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Target
Disulfide bond formation protein B
Ligand
BDBM42347
Substrate
n/a
Meas. Tech.
Biochemical Assay
pH
6.2±0
Temperature
303.15±0 K
IC50
1.68e+5±n/a nM
Citation
 Früh, V; Zhou, Y; Chen, D; Loch, C; Ab, E; Grinkova, YN; Verheij, H; Sligar, SG; Bushweller, JH; Siegal, G Application of fragment-based drug discovery to membrane proteins: identification of ligands of the integral membrane enzyme DsbB. Chem Biol 17:881-91 (2010) [PubMed]  Article 
Target
Name:
Disulfide bond formation protein B
Synonyms:
DSBB_ECOLI | Disulfide bond formation protein B (DsbB) | Disulfide oxidoreductase | dsbB | roxB | ycgA
Type:
Protein
Mol. Mass.:
20147.01
Organism:
Escherichia coli
Description:
P0A6M2
Residue:
176
Sequence:
MLRFLNQCSQGRGAWLLMAFTALALELTALWFQHVMLLKPCVLCIYERCALFGVLGAALIGAIAPKTPLRYVAMVIWLYSAFRGVQLTYEHTMLQLYPSPFATCDFMVRFPEWLPLDKWVPQVFVASGDCAERQWDFLGLEMPQWLLGIFIAYLIVAVLVVISQPFKAKKRDLFGR
  
Inhibitor
Name:
BDBM42347
Synonyms:
(2,2-dimethyl-4-oxo-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl)acetic acid | 2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)ethanoic acid | 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetic acid | 2-(4-keto-2,2-dimethyl-3H-1,5-benzothiazepin-5-yl)acetic acid | MLS000045978 | SMR000031587 | cid_2728645
Type:
Small organic molecule
Emp. Form.:
C13H15NO3S
Mol. Mass.:
265.328
SMILES:
CC1(C)CC(=O)N(CC(O)=O)c2ccccc2S1
Structure:
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