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Target
Tyrosine--tRNA ligase
Ligand
BDBM50458121
Substrate
n/a
Meas. Tech.
ChEMBL_1762362 (CHEMBL4197609)
Ki
2.9±n/a nM
Citation
 Zhang, B; De Graef, S; Nautiyal, M; Pang, L; Gadakh, B; Froeyen, M; Van Mellaert, L; Strelkov, SV; Weeks, SD; Van Aerschot, A Family-wide analysis of aminoacyl-sulfamoyl-3-deazaadenosine analogues as inhibitors of aminoacyl-tRNA synthetases. Eur J Med Chem 148:384-396 (2018) [PubMed]  Article 
Target
Name:
Tyrosine--tRNA ligase
Synonyms:
6.1.1.1 | SYY_ECOLI | TyrRS | Tyrosine--tRNA ligase | Tyrosyl-tRNA synthetase | tyrS
Type:
PROTEIN
Mol. Mass.:
47522.37
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_117817
Residue:
424
Sequence:
MASSNLIKQLQERGLVAQVTDEEALAERLAQGPIALYCGFDPTADSLHLGHLVPLLCLKRFQQAGHKPVALVGGATGLIGDPSFKAAERKLNTEETVQEWVDKIRKQVAPFLDFDCGENSAIAANNYDWFGNMNVLTFLRDIGKHFSVNQMINKEAVKQRLNREDQGISFTEFSYNLLQGYDFACLNKQYGVVLQIGGSDQWGNITSGIDLTRRLHQNQVFGLTVPLITKADGTKFGKTEGGAVWLDPKKTSPYKFYQFWINTADADVYRFLKFFTFMSIEEINALEEEDKNSGKAPRAQYVLAEQVTRLVHGEEGLQAAKRITECLFSGSLSALSEADFEQLAQDGVPMVEMEKGADLMQALVDSELQPSRGQARKTIASNAITINGEKQSDPEYFFKEEDRLFGRFTLLRRGKKNYCLICWK
  
Inhibitor
Name:
BDBM50458121
Synonyms:
CHEMBL1163085
Type:
Small organic molecule
Emp. Form.:
C19H23N7O8S
Mol. Mass.:
509.493
SMILES:
N[C@@H](Cc1ccc(O)cc1)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
Structure:
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