGCTACGAAAACATTTAAGCTTTACACAGATGAAAGTACATTCAAATTCAATGCAGATTCAGAGTTCTCCGCTAAATCGTGGGTGAACGCTTTGAAAAAGGAGCAGTTCGCAGCTCAGAATTCTGAAAACAATTCGATAAGTTTAAAAATTCCGCTGCCCAACATTATAGAGATAGATGATCAACCTATAGTCAACAAAGCTTTAACATTGAGATTAAGAGCTTTGGAGAGCTCACAGACCTATGCTATCGATGATTTCATGTTTGTTTTCATGGATGGGTCCGGTAGTCAGGTCAAAGAGAGCCTTGGCGAACAGTTGGCTATATTGCAGAAATCCGGTGTTAATACACTTTATTATGATATTCCAGCCAAGAAATCAAAATCAAGTTTTGGAAAAGAGACACCAGCTACAGTTGAGCAAAAGAATAACGGCGAGGATTCAAAATATTTGAATGTTCCAACTTCGGCTGTGCCTTCTTCGGAAAATGGGAAAAAGAGTCGATTCAGATTTAGAGAAAGAAGCAATAGTTGGTTTCGTAGAGCTAAACCTCTTGAAGATTCTCAAGTTGAGGATGTGGAGGAAATATATAAAGATGCGGCGAATGATATAGACTCTTCTGTGCATTCCACGATTCATATTCATGAACAAGAAGATAGTCAAGAGCAAACCGTAGCTTGGAAGCCAAGTCACCTCAAAAATTTTGCCGAAATGTGGGCTGCCAAACCAATACACTACCGGAACAAGTTTATCCCGTTTCAAAAGGATGATACCTATTTGATTAAAGAAACAGAAGAGGTTTCTGCTAACGAGCGGTTCAGGTACCATTTCAAGTTTAATAAAGAGAAGTCACTAATCAGTACTTACTACACATACCTGAATAGAAATGTTCCCGTTTATGGTAAGATTTACGTATCCAATGATACGGTGTGCTTCAGATCGTTATTACCAGGGTCTAATACATACATGGTTTTGCCATTGGTTGATGTGGAGACATGCTATAAAGAAAAGGGATTTCGATTTGGTTATTTTGTATTGGTTATAGTAATTCACGGTCACGAGGAGCTATTTTTTGAATTTAGCACTGAGGTCGCCAGGGATGATATTGAACGCATTCTTTTAAAGCTCTTAGATAACATATATGCAAGCAGTGCAGAAGGATCGAATATATCGAGTGCTTCTCTTGGCGATGTTCAGCATAACCCTGACTCAGCGAAGTTGAAGCTTTTCGAAGATAAAATTAATGCCGAGGGCTTTGAGGTACCGTTAATGATTGATGAGAATCCGCACTATAAAACAAGCATAAAACCAAACAAGAGTTATAAGTTTGGATTATTGACGATTGGCTCAAGAGGGGATGTTCAACCATATATTGCACTTGGAAAGGGCTTGATAAAAGAAGGTCACCAAGTGGTAATAATTACACATTCGGAATTTAGAGACTTTGTTGAAAGTCATGGAATCCAGTTTGAAGAGATTGCTGGTAACCCAGTGGAGTTGATGTCCTTGATGGTGGAAAATGAATCAATGAATGTTAAAATGCTGAGAGAAGCTTCGAGCAAATTTAGGGGATGGATCGATGCTCTTTTACAGACATCTTGGGAGGTTTGTAACAGAAGAAAATTTGATATTCTGATTGAATCACCCTCAGCTATGGTTGGTATTCATATTACTGAAGCATTGCAAATTCCTTATTTTCGAGCATTTACCATGCCATGGACAAGAACAAGAGCATATCCACATGCATTTATTGTACCAGATCAAAAAAGGGGCGGTAACTATAACTACCTGACACATGTCCTTTTCGAAAACGTTTTCTGGAAGGGAATTAGTGGGCAAGTAAACAAGTGGAGAGTTGAAACTCTAGGTTTAGGGAAAACAAATCTTTTTCTTTTACAGCAGAATAATGTTCCTTTCTTATACAATGTTTCTCCTACAATTTTTCCGCCATCAATTGATTTTAGCGAGTGGGTGAGAGTTACAGGATATTGGTTTCTTGATGATAAGAGTACTTTCAAACCGCCAGCAGAATTACAAGAATTTATTTCTGAGGCAAGATCAAAAGGAAAAAAATTGGTTTATATCGGGTTTGGTTCGATTGTAGTCTCTAATGCCAAAGAAATGACGGAAGCTCTTGTCGAAGCAGTTATGGAAGCAGATGTATACTGCATTTTAAATAAGGGATGGTCAGAAAGGTTGGGCGATAAGGCGGCAAAGAAGACAGAGGTAGATCTTCCAAGAAACATTTTAAATATCGGAAACGTTCCCCATGATTGGTTGTTCCCACAAGTCGATGCTGCCGTTCACCATGGTGGTTCTGGAACTACTGGAGCTTCATTACGTGCTGGTTTACCTACTGTTATAAAACCTTTCTTTGGTGATCAGTTCTTTTATGCAGGTAGAGTAGAAGACATTGGAGTTGGTATTGCTTTAAAGAAACTTAACGCTCAAACATTAGCAGATGCTTTAAAAGTAGCTACGACGAACAAAATAATGAAGGATAGAGCTGGATTAATAAAGAAGAAAATTTCCAAAGAAGATGGGATTAAAACTGCAATAAGTGCAATTTACAACGAACTTGAGTATGCAAGAAGCGTTACTTTATCAAGAGTGAAAACTCCGCGCAAGAAAGAGGAAAATGTAGATGCAACCAAACTGACACCTGCTGAAACAACGGATGAAGGGTGGACGATGATTTAA","protein_sequence":"MPITQIISASDSEAGPKPSISLVPDKPSEPETSPRHHRLSRSLSKFKRWRGRSNSSLSMGSSEQQELQDSPNEARSDDDENGYNNDNADDLAKSKYMMKSIAGLLTTASVYAGMNNAQEMNVLSQVDSEESDSSDSFQENIGRNEVKSKKENLKTKSHPEVPRLDKRKPTLFDFSITREKLSKDNVAKLRQRFCLDEQEPFLNDFPAWLLKDVLVQGHIFITTKHFLFFAYLPKNPRSVKMSGNLNIRTKLIRSTRYWCVLKNHLFSMYTSSTELYFPVLTIDLREVQKIETQKHTLNGSATKTFKLYTDESTFKFNADSEFSAKSWVNALKKEQFAAQNSENNSISLKIPLPNIIEIDDQPIVNKALTLRLRALESSQTYAIDDFMFVFMDGSGSQVKESLGEQLAILQKSGVNTLYYDIPAKKSKSSFGKETPATVEQKNNGEDSKYLNVPTSAVPSSENGKKSRFRFRERSNSWFRRAKPLEDSQVEDVEEIYKDAANDIDSSVHSTIHIHEQEDSQEQTVAWKPSHLKNFAEMWAAKPIHYRNKFIPFQKDDTYLIKETEEVSANERFRYHFKFNKEKSLISTYYTYLNRNVPVYGKIYVSNDTVCFRSLLPGSNTYMVLPLVDVETCYKEKGFRFGYFVLVIVIHGHEELFFEFSTEVARDDIERILLKLLDNIYASSAEGSNISSASLGDVQHNPDSAKLKLFEDKINAEGFEVPLMIDENPHYKTSIKPNKSYKFGLLTIGSRGDVQPYIALGKGLIKEGHQVVIITHSEFRDFVESHGIQFEEIAGNPVELMSLMVENESMNVKMLREASSKFRGWIDALLQTSWEVCNRRKFDILIESPSAMVGIHITEALQIPYFRAFTMPWTRTRAYPHAFIVPDQKRGGNYNYLTHVLFENVFWKGISGQVNKWRVETLGLGKTNLFLLQQNNVPFLYNVSPTIFPPSIDFSEWVRVTGYWFLDDKSTFKPPAELQEFISEARSKGKKLVYIGFGSIVVSNAKEMTEALVEAVMEADVYCILNKGWSERLGDKAAKKTEVDLPRNILNIGNVPHDWLFPQVDAAVHHGGSGTTGASLRAGLPTVIKPFFGDQFFYAGRVEDIGVGIALKKLNAQTLADALKVATTNKIMKDRAGLIKKKISKEDGIKTAISAIYNELEYARSVTLSRVKTPRKKEENVDATKLTPAETTDEGWTMI"}]}