Reaction Details Report a problem with these data
Target
Thiamine-binding periplasmic protein
Ligand
BDBM92962
Substrate
n/a
Meas. Tech.
Titration Assay
Kd
7.4±0.7 nM
Citation
 Soriano, EV; Rajashankar, KR; Hanes, JW; Bale, S; Begley, TP; Ealick, SE Structural similarities between thiamin-binding protein and thiaminase-I suggest a common ancestor. Biochemistry 47:1346-57 (2008) [PubMed]  Article 
Target
Name:
Thiamine-binding periplasmic protein
Synonyms:
THIB_ECOLI | tbpA | thiB | yabL
Type:
Protein
Mol. Mass.:
36163.97
Organism:
Escherichia coli (strain K12)
Description:
P31550
Residue:
327
Sequence:
MLKKCLPLLLLCTAPVFAKPVLTVYTYDSFAADWGPGPVVKKAFEADCNCELKLVALEDGVSLLNRLRMEGKNSKADVVLGLDNNLLDAASKTGLFAKSGVAADAVNVPGGWNNDTFVPFDYGYFAFVYDKNKLKNPPQSLKELVESDQNWRVIYQDPRTSTPGLGLLLWMQKVYGDDAPQAWQKLAKKTVTVTKGWSEAYGLFLKGESDLVLSYTTSPAYHILEEKKDNYAAANFSEGHYLQVEVAARTAASKQPELAQKFLQFMVSPAFQNAIPTGNWMYPVANVTLPAGFEKLTKPATTLEFTPAEVAAQRQAWISEWQRAVSR
  
Inhibitor
Name:
BDBM92962
Synonyms:
ThDP
Type:
Small molecule
Emp. Form.:
C12H19N4O7P2S
Mol. Mass.:
425.314
SMILES:
Cc1c(CCOP(O)(=O)OP(O)(O)=O)sc[n+]1Cc1cnc(C)nc1N
Structure:
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