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TargetInosine Monophosphate Dehydrogenase Type 1 (IMPDH1)
LigandBDBM50263242
Substrate/Competitorn/a
Meas. Tech.ChEMBL_490551
IC50 23600±n/a nM
Citation Chen, LPetrelli, ROlesiak, MWilson, DJLabello, NPPankiewicz, KW Bis(sulfonamide) isosters of mycophenolic adenine dinucleotide analogues: inhibition of inosine monophosphate dehydrogenase. Bioorg Med Chem16:7462-9 (2008) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Inosine Monophosphate Dehydrogenase Type 1 (IMPDH1)
Name:Inosine-5'-monophosphate dehydrogenase (IMPDH)
Synonyms:IMP dehydrogenase 1 | IMPD 1 | IMPDH-I | Inosine-5''-monophosphate dehydrogenase 1
Type:Enzyme
Mol. Mass.:55407.70
Organism:Homo sapiens (Human)
Description:Recombinant IMPDH1 expressed in E. coli.
Residue:514
Sequence:
MADYLISGGTGYVPEDGLTAQQLFASADGLTYNDFLILPGFIDFIADEVDLTSALTRKIT
LKTPLISSPMDTVTEADMAIAMALMGGIGFIHHNCTPEFQANEVRKVKKFEQGFITDPVV
LSPSHTVGDVLEAKMRHGFSGIPITETGTMGSKLVGIVTSRDIDFLAEKDHTTLLSEVMT
PRIELVVAPAGVTLKEANEILQRSKKGKLPIVNDCDELVAIIARTDLKKNRDYPLASKDS
QKQLLCGAAVGTREDDKYRLDLLTQAGVDVIVLDSSQGNSVYQIAMVHYIKQKYPHLQVI
GGNVVTAAQAKNLIDAGVDGLRVGMGCGSICITQEVMACGRPQGTAVYKVAEYARRFGVP
IIADGGIQTVGHVVKALALGASTVMMGSLLAATTEAPGEYFFSDGVRLKKYRGMGSLDAM
EKSSSSQKRYFSEGDKVKIAQGVSGSIQDKGSIQKFVPYLIAGIQHGCQDIGARSLSVLR
SMMYSGELKFEKRTMSAQIEGGVHGLHSYEKRLY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50263242
NameBDBM50263242
Synonyms:2-{(2R,3R,4S,5R)-5-[({[(2R,3S,4R,5R)-5-(6-Amino-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-ylmethyl]-sulfamoyl}-methanesulfonylamino)-methyl]-3,4-dihydroxy-tetrahydro-furan-2-yl}-thiazole-4-carboxylic acid amide | CHEMBL508103
TypeSmall organic molecule
Emp. Form.C20H27N9O11S3
Mol. Mass.665.677
SMILESNC(=O)c1csc(n1)[C@@H]1O[C@H](CNS(=O)(=O)CS(=O)(=O)NC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O |r|
Structure
n/a