| Reaction Details |
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 | Report a problem with these data |
| Target | UDP-N-acetylmuramoyl-L-alanyl-D-glutamate--2,6-diaminopimelate ligase |
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| Ligand | BDBM119111 |
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| Substrate/Competitor | n/a |
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| IC50 | 7.5e+4±n/a nM |
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| Citation |  Hrast, M; Sosic, I; Sink, R; Gobec, S Inhibitors of the peptidoglycan biosynthesis enzymes MurA-F. Bioorg Chem55:2-15 (2014) [PubMed] Article |
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| More Info.: | Get all data from this article |
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| UDP-N-acetylmuramoyl-L-alanyl-D-glutamate--2,6-diaminopimelate ligase |
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| Name: | UDP-N-acetylmuramoyl-L-alanyl-D-glutamate--2,6-diaminopimelate ligase |
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| Synonyms: | MURE_MYCTU | MurE (M. tuberculosis) | UDP-N-acetylmuramoyl-L-alanyl-D-glutamate--L-lysine ligase | murE |
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| Type: | Protein |
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| Mol. Mass.: | 55342.10 |
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| Organism: | Mycobacterium tuberculosis H37Rv |
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| Description: | M. tuberculosis MurE |
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| Residue: | 535 |
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| Sequence: | MSSLARGISRRRTEVATQVEAAPTGLRPNAVVGVRLAALADQVGAALAEGPAQRAVTEDR
TVTGVTLRAQDVSPGDLFAALTGSTTHGARHVGDAIARGAVAVLTDPAGVAEIAGRAAVP
VLVHPAPRGVLGGLAATVYGHPSERLTVIGITGTSGKTTTTYLVEAGLRAAGRVAGLIGT
IGIRVGGADLPSALTTPEAPTLQAMLAAMVERGVDTVVMEVSSHALALGRVDGTRFAVGA
FTNLSRDHLDFHPSMADYFEAKASLFDPDSALRARTAVVCIDDDAGRAMAARAADAITVS
AADRPAHWRATDVAPTDAGGQQFTAIDPAGVGHHIGIRLPGRYNVANCLVALAILDTVGV
SPEQAVPGLREIRVPGRLEQIDRGQGFLALVDYAHKPEALRSVLTTLAHPDRRLAVVFGA
GGDRDPGKRAPMGRIAAQLADLVVVTDDNPRDEDPTAIRREILAGAAEVGGDAQVVEIAD
RRDAIRHAVAWARPGDVVLIAGKGHETGQRGGGRVRPFDDRVELAAALEALERRA
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| BDBM119111 |
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| n/a |
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| Name | BDBM119111 |
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| Synonyms: | MurE inhibitor (compound 53) |
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| Type | Small organic molecule |
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| Emp. Form. | C20H28O4 |
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| Mol. Mass. | 332.4339 |
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| SMILES | [#6]-[#6](-[#6])-[#6](=O)-c1c(-[#8])cc(-[#8])cc1-[#8]-[#6]\[#6]=[#6](\[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |
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| Structure | 
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