Target
NH(3)-dependent NAD(+) synthetase
Ligand
BDBM50130829
Substrate
n/a
Meas. Tech.
ChEMBL_141613 (CHEMBL747929)
IC50
>1000±n/a nM
Citation
 Velu, SECristofoli, WAGarcia, GJBrouillette, CGPierson, MCLuan, CHDeLucas, LJBrouillette, WJ Tethered dimers as NAD synthetase inhibitors with antibacterial activity. J Med Chem 46:3371-81 (2003) [PubMed]  Article 
Target
Name:
NH(3)-dependent NAD(+) synthetase
Synonyms:
GSP38 | General stress protein 38 | NADE_BACSU | Spore outgrowth factor B | Sporulation protein outB | nadE | outB
Type:
PROTEIN
Mol. Mass.:
30386.77
Organism:
Bacillus subtilis
Description:
ChEMBL_141613
Residue:
272
Sequence:
MSMQEKIMRELHVKPSIDPKQEIEDRVNFLKQYVKKTGAKGFVLGISGGQDSTLAGRLAQLAVESIREEGGDAQFIAVRLPHGTQQDEDDAQLALKFIKPDKSWKFDIKSTVSAFSDQYQQETGDQLTDFNKGNVKARTRMIAQYAIGGQEGLLVLGTDHAAEAVTGFFTKYGDGGADLLPLTGLTKRQGRTLLKELGAPERLYLKEPTADLLDEKPQQSDETELGISYDEIDDYLEGKEVSAKVSEALEKRYSMTEHKRQVPASMFDDWWK
  
Inhibitor
Name:
BDBM50130829
Synonyms:
CHEMBL1164 | Dimocillin sodium | Meticillin sodium | Meticillin sodium salt | methicillin sodium | sodium (2S,5R,6R)-6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | sodium 6beta-(2,6-dimethoxybenzamido)-2,2-dimethylpenam-3alpha-carboxylate | sodium 6beta-(2,6-dimethoxybenzamido)penicillanate
Type:
Small organic molecule
Emp. Form.:
C17H19N2O6S
Mol. Mass.:
379.408
SMILES:
COc1cccc(OC)c1C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C([O-])=O
Structure:
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