Target
UDP-3-O-acyl-N-acetylglucosamine deacetylase
Ligand
BDBM50501765
Substrate
n/a
Meas. Tech.
ChEMBL_1699652 (CHEMBL4050634)
IC50
14±n/a nM
Citation
 Zhang, JChan, ALippa, BCross, JBLiu, CYin, NRomero, JALawrence, JHeney, RHerradura, PGoss, JClark, CAbel, CZhang, YPoutsiaka, KMEpie, FConrad, MMahamoon, ANguyen, KChavan, AClark, ELi, TCCheng, RKWood, MAndersen, OABrooks, MKwong, JBarker, JParr, IBGu, YRyan, MDColeman, SMetcalf, CA Structure-based discovery of LpxC inhibitors. Bioorg Med Chem Lett 27:1670-1680 (2017) [PubMed]  Article 
Target
Name:
UDP-3-O-acyl-N-acetylglucosamine deacetylase
Synonyms:
LPXC_PSEAE | Protein envA | UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase | UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase (LpxC | UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase (LpxC) | UDP-3-O-acyl-GlcNAc deacetylase | UDP-3-O-acyl-GlcNAc deacetylase (LpxC) | envA | lpxC
Type:
Enzyme
Mol. Mass.:
33428.15
Organism:
Pseudomonas aeruginosa
Description:
P47205
Residue:
303
Sequence:
MIKQRTLKNIIRATGVGLHSGEKVYLTLKPAPVDTGIVFCRTDLDPVVEIPARAENVGETTMSTTLVKGDVKVDTVEHLLSAMAGLGIDNAYVELSASEVPIMDGSAGPFVFLIQSAGLQEQEAAKKFIRIKREVSVEEGDKRAVFVPFDGFKVSFEIDFDHPVFRGRTQQASVDFSSTSFVKEVSRARTFGFMRDIEYLRSQNLALGGSVENAIVVDENRVLNEDGLRYEDEFVKHKILDAIGDLYLLGNSLIGEFRGFKSGHALNNQLLRTLIADKDAWEVVTFEDARTAPISYMRPAAAV
  
Inhibitor
Name:
BDBM50501765
Synonyms:
CHEMBL4062274
Type:
Small organic molecule
Emp. Form.:
C29H38N4O4
Mol. Mass.:
506.6364
SMILES:
[H][C@@]1(CCc2cc(ccc12)C#Cc1ccc(CN2CCN(CCO)CC2)cc1)N[C@H](C(=O)NO)C(C)(C)O |r|
Structure:
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