Reaction Details |
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Target | 1-deoxy-D-xylulose-5-phosphate synthase |
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Ligand | BDBM92962 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1441273 (CHEMBL3380663) |
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Kd | 3100±n/a nM |
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Citation | Masini, T; Hirsch, AK Development of inhibitors of the 2C-methyl-D-erythritol 4-phosphate (MEP) pathway enzymes as potential anti-infective agents. J Med Chem57:9740-63 (2014) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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1-deoxy-D-xylulose-5-phosphate synthase |
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Name: | 1-deoxy-D-xylulose-5-phosphate synthase |
Synonyms: | DXS_MYCTU | dxs |
Type: | PROTEIN |
Mol. Mass.: | 67882.02 |
Organism: | Mycobacterium tuberculosis |
Description: | ChEMBL_1441273 |
Residue: | 638 |
Sequence: | MLQQIRGPADLQHLSQAQLRELAAEIREFLIHKVAATGGHLGPNLGVVELTLALHRVFDS
PHDPIIFDTGHQAYVHKMLTGRSQDFATLRKKGGLSGYPSRAESEHDWVESSHASAALSY
ADGLAKAFELTGHRNRHVVAVVGDGALTGGMCWEALNNIAASRRPVIIVVNDNGRSYAPT
IGGVADHLATLRLQPAYEQALETGRDLVRAVPLVGGLWFRFLHSVKAGIKDSLSPQLLFT
DLGLKYVGPVDGHDERAVEVALRSARRFGAPVIVHVVTRKGMGYPPAEADQAEQMHSTVP
IDPATGQATKVAGPGWTATFSDALIGYAQKRRDIVAITAAMPGPTGLTAFGQRFPDRLFD
VGIAEQHAMTSAAGLAMGGLHPVVAIYSTFLNRAFDQIMMDVALHKLPVTMVLDRAGITG
SDGASHNGMWDLSMLGIVPGIRVAAPRDATRLREELGEALDVDDGPTALRFPKGDVGEDI
SALERRGGVDVLAAPADGLNHDVLLVAIGAFAPMALAVAKRLHNQGIGVTVIDPRWVLPV
SDGVRELAVQHKLLVTLEDNGVNGGAGSAVSAALRRAEIDVPCRDVGLPQEFYEHASRSE
VLADLGLTDQDVARRITGWVAALGTGVCASDAIPEHLD
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BDBM92962 |
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n/a |
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Name | BDBM92962 |
Synonyms: | ThDP |
Type | Small molecule |
Emp. Form. | C12H19N4O7P2S |
Mol. Mass. | 425.314 |
SMILES | Cc1c(CCOP(O)(=O)OP(O)(O)=O)sc[n+]1Cc1cnc(C)nc1N |
Structure |
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