Reaction Details
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Acyl-[acyl-carrier-protein]--UDP-N-acetylglucosamine O-acyltransferase
Ligand
BDBM50577526
Substrate
n/a
Meas. Tech.
ChEMBL_2130503 (CHEMBL4839932)
IC50
>50000±n/a nM
Citation
Ryan, MD; Parkes, AL; Corbett, D; Dickie, AP; Southey, M; Andersen, OA; Stein, DB; Barbeau, OR; Sanzone, A; Thommes, P; Barker, J; Cain, R; Compper, C; Dejob, M; Dorali, A; Etheridge, D; Evans, S; Faulkner, A; Gadouleau, E; Gorman, T; Haase, D; Holbrow-Wilshaw, M; Krulle, T; Li, X; Lumley, C; Mertins, B; Napier, S; Odedra, R; Papadopoulos, K; Roumpelakis, V; Spear, K; Trimby, E; Williams, J; Zahn, M; Keefe, AD; Zhang, Y; Soutter, HT; Centrella, PA; Clark, MA; Cuozzo, JW; Dumelin, CE; Deng, B; Hunt, A; Sigel, EA; Troast, DM; DeJonge, BLM Discovery of Novel UDP- J Med Chem 64:14377-14425 (2021) [PubMed] Article More Info.:
Target
Name:
Acyl-[acyl-carrier-protein]--UDP-N-acetylglucosamine O-acyltransferase
Synonyms:
LPXA_ECOLI | lpxA | UDP-N-acetylglucosamine acryltransferase (LpxA)
Type:
Enzyme
Mol. Mass.:
28083.70
Organism:
Escherichia coli (strain K12)
Description:
P0A722
Residue:
262
Sequence:
MIDKSAFVHPTAIVEEGASIGANAHIGPFCIVGPHVEIGEGTVLKSHVVVNGHTKIGRDNEIYQFASIGEVNQDLKYAGEPTRVEIGDRNRIRESVTIHRGTVQGGGLTKVGSDNLLMINAHIAHDCTVGNRCILANNATLAGHVSVDDFAIIGGMTAVHQFCIIGAHVMVGGCSGVAQDVPPYVIAQGNHATPFGVNIEGLKRRGFSREAITAIRNAYKLIYRSGKTLDEVKPEIAELAETYPEVKAFTDFFARSTRGLIR
Inhibitor
Name:
BDBM50577526
Synonyms:
CHEMBL4871671
Type:
Small organic molecule
Emp. Form.:
C20H20ClN5O2S
Mol. Mass.:
429.93
SMILES:
CNC(=O)CN(Cc1ccc(cc1)-n1cncn1)C(=O)CSc1ccccc1Cl
Structure:
