| Reaction Details |
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 | Report a problem with these data |
| Target | Acyl carrier protein,/NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial |
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| Ligand | BDBM50094721 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_141740 (CHEMBL749252) |
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| IC50 | 1.7±n/a nM |
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| Citation |  Gallardo, T; Zafra-Polo, MC; Tormo, JR; González, MC; Franck, X; Estornell, E; Cortes, D Semisynthesis of antitumoral acetogenins: SAR of functionalized alkyl-chain bis-tetrahydrofuranic acetogenins, specific inhibitors of mitochondrial complex I. J Med Chem43:4793-800 (2000) [PubMed] |
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| More Info.: | Get all data from this article, Assay Method |
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| Acyl carrier protein,/NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial |
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| Name: | Acyl carrier protein,/NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial |
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| Synonyms: | Mitochondrial complex I; NADH oxidoreductase |
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| Type: | n/a |
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| Mol. Mass.: | n/a |
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| Description: | ASSAY_ID of EBI is 141738 |
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| Components: | This complex has 2 components. |
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| Component 1 |
| Name: | NADH dehydrogenase [ubiquinone] flavoprotein 1, mitochondrial |
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| Synonyms: | CI-51kD | Complex I-51kD | NADH dehydrogenase flavoprotein 1 | NADH-ubiquinone oxidoreductase 51 kDa subunit | NDUFV1 | NDUV1_BOVIN | UQOR1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 50659.85 |
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| Organism: | Bos taurus |
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| Description: | EBI_100771 |
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| Residue: | 464 |
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| Sequence: | MLAARRLLGGSLPARVSVRFSGDTTAPKKTSFGSLKDEDRIFTNLYGRHDWRLKGAQSRG
DWYKTKEILLKGPDWILGEVKTSGLRGRGGAGFPTGLKWSFMNKPSDGRPKYLVVNADEG
EPGTCKDREIIRHDPHKLVEGCLVGGRAMGARAAYIYIRGEFYNEASNLQVAIREAYEAG
LIGKNACGSGYDFDVFVVRGAGAYICGEETALIESIEGKQGKPRLKPPFPADVGVFGCPT
TVANVETVAVSPTICRRGGAWFASFGRERNSGTKLFNISGHVNNPCTVEEEMSVPLKELI
EKHAGGVTGGWDNLLAVIPGGSSTPLIPKSVCETVLMDFDALIQAQTGLGTAAVIVMDRS
TDIVKAIARLIEFYKHESCGQCTPCREGVDWMNKVMARFVRGDARPAEIDSLWEISKQIE
GHTICALGDGAAWPVQGLIRHFRPELEERMQQFAQQHQARQAAF
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| Component 2 |
| Name: | Acyl carrier protein, mitochondrial |
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| Synonyms: | ACP | ACPM_BOVIN | CI-SDAP | NADH-ubiquinone oxidoreductase 9.6 kDa subunit | NDUFAB1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 17397.64 |
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| Organism: | Bos taurus |
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| Description: | ChEMBL_469770 |
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| Residue: | 156 |
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| Sequence: | MAVRVLCACVRRLPTAFAPLPRLPTLAAARPLSTTLFAAETRTRPGAPLPALVLAQVPGR
VTQLCRQYSDAPPLTLEGIKDRVLYVLKLYDKIDPEKLSVNSHFMKDLGLDSLDQVEIIM
AMEDEFGFEIPDIDAEKLMCPQEIVDYIADKKDVYE
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| BDBM50094721 |
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| n/a |
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| Name | BDBM50094721 |
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| Synonyms: | CHEMBL145555 | Methanesulfonic acid 12-methanesulfonyloxy-12-[5'-(1-methanesulfonyloxy-undecyl)-octahydro-[2,2']bifuranyl-5-yl]-1-(5-methyl-2-oxo-2,5-dihydro-furan-3-ylmethyl)-dodecyl ester |
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| Type | Small organic molecule |
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| Emp. Form. | C40H72O13S3 |
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| Mol. Mass. | 857.187 |
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| SMILES | CCCCCCCCCC[C@H](OS(C)(=O)=O)[C@H]1CC[C@H](O1)[C@@H]1CC[C@@H](O1)[C@@H](CCCCCCCCCC[C@H](CC1=C[C@H](C)OC1=O)OS(C)(=O)=O)OS(C)(=O)=O |t:41| |
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| Structure | 
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