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TargetEpoxide Hydrolase B (EHB)
LigandBDBM25734
Substrate/CompetitorBDBM25726
Meas. Tech.Mtb EHB Inhibition Assay
pH7±n/a
Temperature303.15±n/a K
IC50 18500±n/a nM
Citation Biswal, BKMorisseau, CGaren, GCherney, MMGaren, CNiu, CHammock, BDJames, MN The molecular structure of epoxide hydrolase B from Mycobacterium tuberculosis and its complex with a urea-based inhibitor. J Mol Biol381:897-912 (2008) [PubMed]  Article
More Info.:Get all data from this article,  Inhibition_Run data,   Solution Info,  Assay Method
 
Epoxide Hydrolase B (EHB)
Name:Epoxide Hydrolase B (EHB)
Synonyms:Mtb EHB
Type:Enzyme
Mol. Mass.:39285.78
Organism:Mycobacterium tuberculosis
Description:The His6-tagged Mtb EHB was expressed in E. coli and purified.
Residue:356
Sequence:
MSQVHRILNCRGTRIHAVADSPPDQQGPLVVLLHGFPESWYSWRHQIPALAGAGYRVVAI
DQRGYGRSSKYRVQKAYRIKELVGDVVGVLDSYGAEQAFVVGHDWGAPVAWTFAWLHPDR
CAGVVGISVPFAGRGVIGLPGSPFGERRPSDYHLELAGPGRVWYQDYFAVQDGIITEIEE
DLRGWLLGLTYTVSGEGMMAATKAAVDAGVDLESMDPIDVIRAGPLCMAEGARLKDAFVY
PETMPAWFTEADLDFYTGEFERSGFGGPLSFYHNIDNDWHDLADQQGKPLTPPALFIGGQ
YDVGTIWGAQAIERAHEVMPNYRGTHMIADVGHWIQQEAPEETNRLLLDFLGGLRP
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BDBM25734
NameBDBM25734
Synonyms:4-[(adamantan-1-ylcarbamoyl)amino]butanoic acid | CHEMBL419810 | Urea-based compound, 15
TypeSmall organic molecule
Emp. Form.C15H24N2O3
Mol. Mass.280.3627
SMILESOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:17:12:19:16.15.18,17:16:12.13.11:19,THB:15:14:11:16.17.18,15:16:11:14.13.19|
Structure
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BDBM25726
NameBDBM25726
Synonyms:2-(6-methoxynaphthalen-2-yl)-2-({[(3-phenyloxiran-2-yl)methoxy]carbonyl}oxy)acetonitrile | alpha-cyanocarbonate epoxide | cyano(6-methoxy-naphthalen-2-yl)methyl trans-[(3-phenyloxiran-2-yl)methyl] carbonate
TypeSmall organic molecule
Emp. Form.C23H19NO5
Mol. Mass.389.4007
SMILESCOc1ccc2cc(ccc2c1)C(OC(=O)OCC1OC1c1ccccc1)C#N
Structure
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