Reaction Details Report a problem with these data
Target
RNA-editing ligase 1, mitochondrial
Ligand
BDBM128199
Substrate
n/a
Meas. Tech.
Fluorescence-based biochemical high throughput dose response assay to identify inhibitors of Trypanosoma brucei RNA editing ligase 1 (TbREL1).
IC50
4099±n/a nM
Citation
 PubChem, PC Fluorescence-based biochemical high throughput dose response assay to identify inhibitors of Trypanosoma brucei RNA editing ligase 1 (TbREL1). PubChem Bioassay (2014)[AID] 
Target
Name:
RNA-editing ligase 1, mitochondrial
Synonyms:
REL1 | RLGM1_TRYBB | Trypanosoma brucei RNA editing ligase 1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
52299.36
Organism:
Trypanosoma brucei brucei
Description:
gi_342179211
Residue:
469
Sequence:
MQLQRLGAPLLKRLVGGCIRQSTAPIMPCVVVSGSGVFLTPVRTYMPLPNDQSDFSPYIEIDLPSESRIQSLHKSGLAAQEWVACEKVHGTNFGIYLINQGDHEVVRFAKRSGIMDPNENFFGYHILIDEFTAQIRILNDLLKQKYGLSRVGRLVLNGELFGAKYKHPLVPKSEKWCTLPNGKKFPIAGVQIQREPFPQYSPELHFFAFDIKYSVSGAEEDFVLLGYDEFVEFSSKVPNLLYARALVRGTLDECLAFDVENFMTPLPALLGLGNYPLEGNLAEGVVIRHVRRGDPAVEKHNVSTIIKLRCSSFMELKHPGKQKELKETFIDTVRSGALRRVRGNVTVISDSMLPQVEAAANDLLLNNVSDGRLSNVLSKIGREPLLSGEVSQVDVVLMLAKDALKDFLKEVDSLVLNTTLAFRKLLITNVYFESKRLVEQKWKELMQEEAAAQSEAIPPLSPAAPTKGE
  
Inhibitor
Name:
BDBM128199
Synonyms:
MLS004257393 | Rugulosin | SMR003082523 | cid_60160180
Type:
Small organic molecule
Emp. Form.:
C30H22O10
Mol. Mass.:
542.4897
SMILES:
[H][C@]12C(O)[C@]3([H])[C@@]4([H])C(O)[C@]([H])(C(=O)C5=C(O)c6c(O)cc(C)cc6C(=O)[C@]145)[C@@]31C(=O)c3cc(C)cc(O)c3C(O)=C1C2=O |wU:6.6,4.4,27.27,28.33,1.0,wD:10.10,c:14,46,TLB:29:28:8:27.14.12,25:27:4.28:8,15:14:4.28:8,THB:3:2:6.27:28.41.42,2:4:8:27.14.12,13:12:4.28:8,41:28:8:27.14.12,1:27:4.28:8,(5.36,1.48,;6.61,1.08,;7.08,-.39,;6.92,-1.92,;8.62,-.39,;9.47,.61,;9.1,1.08,;10.37,1.4,;9.97,-.18,;11.5,-.06,;9.31,-1.56,;10.29,-2.42,;6.67,-.21,;5.38,-1.04,;6.52,2.75,;6.52,4.29,;5.19,5.06,;7.85,5.06,;7.83,6.66,;6.49,7.42,;9.21,7.48,;10.6,6.67,;11.94,7.44,;10.59,5.07,;9.19,4.29,;9.19,2.75,;10.73,2.75,;7.85,1.98,;7.78,-1.66,;8.47,-3.09,;9.74,-3.96,;7.56,-4.39,;8.16,-5.76,;7.28,-6.97,;7.92,-8.37,;5.79,-6.84,;5.15,-5.49,;3.62,-5.38,;5.98,-4.25,;5.33,-2.8,;3.8,-2.65,;6.26,-1.52,;5.66,-.12,;4.14,.08,)|
Structure:
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