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Target
Undecaprenyl-diphosphatase
Ligand
BDBM50458054
Substrate
n/a
Meas. Tech.
ChEMBL_1761928 (CHEMBL4197175)
IC50
5600±n/a nM
Citation
 Elsebaei, MM; Mohammad, H; Abouf, M; Abutaleb, NS; Hegazy, YA; Ghiaty, A; Chen, L; Zhang, J; Malwal, SR; Oldfield, E; Seleem, MN; Mayhoub, AS Alkynyl-containing phenylthiazoles: Systemically active antibacterial agents effective against methicillin-resistant Staphylococcus aureus (MRSA). Eur J Med Chem 148:195-209 (2018) [PubMed]  Article 
Target
Name:
Undecaprenyl-diphosphatase
Synonyms:
3.6.1.27 | Bacitracin resistance protein | UPPP_ECOLI | Undecaprenyl pyrophosphate phosphatase | bacA | upk | uppP
Type:
PROTEIN
Mol. Mass.:
29763.97
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_117826
Residue:
273
Sequence:
MSDMHSLLIAAILGVVEGLTEFLPVSSTGHMIIVGHLLGFEGDTAKTFEVVIQLGSILAVVVMFWRRLFGLIGIHFGRPLQHEGESKGRLTLIHILLGMIPAVVLGLLFHDTIKSLFNPINVMYALVVGGLLLIAAECLKPKEPRAPGLDDMTYRQAFMIGCFQCLALWPGFSRSGATISGGMLMGVSRYAASEFSFLLAVPMMMGATALDLYKSWGFLTSGDIPMFAVGFITAFVVALIAIKTFLQLIKRISFIPFAIYRFIVAAAVYVVFF
  
Inhibitor
Name:
BDBM50458054
Synonyms:
Albac 50 | Baci-Rx | Baciferm 50 | Baciguent | Baciim | Bacitracin | CHEBI:35862 | E700
Type:
Small organic molecule
Emp. Form.:
C66H103N17O16S
Mol. Mass.:
1422.693
SMILES:
[H][C@]1(NC(=O)[C@@H](CCCN)NC(=O)[C@H](CCCCNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2ccccc2)NC1=O)NC(=O)[C@@H](NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CSC(=N1)[C@@H](N)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC |r,c:88|
Structure:
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