| Reaction Details |
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 | Report a problem with these data |
| Target | Penicillin-binding protein 1B |
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| Ligand | BDBM50458509 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1763994 (CHEMBL4199241) |
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| IC50 | 157000±n/a nM |
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| Citation |  Yu, JY; Cheng, HJ; Wu, HR; Wu, WS; Lu, JW; Cheng, TJ; Wu, YT; Fang, JM Structure-based design of bacterial transglycosylase inhibitors incorporating biphenyl, amine linker and 2-alkoxy-3-phosphorylpropanoate moieties. Eur J Med Chem150:729-741 (2018) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Penicillin-binding protein 1B |
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| Name: | Penicillin-binding protein 1B |
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| Synonyms: | B9X91_01540 | CEJ63_06105 | EJB02_02435 | FE003_06205 | Murein polymerase | PBP-1b | PBP1b | Penicillin-binding protein 1B | SAMEA104305229_00571 | SAMEA104305325_03053 | SAMEA104305337_07354 | mrcB | mrcB_2 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 88233.96 |
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| Organism: | Acinetobacter baumannii |
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| Description: | ChEMBL_117791 |
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| Residue: | 798 |
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| Sequence: | MKFERGIGFFALIFSILVIGAFIALSIYLIRLDNIIREKFEGQRWDIPAKVFARPLEIYN
NAPITQANFTQELKLLGYKTSSNYDKSGTYVAQGSNMYVHTRGFDYGDSVESEQVLELSF
ANDQVVEVRSTKPSSTGVARLEPLLIGGIYPQHNEDRVLIKLNSVPKPLIEALISTEDRN
FYHHHGISIRGTARALVSNVTGGRRQGGSTLTQQLVKNFYLTPERTLKRKVNEALMALLI
ELHYSKDEILEAYLNEVNLGQNGNYSINGYGLASQFYFGLPLRELNVAQQAYLVGLVQGP
SLYNPWKNPEGAKNRRDTVLNNMRVMGYLTQAEYETEIARPLNVLSKPSLGPAKFPDFLD
IVRRQLRTEYQESDLTNQGLRIFTTLDPIAQTQVQNAFKASVERLANSNPARLKNLQGAV
LIAHPENGELIAAVGSTQDFTGFNRALDAKRQVGSLLKPVIYLSAIESGRYNWASQIEDA
PISVPVDGGKSWTPKNYSGGGHGIVSLSEALANSYNLSAVRLGQEFGLSTFTNNLRKFGV
ESTIPAYPSIFLGAVNMSPMEVLGIYENFATGGFKYPTRAIRSVVDANGRLLDRYGLNVQ
QTIDPSVGYIMNYGLQQVMSSGTGRAAYNSLSPALKLAGKSGTTNDTRDSWFAGYSGNHV
AVVWLGLDDNKVTGLTGSSGALPVWINVMKQLRQTPVNLRQPDSVQWQWIDRASGDLSAQ
ACDGAMYIPMLAHTVPHRATPCGAPYYQVDPTYTPQSDNTIPEPQDDNTDSYIRESENQM
EQDLSNNTRIISSGSYNN
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| BDBM50458509 |
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| n/a |
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| Name | BDBM50458509 |
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| Synonyms: | CHEMBL4208140 |
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| Type | Small organic molecule |
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| Emp. Form. | C35H53N4O6P |
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| Mol. Mass. | 656.7923 |
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| SMILES | CCCCCCCCCCCCn1cc(CO[C@H](CP(O)(=O)OCCNCc2ccc(cc2)-c2ccccc2)C(=O)OCC)nn1 |r| |
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| Structure | 
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