[Bioperl-l] Is Bio::KEGG:Enzyme implemented?

Brian Osborne bosborne11 at verizon.net
Wed Feb 25 14:45:56 UTC 2009


Bryan,

Right, more like a "reaction" file, which builds pathways. No parser  
like this in the core Bioperl, no. In principle this would fit into  
bioperl-network but that package only has parsers for PSI-MI and  
simple pathway formats like DIP.

Brian O.


On Feb 25, 2009, at 9:36 AM, Bryan Bishop wrote:

> On Wed, Feb 25, 2009 at 8:31 AM, Brian Osborne  
> <bosborne11 at verizon.net> wrote:
>> Bio::SeqIO::kegg parses the database format and creates Seq  
>> objects, I show
>> an example of the format below.
>
> That doesn't look like the same thing. In the ligand/enzyme file, you
> see data like this:
>
> ---------
> ENTRY       EC 1.1.1.1                  Enzyme
> NAME        alcohol dehydrogenase;
>            aldehyde reductase;
>            ADH;
>            alcohol dehydrogenase (NAD);
>            aliphatic alcohol dehydrogenase;
>            ethanol dehydrogenase;
>            NAD-dependent alcohol dehydrogenase;
>            NAD-specific aromatic alcohol dehydrogenase;
>            NADH-alcohol dehydrogenase;
>            NADH-aldehyde dehydrogenase;
>            primary alcohol dehydrogenase;
>            yeast alcohol dehydrogenase
> CLASS       Oxidoreductases;
>            Acting on the CH-OH group of donors;
>            With NAD+ or NADP+ as acceptor
> SYSNAME     alcohol:NAD+ oxidoreductase
> REACTION    an alcohol + NAD+ = an aldehyde or ketone + NADH + H+  
> [RN:R07326
>            R07327]
> ALL_REAC    R07326 > R00623 R00754 R02124 R04805 R04880 R06917  
> R06927 R08281
>            R08306 R08557 R08558;
>            R07327 > R00624 R08310;
>            (other) R01041 R05233 R05234 R07105
> SUBSTRATE   alcohol [CPD:C00069];
>            NAD+ [CPD:C00003]
> PRODUCT     aldehyde [CPD:C00071];
>            ketone [CPD:C00709];
>            NADH [CPD:C00004];
>            H+ [CPD:C00080]
> COFACTOR    Zinc [CPD:C00038]
> COMMENT     A zinc protein. Acts on primary or secondary alcohols or
>            hemi-acetals; the animal, but not the yeast, enzyme acts  
> also on
>            cyclic secondary alcohols.
> REFERENCE   1
>  AUTHORS   Branden, G.-I., Jornvall, H., Eklund, H. and Furugren, B.
>  TITLE     Alcohol dehydrogenase.
>  JOURNAL   In: Boyer, P.D. (Ed.), The Enzymes, 3rd ed., vol. 11,  
> Academic
>            Press, New York, 1975, p. 103-190.
>  ORGANISM  horse, human [GN:hsa], rat [GN:rno], Saccharomyces  
> cerevisiae
>            [GN:sce]
> REFERENCE   2  [PMID:320001]
>  AUTHORS   Jornvall H.
>  TITLE     Differences between alcohol dehydrogenases. Structural  
> properties
>            and evolutionary aspects.
>  JOURNAL   Eur. J. Biochem. 72 (1977) 443-52.
>  ORGANISM  horse, human [GN:hsa], rat [GN:rno], Bacillus  
> stearotherrnophilus,
>            Drosophila melanogaster [GN:dme]
> REFERENCE   3
>  AUTHORS   Negelein, E. and Wulff, H.-J.
>  TITLE     Diphosphopyridinproteid ackohol, acetaldehyd.
>  JOURNAL   Biochem. Z. 293 (1937) 351-389.
> REFERENCE   4
>  AUTHORS   Sund, H. and Theorell, H.
>  TITLE     Alcohol dehydrogenase.
>  JOURNAL   In: Boyer, P.D., Lardy, H. and Myrback, K. (Eds.), The  
> Enzymes, 2nd
>            ed., vol. 7, Academic Press, New York, 1963, p. 25-83.
>  ORGANISM  horse, Saccharomyces cerevisiae [GN:sce]
> REFERENCE   5  [PMID:13605979]
>  AUTHORS   THEORELL H.
>  TITLE     Kinetics and equilibria in the liver alcohol  
> dehydrogenase system.
>  JOURNAL   Adv. Enzymol. Relat. Subj. Biochem. 20 (1958) 31-49.
> PATHWAY     PATH: ec00010  Glycolysis / Gluconeogenesis
>            PATH: ec00071  Fatty acid metabolism
>            PATH: ec00120  Bile acid biosynthesis
>            PATH: ec00260  Glycine, serine and threonine metabolism
>            PATH: ec00350  Tyrosine metabolism
>            PATH: ec00624  1- and 2-Methylnaphthalene degradation
>            PATH: ec00641  3-Chloroacrylic acid degradation
>            PATH: ec00830  Retinol metabolism
>            PATH: ec00980  Metabolism of xenobiotics by cytochrome P450
>            PATH: ec00982  Drug metabolism - cytochrome P450
> ORTHOLOGY   KO: K00001  alcohol dehydrogenase
>            KO: K11440  choline dehydrogenase
> GENES       HSA: 124(ADH1A) 125(ADH1B) 126(ADH1C) 127(ADH4)  
> 128(ADH5) 130(ADH6)
>                 131(ADH7)
>            PTR: 461394(ADH4) 461395(ADH6) 461396(ADH1B)  
> 462908(RTN4IP1)
>                 471257(ADH7) 743928(ADH5) 744064(ADH1A) 744176(ADH1C)
>            MCC: 697703(ADH5) 707258(ADH5) 707367 707682(ADH1A) 708520
>                 711061(ADH1C)
>            MMU: 11522(Adh1) 11529(Adh7) 11532(Adh5) 26876(Adh4)
> <snip>
>            TPE: Tpen_1006 Tpen_1516
> STRUCTURES  PDB: 1A4U  1A71  1A72  1ADB  1ADC  1ADF  1ADG  1AGN   
> 1AXE  1AXG
>                 1B14  1B15  1B16  1B2L  1BTO  1CDO  1D1S  1D1T   
> 1DEH  1E3E
>                 1E3I  1E3L  1EE2  1H2B  1HDX  1HDY  1HDZ  1HET   
> 1HEU  1HF3
>                 1HLD  1HSO  1HSZ  1HT0  1HTB  1JU9  1JVB  1LDE   
> 1LDY  1LLU
>                 1M6H  1M6W  1MA0  1MC5  1MG0  1MG5  1MGO  1MP0   
> 1N8K  1N92
>                 1NTO  1NVG  1O2D  1P1R  1QLH  1QLJ  1QV6  1QV7   
> 1R37  1RJW
>                 1SBY  1TEH  1U3T  1U3U  1U3V  1U3W  1VJ0  1YE3   
> 2EER  2FZE
>                 2FZW  2HCY  2JHF  2JHG  2OHX  2OXI  3BTO  3COS   
> 3HUD  5ADH
>                 6ADH  7ADH
> DBLINKS     IUBMB Enzyme Nomenclature: 1.1.1.1
>            ExPASy - ENZYME nomenclature database: 1.1.1.1
>            ExplorEnz - The Enzyme Database: 1.1.1.1
>            ERGO genome analysis and discovery system: 1.1.1.1
>            UM-BBD (Biocatalysis/Biodegradation Database): 1.1.1.1
>            BRENDA, the Enzyme Database: 1.1.1.1
>            CAS: 9031-72-5
> ///
> ---------
>
> You can find this download here: (23 MB)
> http://heybryan.org/~bbishop/docs/dopamine/enzyme
>
> Skeleton "enzyme" file parser:
> http://heybryan.org/~bbishop/docs/dopamine/parseenzyme.pl
>
> - Bryan
> http://heybryan.org/
> 1 512 203 0507
> _______________________________________________
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> Bioperl-l at lists.open-bio.org
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