Reaction Details Report a problem with these data
Target
Multidrug resistance protein MdtK
Ligand
BDBM50336500
Substrate
n/a
Meas. Tech.
ChEMBL_720700 (CHEMBL1681167)
Kd
3000±n/a nM
Citation
 Long, F; Rouquette-Loughlin, C; Shafer, WM; Yu, EW Functional cloning and characterization of the multidrug efflux pumps NorM from Neisseria gonorrhoeae and YdhE from Escherichia coli. Antimicrob Agents Chemother 52:3052-60 (2008) [PubMed]  Article 
Target
Name:
Multidrug resistance protein MdtK
Synonyms:
MDTK_ECOLI | Multidrug-efflux transporter | mdtK | norE | norM | ydhE
Type:
PROTEIN
Mol. Mass.:
49460.10
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_720698
Residue:
457
Sequence:
MQKYISEARLLLALAIPVILAQIAQTAMGFVDTVMAGGYSATDMAAVAIGTSIWLPAILFGHGLLLALTPVIAQLNGSGRRERIAHQVRQGFWLAGFVSVLIMLVLWNAGYIIRSMENIDPALADKAVGYLRALLWGAPGYLFFQVARNQCEGLAKTKPGMVMGFIGLLVNIPVNYIFIYGHFGMPELGGVGCGVATAAVYWVMFLAMVSYIKRARSMRDIRNEKGTAKPDPAVMKRLIQLGLPIALALFFEVTLFAVVALLVSPLGIVDVAGHQIALNFSSLMFVLPMSLAAAVTIRVGYRLGQGSTLDAQTAARTGLMVGVCMATLTAIFTVSLREQIALLYNDNPEVVTLAAHLMLLAAVYQISDSIQVIGSGILRGYKDTRSIFYITFTAYWVLGLPSGYILALTDLVVEPMGPAGFWIGFIIGLTSAAIMMMLRMRFLQRLPSAIILQRASR
  
Inhibitor
Name:
BDBM50336500
Synonyms:
(E)-N-(9-(2-(ethoxycarbonyl)phenyl)-6-(ethylamino)-2,7-dimethyl-3H-xanthen-3-ylidene)ethanaminium chloride | CHEMBL402140 | [9-(2-ethoxycarbonyl-phenyl)-6-ethylamino-2,7-dimethyl-xanthen-(3E)-ylidene]-ethyl-ammonium; chloride | rhodamine 6G
Type:
Small organic molecule
Emp. Form.:
C28H30N2O3
Mol. Mass.:
442.5494
SMILES:
CCNc1cc2oc3c\c(=N/CC)c(C)cc3c(-c3ccccc3C(=O)OCC)c2cc1C |(-6.01,-19.07,;-4.68,-18.3,;-3.35,-19.07,;-2.01,-18.31,;-.68,-19.08,;.65,-18.3,;1.98,-19.07,;3.32,-18.3,;4.65,-19.07,;5.99,-18.3,;7.32,-19.07,;7.32,-20.61,;8.66,-21.38,;5.98,-16.75,;7.31,-15.98,;4.65,-15.99,;3.33,-16.76,;1.99,-15.98,;1.99,-14.45,;.66,-13.68,;.65,-12.15,;1.99,-11.37,;3.33,-12.14,;3.33,-13.68,;4.66,-14.45,;4.2,-15.5,;6.2,-14.46,;6.98,-13.13,;8.52,-13.14,;.65,-16.75,;-.68,-15.99,;-2.01,-16.76,;-3.34,-15.99,)|
Structure:
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