methylthiopropanoate degradation I (cleavage)
MetaCyc:PWY-6048
The complete three-reaction MetaCyc route converts 3-(methylthio)propionate (MMPA) to methanethiol, acetaldehyde and carbon dioxide in Ruegeria pomeroyi DSS-3. DmdB2 activates MMPA with ATP and CoA; DmdC1 oxidizes the thioester to trans-methylthioacryloyl-CoA; DmdD-dependent hydration and hydrolysis complete cleavage. The terminal net reaction includes spontaneous methanethiol elimination and expected spontaneous decarboxylation. Generic electron-transfer flavoprotein redox states retain the MetaCyc/Rhea database convention: the physiological partner remains unidentified, and direct DmdC1 assays used artificial acceptors. DmdB2 and DmdC1 are experimentally supported homodimers and DmdD a homohexamer; protein enables edges represent their functional roles without asserting monomer sufficiency. DmdB magnesium dependence and DmdC inferred FAD cofactor are distinguished from the whole carrier. DMSP-dependent DmdB2 inhibition and its conditional relief by MMPA are supported in vitro. The route starts after DMSP demethylation and stops before acetaldehyde oxidation or methanethiol assimilation; it does not assert these adjacent pathways or flux in every environmental condition.
- Pathway type
- organosulfur catabolism
- Organism scope
Pathway network
24 nodes · 29 asserted directed edges
Arrows show recorded subject → object relationships, not necessarily metabolic flow. Select a node for details or an arrow for evidence. Scroll, zoom or find a node to explore.
- Reaction / activity
- Chemical / cofactor
- Protein / complex
- Pathway
- Solid arrow: mechanistic relation
- Dashed arrow: membership, location or cofactor relation
Components and activities
| Node | Kind or role | Source direction |
|---|---|---|
Ruegeria pomeroyi DSS-3NCBITaxon:246200 | taxon | |
3-(methylthio)propionateCHEBI:49016 | small molecule | |
ATP(4-)CHEBI:30616 | small molecule | |
coenzyme A(4-)CHEBI:57287 | small molecule | |
3-(methylthio)propanoyl-CoA(4-)CHEBI:82815 | small molecule | |
adenosine 5'-monophosphate(2-)CHEBI:456215 | small molecule | |
diphosphate(3-)CHEBI:33019 | small molecule | |
oxidized [electron-transfer flavoprotein]RHEA-COMP:10685 | protein | |
hydronCHEBI:15378 | small molecule | |
3-(methylthio)acryloyl-CoA(4-)CHEBI:84994 | small molecule | |
reduced [electron-transfer flavoprotein]RHEA-COMP:10686 | protein | |
waterCHEBI:15377 | small molecule | |
methanethiolCHEBI:16007 | small molecule | |
acetaldehydeCHEBI:15343 | small molecule | |
carbon dioxideCHEBI:16526 | small molecule | |
magnesium(2+)CHEBI:18420 | cofactor | |
FAD(3-)CHEBI:57692 | cofactor | |
S,S-dimethyl-beta-propiothetinCHEBI:16457 | small molecule | |
3-methylmercaptopropionyl-CoA ligaseUniProtKB:Q5LRT0 | protein | |
3-methylmercaptopropionyl-CoA dehydrogenaseUniProtKB:Q5LLW7 | protein | |
Methylthioacryloyl-CoA hydrataseUniProtKB:Q5LLW6 | protein | |
3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 | molecular activity | left to right |
3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 | molecular activity | left to right |
3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 | molecular activity | left to right |
Mechanistic edges
| Subject | Predicate and description | Object | Evidence |
|---|---|---|---|
3-(methylthio)propionateCHEBI:49016 | consumes | 3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 |
|
ATP(4-)CHEBI:30616 | consumes | 3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 |
|
coenzyme A(4-)CHEBI:57287 | consumes | 3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 |
|
3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 | produces | 3-(methylthio)propanoyl-CoA(4-)CHEBI:82815 |
|
3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 | produces | adenosine 5'-monophosphate(2-)CHEBI:456215 |
|
3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 | produces | diphosphate(3-)CHEBI:33019 |
|
3-(methylthio)propanoyl-CoA(4-)CHEBI:82815 | consumes | 3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 |
|
oxidized [electron-transfer flavoprotein]RHEA-COMP:10685 | consumes This whole generic carrier state is the curated database acceptor-class convention, not a specific DSS-3 protein. Primary assays establish MMPA-CoA oxidation with artificial acceptors; the physiological flavoprotein partner remains unresolved. Carrier-bound FAD is not a substitute node for the carrier. | 3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 |
|
hydronCHEBI:15378 | consumes | 3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 |
|
3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 | produces | 3-(methylthio)acryloyl-CoA(4-)CHEBI:84994 |
|
3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 | produces This whole generic carrier state is the curated database acceptor-class convention, not a specific DSS-3 protein. Primary assays establish MMPA-CoA oxidation with artificial acceptors; the physiological flavoprotein partner remains unresolved. Carrier-bound FAD is not a substitute node for the carrier. | reduced [electron-transfer flavoprotein]RHEA-COMP:10686 |
|
3-(methylthio)acryloyl-CoA(4-)CHEBI:84994 | consumes This is a side of the single terminal net reaction. DmdD catalyzes hydration and hydrolysis; methanethiol elimination and subsequent decarboxylation are spontaneous or expected spontaneous steps within that net conversion. | 3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 |
|
waterCHEBI:15377 | consumes This is a side of the single terminal net reaction. DmdD catalyzes hydration and hydrolysis; methanethiol elimination and subsequent decarboxylation are spontaneous or expected spontaneous steps within that net conversion. | 3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 |
|
3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 | produces This is a side of the single terminal net reaction. DmdD catalyzes hydration and hydrolysis; methanethiol elimination and subsequent decarboxylation are spontaneous or expected spontaneous steps within that net conversion. | methanethiolCHEBI:16007 |
|
3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 | produces This is a side of the single terminal net reaction. DmdD catalyzes hydration and hydrolysis; methanethiol elimination and subsequent decarboxylation are spontaneous or expected spontaneous steps within that net conversion. | acetaldehydeCHEBI:15343 |
|
3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 | produces This is a side of the single terminal net reaction. DmdD catalyzes hydration and hydrolysis; methanethiol elimination and subsequent decarboxylation are spontaneous or expected spontaneous steps within that net conversion. | carbon dioxideCHEBI:16526 |
|
3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 | produces This is a side of the single terminal net reaction. DmdD catalyzes hydration and hydrolysis; methanethiol elimination and subsequent decarboxylation are spontaneous or expected spontaneous steps within that net conversion. | coenzyme A(4-)CHEBI:57287 |
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3-methylmercaptopropionyl-CoA ligaseUniProtKB:Q5LRT0 | enables DmdB2 (SPO2045) enables MMPA activation as a functional gene-product role. Purified recombinant DSS-3 enzyme was a homodimer by gel filtration; this edge does not assert monomer sufficiency. DmdB1 is a separately characterized isozyme outside this native catalyst projection. | 3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 |
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3-methylmercaptopropionyl-CoA dehydrogenaseUniProtKB:Q5LLW7 | enables DmdC1 (SPO3804) enables the oxidation in its experimentally supported homodimeric context. Current Rhea specifies a generic ETF acceptor class; this role does not claim that the exact carrier was tested. The 2022 study used recombinant DSS-3 enzyme and artificial electron acceptors. | 3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 |
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Methylthioacryloyl-CoA hydrataseUniProtKB:Q5LLW6 | enables DmdD (SPO3805) enables the observed net cleavage as a homohexamer (dimer of trimers), not an isolated monomer. The net equation includes spontaneous methanethiol elimination after hydration and expected spontaneous malonate-semialdehyde decarboxylation. It is not duplicated by component reaction nodes. | 3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 |
|
3-methylmercaptopropionyl-CoA ligaseUniProtKB:Q5LRT0 | has_cofactor Magnesium dependence is reported for ligase activity. The sources do not establish an independent protein-binding stoichiometry or separate MgATP and free-ion mechanisms. | magnesium(2+)CHEBI:18420 |
|
3-methylmercaptopropionyl-CoA dehydrogenaseUniProtKB:Q5LLW7 | has_cofactor The enzyme-bound FAD assignment is similarity-scoped and distinct from the generic whole ETF substrate. Free FAD did not act as the sole electron acceptor in the DSS-3 DmdC1 assay; cross-species DmdC activity with free FAD is not transferred here. | FAD(3-)CHEBI:57692 |
|
S,S-dimethyl-beta-propiothetinCHEBI:16457 | inhibits The physiological regulatory model is proposed from measured in vitro inhibition and cellular DMSP context; no direct regulator binding or universal in vivo flux assertion is made. | 3-methylmercaptopropionyl-CoA ligaseUniProtKB:Q5LRT0 |
|
3-(methylthio)propionateCHEBI:49016 | activates Conditional relief of DMSP inhibition, not unqualified stimulation in the absence of inhibitor. MMPA is also the substrate of the activation reaction. | 3-methylmercaptopropionyl-CoA ligaseUniProtKB:Q5LRT0 |
|
3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 | part_of | MetaCyc:PWY-6048 |
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3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 | part_of | MetaCyc:PWY-6048 |
|
3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 | part_of The selected terminal Rhea net includes all four native component transformations and is represented once. | MetaCyc:PWY-6048 |
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3-(methylsulfanyl)propanoate + ATP + CoA => 3-(methylsulfanyl)propanoyl-CoA + AMP + diphosphateRHEA:43053 | provides_input_for The shared chemical is CHEBI:82815; this is material continuity, not an assumed regulatory relation. | 3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 |
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3-(methylsulfanyl)propanoyl-CoA + oxidized [electron-transfer flavoprotein] + H(+) => 3-(methylsulfanyl)acryloyl-CoA + reduced [electron-transfer flavoprotein]RHEA:52613 | provides_input_for The shared chemical is CHEBI:84994; this is material continuity, not an assumed regulatory relation. | 3-(methylsulfanyl)acryloyl-CoA + 2 H2O => methanethiol + acetaldehyde + CO2 + CoARHEA:45145 |
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References
MetaCyc:ENZRXN-19462MetaCyc ENZRXN-19462 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:ENZRXN-19463MetaCyc ENZRXN-19463 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:ENZRXN-19464MetaCyc ENZRXN-19464 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:MONOMER-16783MetaCyc MONOMER-16783 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:MONOMER-16784MetaCyc MONOMER-16784 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:MONOMER-16785MetaCyc MONOMER-16785 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:PWY-6048MetaCyc PWY-6048 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:RXN-12571MetaCyc RXN-12571 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:RXN-12572MetaCyc RXN-12572 native XML (source version: MetaCyc 22.5; original native XML)MetaCyc:RXN-12573MetaCyc RXN-12573 native XML (source version: MetaCyc 22.5; original native XML)PMID:21562561Novel pathway for assimilation of dimethylsulphoniopropionate widespread in marine bacteria. (source version: Nature 473, 208-211 (2011); complete six-page author-hosted original PDF)PMID:23704947Crystal Structure of DmdD, a Crotonase Superfamily Enzyme That Catalyzes the Hydration and Hydrolysis of Methylthioacryloyl-CoA (source version: PLOS ONE 8:e63870 (2013); original full-text JATS)PMID:24443527Regulatory and Functional Diversity of Methylmercaptopropionate Coenzyme A Ligases from the Dimethylsulfoniopropionate Demethylation Pathway in Ruegeria pomeroyi DSS-3 and Other Proteobacteria (source version: Original full-text PMC HTML retrieved 2026-10-11)PMID:34818101Substrate Specificity of the 3-Methylmercaptopropionyl Coenzyme A Dehydrogenase (DmdC1) from Ruegeria pomeroyi DSS-3 (source version: Original full-text PMC HTML retrieved 2026-10-11)RHEA:43053Rhea 43053 directed MMPA cleavage reaction (source version: 142 (2026-09-02); complete compressed RDF body)RHEA:45145Rhea 45145 directed MMPA cleavage reaction (source version: 142 (2026-09-02); complete compressed RDF body)RHEA:52613Rhea 52613 directed MMPA cleavage reaction (source version: 142 (2026-09-02); complete compressed RDF body)UniProtKB:Q5LLW6UniProtKB Q5LLW6, Ruegeria pomeroyi DSS-3 (source version: 2026_03 (2026-09-02))UniProtKB:Q5LLW7UniProtKB Q5LLW7, Ruegeria pomeroyi DSS-3 (source version: 2026_03 (2026-09-02))UniProtKB:Q5LRT0UniProtKB Q5LRT0, Ruegeria pomeroyi DSS-3 (source version: 2026_03 (2026-09-02))
Curation history
- codex
- CREATE — Add methylthiopropanoate degradation I (cleavage)
Curated all three native methylthiopropanoate cleavage reactions, retaining generic electron-carrier conventions, measured enzyme/cofactor context and spontaneous components of the terminal net reaction. Maintained record MetaCyc:PWY-6048; creation bytes SHA256 7810e21c690b17fe781fd249ea6fc0ec86220913a55947df75ec29c15cffe5dd. Original-source projections, replay and identifier decisions are in research/pathway_additions/2026-10-11-next-203/. Duplicate searches included ignored and hidden files. Independent review and full integration gates are separate subsequent checks, not claimed by this creation event.
- CREATE — Add methylthiopropanoate degradation I (cleavage)