Reaction Details Report a problem with these data
Target
Queuine tRNA-ribosyltransferase
Ligand
BDBM84655
Substrate
n/a
Meas. Tech.
Enzyme Assay
pH
7.3±0
Ki
1.5e+3± 4e+2 nM
Citation
 Ritschel, T; Hoertner, S; Heine, A; Diederich, F; Klebe, G Crystal structure analysis and in silico pKa calculations suggest strong pKa shifts of ligands as driving force for high-affinity binding to TGT. Chembiochem 10:716-27 (2009) [PubMed]  Article 
Target
Name:
Queuine tRNA-ribosyltransferase
Synonyms:
TGT_ZYMMO | tRNA-guanine transglycosylase | tRNA-guanine transglycosylase (TGT) | tgt
Type:
Protein
Mol. Mass.:
42844.19
Organism:
Zymomonas mobilis
Description:
P28720
Residue:
386
Sequence:
MVEATAQETDRPRFSFSIAAREGKARTGTIEMKRGVIRTPAFMPVGTAATVKALKPETVRATGADIILGNTYHLMLRPGAERIAKLGGLHSFMGWDRPILTDSGGYQVMSLSSLTKQSEEGVTFKSHLDGSRHMLSPERSIEIQHLLGSDIVMAFDECTPYPATPSRAASSMERSMRWAKRSRDAFDSRKEQAENAALFGIQQGSVFENLRQQSADALAEIGFDGYAVGGLAVGEGQDEMFRVLDFSVPMLPDDKPHYLMGVGKPDDIVGAVERGIDMFDCVLPTRSGRNGQAFTWDGPINIRNARFSEDLTPLDSECHCAVCQKWSRAYIHHLIRAGEILGAMLMTEHNIAFYQQLMQKIRDSISEGRFSQFAQDFRARYFARNS
  
Inhibitor
Name:
BDBM84655
Synonyms:
lin-benzoguanine scaffold, 4
Type:
Small organic molecule
Emp. Form.:
C10H9N5O
Mol. Mass.:
215.2114
SMILES:
Cc1nc2cc3nc(N)[nH]c(=O)c3cc2[nH]1
Structure:
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