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TargetLeucine--tRNA ligase
LigandBDBM50241770
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1670423 (CHEMBL4020311)
IC50 240±n/a nM
Citation Li, XHernandez, VRock, FLChoi, WMak, YSLMohan, MMao, WZhou, YEasom, EEPlattner, JJZou, WPérez-Herrán, EGiordano, IMendoza-Losana, AAlemparte, CRullas, JAngulo-Barturen, ICrouch, SOrtega, FBarros, DAlley, MRK Discovery of a Potent and Specific M. tuberculosis Leucyl-tRNA Synthetase Inhibitor: (S)-3-(Aminomethyl)-4-chloro-7-(2-hydroxyethoxy)benzo[c][1,2]oxaborol-1(3H)-ol (GSK656). J Med Chem60:8011-8026 (2017) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Leucine--tRNA ligase
Name:Leucine--tRNA ligase
Synonyms:6.1.1.4 | LeuRS | Leucine--tRNA ligase | Leucyl-tRNA synthetase | SYL_MYCTU | leuS
Type:PROTEIN
Mol. Mass.:107566.69
Organism:Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:ChEMBL_117449
Residue:969
Sequence:
MTESPTAGPGGVPRADDADSDVPRYRYTAELAARLERTWQENWARLGTFNVPNPVGSLAP
PDGAAVPDDKLFVQDMFPYPSGEGLHVGHPLGYIATDVYARYFRMVGRNVLHALGFDAFG
LPAEQYAVQTGTHPRTRTEANVVNFRRQLGRLGFGHDSRRSFSTTDVDFYRWTQWIFLQI
YNAWFDTTANKARPISELVAEFESGARCLDGGRDWAKLTAGERADVIDEYRLVYRADSLV
NWCPGLGTVLANEEVTADGRSDRGNFPVFRKRLRQWMMRITAYADRLLDDLDVLDWPEQV
KTMQRNWIGRSTGAVALFSARAASDDGFEVDIEVFTTRPDTLFGATYLVLAPEHDLVDEL
VAASWPAGVNPLWTYGGGTPGEAIAAYRRAIAAKSDLERQESREKTGVFLGSYAINPANG
EPVPIFIADYVLAGYGTGAIMAVPGHDQRDWDFARAFGLPIVEVIAGGNISESAYTGDGI
LVNSDYLNGMSVPAAKRAIVDRLESAGRGRARIEFKLRDWLFARQRYWGEPFPIVYDSDG
RPHALDEAALPVELPDVPDYSPVLFDPDDADSEPSPPLAKATEWVHVDLDLGDGLKPYSR
DTNVMPQWAGSSWYELRYTDPHNSERFCAKENEAYWMGPRPAEHGPDDPGGVDLYVGGAE
HAVLHLLYSRFWHKVLYDLGHVSSREPYRRLVNQGYIQAYAYTDARGSYVPAEQVIERGD
RFVYPGPDGEVEVFQEFGKIGKSLKNSVSPDEICDAYGADTLRVYEMSMGPLEASRPWAT
KDVVGAYRFLQRVWRLVVDEHTGETRVADGVELDIDTLRALHRTIVGVSEDFAALRNNTA
TAKLIEYTNHLTKKHRDAVPRAAVEPLVQMLAPLAPHIAEELWLRLGNTTSLAHGPFPKA
DAAYLVDETVEYPVQVNGKVRGRVVVAADTDEETLKAAVLTDEKVQAFLAGATPRKVIVV
AGRLVNLVI
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  Blast E-value cutoff:
BDBM50241770
n/a
NameBDBM50241770
Synonyms:CHEMBL4061966
TypeSmall organic molecule
Emp. Form.C10H14BCl2NO4
Mol. Mass.293.939
SMILESCl.NCC1OB(O)c2c1c(Cl)ccc2OCCO
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: