| Reaction Details |
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 | Report a problem with these data |
| Target | Beta-lactamase |
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| Ligand | BDBM466989 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Inhibition of Beta-Lactamase Enzymes |
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| IC50 | 530±n/a nM |
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| Citation |  Comita-Prevoir, J; Durand-Reville, TF; Gauthier, L; O''Donnell, J; Romero, J; Tommasi, R; Verheijen, JC; Wu, F; Wu, X; Zhang, J Beta-lactamase inhibitor compounds US Patent US10800778 Publication Date 10/13/2020 |
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| More Info.: | Get all data from this article, Assay Method |
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| |
| Beta-lactamase |
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| Name: | Beta-lactamase |
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| Synonyms: | Beta-lactamase | OXA-48 | Synonyms=blaOXA-48 | bla |
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| Type: | PROTEIN |
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| Mol. Mass.: | 30363.94 |
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| Organism: | Klebsiella pneumoniae |
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| Description: | ChEMBL_103606 |
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| Residue: | 265 |
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| Sequence: | MRVLALSAVFLVASIIGMPAVAKEWQENKSWNAHFTEHKSQGVVVLWNENKQQGFTNNLK
RANQAFLPASTFKIPNSLIALDLGVVKDEHQVFKWDGQTRDIATWNRDHNLITAMKYSVV
PVYQEFARQIGEARMSKMLHAFDYGNEDISGNVDSFWLDGGIRISATEQISFLRKLYHNK
LHVSERSQRIVKQAMLTEANGDYIIRAKTGYSTRIEPKIGWWVGWVELDDNVWFFAMNMD
MPTSDGLGLRQAITKEVLKQEKIIP
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| BDBM466989 |
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| n/a |
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| Name | BDBM466989 |
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| Synonyms: | (2S)-2-fluoro-2-[[(2S,5R)-3-methyl-7-oxo-2-[2-(5-oxopyrrolidin-2-yl)ethylcarbamoyl]-1,6-diazabicyclo[3.2.1]oct-3-en-6-yl]oxy]acetic acid lithium salt | US10800778, Example 73 |
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| Type | Small organic molecule |
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| Emp. Form. | C16H21FN4O6 |
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| Mol. Mass. | 384.3595 |
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| SMILES | CC1=C[C@@H]2CN([C@@H]1C(=O)NCC[C@@H]1CCC(=O)N1)C(=O)N2O[C@@H](F)C(O)=O |r,t:1| |
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| Structure | 
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