{"ymdb_id":"YMDB00671","created_at":"2011-05-29T18:42:11.000Z","updated_at":"2016-09-08T18:35:45.000Z","name":"2,3-bisphospho-D-glyceric acid","cas":"138-81-8","state":"Solid","melting_point":null,"description":"2,3-Bisphospho-D-glyceric acid (2,3-BPG) is an intermediate in the Rapoport-Luebering glycolytic shunt pathway. In this pathway, the glycolytic intermediate 1,3-bisphospho-D-glycerate (1,3-BPG) is converted to 2,3-BPG, itself converted to 3-phospho-D-glycerate (3-PG), which then reenters the main glycolytic pathway. [Biocyc PWY-6405]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":"cytoplasm","synthesis_reference":null,"chebi_id":"37527","hmdb_id":"HMDB01294","kegg_id":"C01159","pubchem_id":"186004","cs_id":"161681","foodb_id":null,"wikipedia_link":null,"biocyc_id":"23-DIPHOSPHOGLYCERATE","iupac":"(2R)-2,3-bis(phosphonooxy)propanoic acid","traditional_iupac":"diphosphoglycerate","logp":"-1.765871547333333","pka":"1.2497332376712151","alogps_solubility":"9.69e+00 g/l","alogps_logp":"-1.55","alogps_logs":"-1.44","acceptor_count":"8","donor_count":"5","rotatable_bond_count":"6","polar_surface_area":"170.82","refractivity":"42.1293","polarizability":"17.962596431968947","formal_charge":"0","physiological_charge":"-5","pka_strongest_basic":null,"pka_strongest_acidic":"0.4809321990127331","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["(2R)-2,3-bis(phosphonooxy)-Propanoate","(2R)-2,3-bis(phosphonooxy)-Propanoic acid","(R)-2,3-bis(phosphonooxy)-Propanoate","(R)-2,3-bis(phosphonooxy)-Propanoic acid","2,3-bis(phosphonooxy)-Propanoate","2,3-bis(phosphonooxy)-Propanoic acid","2,3-bisphospho-d-glycerate","2,3-bisphospho-D-glyceric acid","2,3-Bisphosphoglyceric acid","2,3-Diphospho-D-glycerate","2,3-Diphospho-D-glyceric acid","2,3-Diphospho-D-glyceric acid pentasodium salt","2,3-disphospho-D-glycerate","3-phospho-d-glycerol phosphate","D-Glyceric acid bis","D-Glyceric acid bis(dihydrogen phosphate)","d-greenwald ester","Diphosphoglycerate","Diphosphoglyceric acid","DPG","Glycerate 2,3-diphosphate","Glyceric acid bis(dihydrogen phosphate)","Glyceric acid diphosphate"],"pathways":[{"name":"Glycolysis / Gluconeogenesis","kegg_map_id":"00010"},{"name":"Ethanol fermentation","kegg_map_id":null},{"name":"Glycolysis I","kegg_map_id":null}],"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":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":19889834,"citation":"Boer, V. M., Crutchfield, C. A., Bradley, P. H., Botstein, D., Rabinowitz, J. D. (2010). \"Growth-limiting intracellular metabolites in yeast growing under diverse nutrient limitations.\" Mol Biol Cell 21:198-211."}],"proteins":[{"created_at":"2011-05-27T06:54:32.000Z","updated_at":"2011-07-22T17:54:38.000Z","name":"Phosphoglycerate mutase 1","uniprot_id":"P00950","uniprot_name":"PMG1_YEAST","enzyme":true,"transporter":false,"gene_name":"GPM1","num_residues":247,"molecular_weight":"27608.30078","theoretical_pi":"9.34","general_function":"Involved in catalytic activity","specific_function":"Interconversion of 3- and 2-phosphoglycerate with 2,3- bisphosphoglycerate as the primer of the reaction. Can also Catalyze the reaction of EC 5.4.2.4 (synthase) and EC 3.1.3.13 (phosphatase), but with a reduced activity","reactions":[{"id":1467,"direction":"\u003c\u003e","locations":"cytoplasm","altext":null,"export":true,"pw_reaction_id":null,"source":null},{"id":1868,"direction":"\u003c\u003e","locations":"cytoplasm","altext":null,"export":true,"pw_reaction_id":null,"source":null},{"id":2796,"direction":"\u003e","locations":"Cytoplasm. 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Nucleus;Cytoplasm","altext":"2-phospho-D-glycerate = 3-phospho-D-glycerate.","export":false,"pw_reaction_id":null,"source":null}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":null,"cellular_location":"Cytoplasm. Nucleus","genbank_gene_id":"Z49209","genbank_protein_id":"798903","gene_card_id":"DET1","chromosome_location":"chromosome 4","locus":"YDR051C","synonyms":["Decreased ergosterol transport protein 1","Phosphoglyceromutase DET1"],"enzyme_classes":["5.4.2.1"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" catalytic activity"},{"category":"Process","description":" metabolic process"}],"pfams":[{"name":"PGAM","identifier":"PF00300"}],"pathways":[{"name":"Glycolysis / Gluconeogenesis","kegg_map_id":"00010"},{"name":"Methane metabolism","kegg_map_id":"00680"}],"gene_sequence":"ATGTGTGAAGAGAATGTTCATGTTAGTGAAGATGTTGCTGGCAGTCACGGTTCTTTTACGAATGCCAGACCTAGGTTAATTGTACTAATAAGGCATGGGGAAAGCGAATCAAATAAAAACAAGGAGGTCAATGGTTATATTCCTAACCATCTGATTTCTTTAACGAAAACAGGTCAAATCCAAGCTAGACAAGCTGGTATTGACTTATTACGTGTTTTAAACGTAGACGATCACAACTTGGTGGAGGATTTGGCTAAGAAGTATATTAAAGATGAAAGTAGCAGGAGAACTTTACCGCTGAAGGACTATACCAGGCTGAGTAGAGAAAAAGACACAAACATAGTTTTTTATACATCACCCTATAGAAGAGCAAGGGAAACATTGAAAGGTATTTTGGACGTCATCGATGAATATAATGAATTAAACAGTGGTGTTCGTATATGTGAAGATATGAGATATGATCCACATGGTAAACAGAAACATGCATTTTGGCCGAGAGGACTTAATAATACTGGTGGTGTTTACGAAAATAATGAAGATAATATTTGTGAAGGGAAGCCTGGAAAATGTTATCTGCAATATCGGGTTAAGGATGAGCCAAGAATAAGGGAACAAGATTTTGGTAATTTCCAAAAAATCAATAGCATGCAGGACGTTATGAAGAAGAGATCTACGTATGGTCATTTCTTCTTCAGATTCCCTCATGGAGAAAGTGCGGCAGATGTATATGACAGAGTCGCCAGTTTCCAAGAGACTTTATTCAGGCACTTCCATGATAGGCAAGAGAGAAGACCCAGAGATGTTGTTGTCCTAGTTACACATGGTATTTATTCCAGAGTATTCCTGATGAAATGGTTTAGATGGACATACGAAGAGTTTGAATCGTTTACCAATGTTCCTAACGGGAGCGTAATGGTGATGGAACTGGACGAATCCATCAATAGATACGTCCTGAGGACCGTGCTACCCAAATGGACTGATTGTGAGGGAGACCTAACTACATAG","protein_sequence":"MCEENVHVSEDVAGSHGSFTNARPRLIVLIRHGESESNKNKEVNGYIPNHLISLTKTGQIQARQAGIDLLRVLNVDDHNLVEDLAKKYIKDESSRRTLPLKDYTRLSREKDTNIVFYTSPYRRARETLKGILDVIDEYNELNSGVRICEDMRYDPHGKQKHAFWPRGLNNTGGVYENNEDNICEGKPGKCYLQYRVKDEPRIREQDFGNFQKINSMQDVMKKRSTYGHFFFRFPHGESAADVYDRVASFQETLFRHFHDRQERRPRDVVVLVTHGIYSRVFLMKWFRWTYEEFESFTNVPNGSVMVMELDESINRYVLRTVLPKWTDCEGDLTT"},{"created_at":"2011-05-27T06:56:19.000Z","updated_at":"2011-05-27T06:56:19.000Z","name":"Probable phosphoglycerate mutase YOR283W","uniprot_id":"Q12040","uniprot_name":"YO283_YEAST","enzyme":true,"transporter":false,"gene_name":null,"num_residues":230,"molecular_weight":"26176.5","theoretical_pi":"8.12","general_function":"Involved in catalytic activity","specific_function":"Catalyzes the interconversion of 2-phosphoglycerate and 3-phosphoglycerate","reactions":[{"id":2796,"direction":"\u003e","locations":"Cytoplasm. Nucleus;Cytoplasm","altext":"2-phospho-D-glycerate = 3-phospho-D-glycerate.","export":false,"pw_reaction_id":null,"source":null},{"id":3815,"direction":"\u003c\u003e","locations":null,"altext":null,"export":true,"pw_reaction_id":"PW_R006328","source":"Smpdb"}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":null,"cellular_location":"Cytoplasm. Nucleus","genbank_gene_id":"X89633","genbank_protein_id":"1279707","gene_card_id":null,"chromosome_location":null,"locus":"YOR283W","synonyms":["Phosphoglyceromutase YOR283W"],"enzyme_classes":["5.4.2.1"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" catalytic activity"},{"category":"Process","description":" metabolic process"}],"pfams":[{"name":"PGAM","identifier":"PF00300"}],"pathways":[{"name":"Glycolysis / Gluconeogenesis","kegg_map_id":"00010"},{"name":"Methane metabolism","kegg_map_id":"00680"},{"name":"Glycolysis I","kegg_map_id":null}],"gene_sequence":"ATGACTAAGGAAGTACCATATTATTGCGATAATGACGATAACAACATCATCAGATTATTCATTATTAGGCATGGACAAACAGAACACAATGTAAAAAAAATTTTGCAAGGTCACAAAGATACCTCGATCAATCCTACGGGAGAAGAACAAGCCACTAAATTGGGGCATTACTTGCGTTCAAGAGGTATTCATTTTGATAAGGTTGTCAGTAGTGATTTAAAAAGGTGTAGGCAAACTACGGCTTTAGTTTTGAAACATTCAAAACAAGAAAATGTGCCTACTTCCTATACTTCGGGGTTAAGGGAGCGTTATATGGGTGTTATTGAAGGTATGCAGATTACTGAGGCTGAAAAGTATGCTGATAAACATGGTGAAGGCTCCTTTAGAAATTTTGGGGAAAAAAGTGACGATTTTGTTGCTAGGTTAACTGGATGTGTCGAAGAAGAAGTTGCTGAAGCATCTAATGAAGGTGTCAAGAATCTAGCCCTAGTTAGTCATGGAGGTGCTATCAGAATGATTTTACAATGGTTAAAGTATGAAAATCATCAAGCTCATAAGATCATTGTTTTCAACACCTCTGTCACTATAGTTGATTACGTCAAGGACTCCAAGCAGTTTATTGTGAGACGTGTCGGAAACACCCAACATCTTGGTGATGGCGAATTTGTCGTCAGTGACTTAAGATTACGTTAG","protein_sequence":"MTKEVPYYCDNDDNNIIRLFIIRHGQTEHNVKKILQGHKDTSINPTGEEQATKLGHYLRSRGIHFDKVVSSDLKRCRQTTALVLKHSKQENVPTSYTSGLRERYMGVIEGMQITEAEKYADKHGEGSFRNFGEKSDDFVARLTGCVEEEVAEASNEGVKNLALVSHGGAIRMILQWLKYENHQAHKIIVFNTSVTIVDYVKDSKQFIVRRVGNTQHLGDGEFVVSDLRLR"},{"created_at":"2011-05-27T06:57:59.000Z","updated_at":"2011-05-27T15:01:27.000Z","name":"Phosphoglycerate mutase 3","uniprot_id":"Q12326","uniprot_name":"PMG3_YEAST","enzyme":true,"transporter":false,"gene_name":"GPM3","num_residues":303,"molecular_weight":"34863.19922","theoretical_pi":"6.01","general_function":"Involved in catalytic activity","specific_function":"Could be non-functional","reactions":[{"id":2796,"direction":"\u003e","locations":"Cytoplasm. Nucleus;Cytoplasm","altext":"2-phospho-D-glycerate = 3-phospho-D-glycerate.","export":false,"pw_reaction_id":null,"source":null}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":null,"cellular_location":null,"genbank_gene_id":"X91067","genbank_protein_id":"984186","gene_card_id":"GPM3","chromosome_location":"chromosome 15","locus":"YOL056W","synonyms":["PGAM 3","BPG-dependent PGAM 3","MPGM 3","Phosphoglyceromutase 3"],"enzyme_classes":["5.4.2.1"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" catalytic activity"},{"category":"Function","description":" isomerase activity"},{"category":"Function","description":" intramolecular transferase activity"},{"category":"Function","description":" intramolecular transferase activity, phosphotransferases"},{"category":"Process","description":" metabolic process"},{"category":"Process","description":" small molecule metabolic process"},{"category":"Process","description":" alcohol metabolic process"},{"category":"Process","description":" monosaccharide metabolic process"},{"category":"Process","description":" hexose metabolic process"},{"category":"Process","description":" glucose metabolic process"},{"category":"Process","description":" glucose catabolic process"},{"category":"Process","description":" glycolysis"}],"pfams":[{"name":"PGAM","identifier":"PF00300"}],"pathways":[{"name":"Glycolysis / Gluconeogenesis","kegg_map_id":"00010"},{"name":"Methane metabolism","kegg_map_id":"00680"}],"gene_sequence":"ATGACTGTTACTGACACTTTTAAACTGTTTATTTTAAGGCATGGTCAAAGTGAATTAAACTCAGAAAACATATTCTGCGGATGGATTGATGCTCAATTAACGGAAAAAGGGAAGTCTCAGGCCCGCCACTCTGCAAAATTGATCAAGCAGTTTTGCGATTCTAACAATATCTCTTTGCCTCAGATTGGCTATACTTCAAGGTTGATTCGAACTCAGCAGACCATGGACGTTATTCTCGAAGAGTTGGGACTAAAACACACCAATTATGTAATTACTACGAATACAAACATTAAGGAGGAGCTGCAGGACACAAGATTTGAAGGAAGTATGCCTGTGTTGCAAACCTGGAGGTTAAATGAGCGTCATTACGGCGCATGGCAAGGACAAAGAAAGCCAGATATCTTGAAAGAATACGGTAAGGAAAAATACATGTATATCAGAAGAGATTACAACGGAAAACCCCCTAAAGTCAACCTAAACCTGGAAATGGTCCAAGAGGAAAATGATCAGGGGTCCTCCACAGGCTATGATTTTAAGGAGCCCAATAGACACTTAAAATACGGCCCCGAAGAGAAGGCTAATGAGCGTCTGCCAGAAAGTGAGTCTCTTTGTGAAGTGGTCGTCAGATTGAAACCATTTTTAAATAATGTTGTTCTGTCTACCGCCAACAAAATCAGTCAAGAATCGTGTGTTATAGTTGGGCATGGCAGCTCTGTAAGATCTCTGCTGAAAGTATTGGAAGGTATCTCAGATGAAGACATCAAAGATGTCGATATTCCCAACGGCATTCCGCTAGTTATAGAGTTGGATAGAGACAATTACTCTTTTGTGAGGAAATTTTACTTGGATCCAGAATCAGCTAAAGTTAATGCTCAAATGGTTCGTGATGAGGGTTTCGAAAAGAATCCATGA","protein_sequence":"MTVTDTFKLFILRHGQSELNSENIFCGWIDAQLTEKGKSQARHSAKLIKQFCDSNNISLPQIGYTSRLIRTQQTMDVILEELGLKHTNYVITTNTNIKEELQDTRFEGSMPVLQTWRLNERHYGAWQGQRKPDILKEYGKEKYMYIRRDYNGKPPKVNLNLEMVQEENDQGSSTGYDFKEPNRHLKYGPEEKANERLPESESLCEVVVRLKPFLNNVVLSTANKISQESCVIVGHGSSVRSLLKVLEGISDEDIKDVDIPNGIPLVIELDRDNYSFVRKFYLDPESAKVNAQMVRDEGFEKNP"},{"created_at":"2011-05-27T06:58:43.000Z","updated_at":"2011-05-27T15:01:27.000Z","name":"Phosphoglycerate mutase 2","uniprot_id":"Q12008","uniprot_name":"PMG2_YEAST","enzyme":true,"transporter":false,"gene_name":"GPM2","num_residues":311,"molecular_weight":"36072.80078","theoretical_pi":"6.52","general_function":"Involved in catalytic activity","specific_function":"Could be non-functional","reactions":[{"id":2796,"direction":"\u003e","locations":"Cytoplasm. Nucleus;Cytoplasm","altext":"2-phospho-D-glycerate = 3-phospho-D-glycerate.","export":false,"pw_reaction_id":null,"source":null},{"id":3812,"direction":"\u003c\u003e","locations":null,"altext":null,"export":true,"pw_reaction_id":"PW_R006326","source":"Smpdb"},{"id":3813,"direction":"\u003c\u003e","locations":null,"altext":null,"export":true,"pw_reaction_id":"PW_R006329","source":"Smpdb"},{"id":3816,"direction":"\u003c\u003e","locations":null,"altext":null,"export":true,"pw_reaction_id":"PW_R006330","source":"Smpdb"}],"signal_regions":"None","transmembrane_regions":"None","pdb_id":null,"cellular_location":"Cytoplasm","genbank_gene_id":"AY692876","genbank_protein_id":"51013203","gene_card_id":"GPM2","chromosome_location":"chromosome 4","locus":"YDL021W","synonyms":["PGAM 2","BPG-dependent PGAM 2","MPGM 2","Phosphoglyceromutase 2"],"enzyme_classes":["5.4.2.1"],"go_classes":[{"category":"Component","description":" Not Available"},{"category":"Function","description":" catalytic activity"},{"category":"Function","description":" isomerase activity"},{"category":"Function","description":" intramolecular transferase activity"},{"category":"Function","description":" intramolecular transferase activity, phosphotransferases"},{"category":"Process","description":" metabolic process"},{"category":"Process","description":" small molecule metabolic process"},{"category":"Process","description":" alcohol metabolic process"},{"category":"Process","description":" monosaccharide metabolic process"},{"category":"Process","description":" hexose metabolic process"},{"category":"Process","description":" glucose metabolic process"},{"category":"Process","description":" glucose catabolic process"},{"category":"Process","description":" glycolysis"}],"pfams":[{"name":"PGAM","identifier":"PF00300"}],"pathways":[{"name":"Glycolysis / Gluconeogenesis","kegg_map_id":"00010"},{"name":"Methane metabolism","kegg_map_id":"00680"},{"name":"Glycolysis I","kegg_map_id":null}],"gene_sequence":"ATGACTGCAAGCACACCATCCAATGTCATGACATTGTTCTTGTTAAGGCATGGACAAAGTGAATTGAATCACGAGAATATATTCTGTGGTTGGATTGACGCTAAGCTAACCGAAAAAGGTAAAGAACAAGCTCGTCATTCTGCCGAGCTAATCGAACAATATTGTAAAGCTAATAATTTGAGATTACCCCAGATTGGTTACACCTCACGTTTAATTAGGACCCAACAGACCATAGAAACGATGTGTGAAGAATTTAAGTTAAAGCCACAACTGCAGGTTGTTTACGACTTTAATAAAATCAAACTTGGAGACGAATTTGGCAGTGATGACAAGGATAATATGAAAATCCCGATTCTTCAAACTTGGAGGCTAAATGAACGTCATTACGGTTCCTGGCAGGGCCAGAGGAAACCGAATGTTTTAAAAGAATATGGTAAGGATAAATATATGTTCATTAGGAGAGATTACGAGGGTAAGCCACCACCTGTAGATCTTGACCGTGAGATGATTCAACAAGAAAATGAGAAGGGCTCTTCTACTGGGTACGAATTCAAGGAGCCAAACAGACAAATAAAATATGAATTGGAATGCAGCAATCATGACATTGTATTACCGGATTCCGAATCTCTTCGTGAAGTGGTTTATAGATTGAATCCTTTTCTACAAAATGTCATATTAAAATTAGCCAATCAATATGATGAATCTTCATGCCTGATTGTGGGCCATGGAAGTTCAGTGAGATCGCTACTGAAAATTCTGGAGGGTATATCAGATGATGACATCAAGAATGTTGATATTCCAAATGGTATCCCCTTAGTCGTTGAATTAGATAAGAATAATGGTCTTAAGTTTATCAGAAAATTCTACCTAGATCCTGAATCTGCTAAGATCAATGCTGAGAAAGTCCGTAATGAGGGTTTCATAAAAAATCCTTAA","protein_sequence":"MTASTPSNVMTLFLLRHGQSELNHENIFCGWIDAKLTEKGKEQARHSAELIEQYCKANNLRLPQIGYTSRLIRTQQTIETMCEEFKLKPQLQVVYDFNKIKLGDEFGSDDKDNMKIPILQTWRLNERHYGSWQGQRKPNVLKEYGKDKYMFIRRDYEGKPPPVDLDREMIQQENEKGSSTGYEFKEPNRQIKYELECSNHDIVLPDSESLREVVYRLNPFLQNVILKLANQYDESSCLIVGHGSSVRSLLKILEGISDDDIKNVDIPNGIPLVVELDKNNGLKFIRKFYLDPESAKINAEKVRNEGFIKNP"}]}