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Target3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase
LigandBDBM50340474
Substrate/Competitorn/a
Meas. Tech.ChEMBL_741233 (CHEMBL1764602)
IC50>400000±n/a nM
Citation Thomas, STYang, XSampson, NS Inhibition of the M. tuberculosis 3β-hydroxysteroid dehydrogenase by azasteroids. Bioorg Med Chem Lett21:2216-9 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase
Name:3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase
Synonyms:3BHS_MYCTU
Type:PROTEIN
Mol. Mass.:40743.62
Organism:Mycobacterium tuberculosis
Description:ChEMBL_741233
Residue:370
Sequence:
MLRRMGDASLTTELGRVLVTGGAGFVGANLVTTLLDRGHWVRSFDRAPSLLPAHPQLEVL
QGDITDADVCAAAVDGIDTIFHTAAIIELMGGASVTDEYRQRSFAVNVGGTENLLHAGQR
AGVQRFVYTSSNSVVMGGQNIAGGDETLPYTDRFNDLYTETKVVAERFVLAQNGVDGMLT
CAIRPSGIWGNGDQTMFRKLFESVLKGHVKVLVGRKSARLDNSYVHNLIHGFILAAAHLV
PDGTAPGQAYFINDAEPINMFEFARPVLEACGQRWPKMRISGPAVRWVMTGWQRLHFRFG
FPAPLLEPLAVERLYLDNYFSIAKARRDLGYEPLFTTQQALTECLPYYVSLFEQMKNEAR
AEKTAATVKP
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  Blast E-value cutoff:
BDBM50340474
n/a
NameBDBM50340474
Synonyms:(1S,3aS,3bS,9aR,9bS,11aS)-N,N-diethyl-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-cyclopenta[i]phenanthridine-1-carboxamide | CHEMBL1762031
TypeSmall organic molecule
Emp. Form.C24H38N2O2
Mol. Mass.386.5707
SMILESCCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN=C4C(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
Structure
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