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Target
Glutathionylspermidine synthase
Ligand
BDBM50060962
Substrate
n/a
Meas. Tech.
ChEMBL_72758 (CHEMBL682573)
Ki
6000±n/a nM
Citation
 Chen, S; Lin, CH; Kwon, DS; Walsh, CT; Coward, JK Design, synthesis, and biochemical evaluation of phosphonate and phosphonamidate analogs of glutathionylspermidine as inhibitors of glutathionylspermidine synthetase/amidase from Escherichia coli. J Med Chem 40:3842-50 (1997) [PubMed]  Article 
Target
Name:
Glutathionylspermidine synthase
Synonyms:
GSP | GSP_CRIFA
Type:
PROTEIN
Mol. Mass.:
80299.94
Organism:
Crithidia fasciculata
Description:
ChEMBL_72759
Residue:
719
Sequence:
MSSLPHNHHYETHHRGTAEVPFDELIGVTPDGVPVISNGNEAHFSNLESITAACLPLSSFERKAPCKQPYRKMGVKWQCVEFVRRYLASRKAVWMTSLCTAEEVWREENLFVDVRDGRPVEVVRTPNKSTGPAPAVADIVVWGEGPETPFGHVAIVTEVCASCVRVAEQNQGFEKWPEDVPFSREIAMRTTESGEVELLDEDPLLGWVTVQAPFYNFDDGDLADSFRLVVGQGQILRQPFPKHVDVPWLNTGEECDTILKHSLVVDGNMGEGAHAEEGDVPGAFYFLDYDMFCRLGRAASSLHRIAMAATAKVLEDPESTHLLEHYFGVPPEIQPLLRRSWEMTPPMGGRFDFGYDGKNVVMLEYNCDSSGALLECCNTQEKMARFYGVSQGTSTGSFLGAKCVTYFQRLLTNEKVCPQHRLIHFMIDEDDEERYTARCMMGFAEQAGFRTKLCVKLVNFRYRDGPPSNAAPLATPCDHPTIVDGEDEEVLMVWKTWSWDTVLHQYHSQRSSSDAVNTPTLSDILLNNNIRVLEPLWKAVTGSKAILPFMHALAPDHEHMLAASFLPTREIISRHYISKPVNGRAGQNIMMYDPVTSPTELEGAPQQDICEALSQNASARSLLNGSPLPLSQSVDQTNECSPGKFFDSVLVYQQRLFLKKFDGKYFPIFCGWMVGDEFGGVVVREDTSKITKLSSMVVPARVVRDNVPLGVSYSDEGET
  
Inhibitor
Name:
BDBM50060962
Synonyms:
2-Amino-4-[1-({[3-(4-amino-butylamino)-propoxy]-hydroxy-phosphorylmethyl}-carbamoyl)-ethylcarbamoyl]-butyric acid | Hydrogen O-[3-[N-(4-Aminobutyl)amino]propyl][[(glutamylalanyl) amino]methyl]phosphonate
Type:
Small organic molecule
Emp. Form.:
C16H35N5O7P
Mol. Mass.:
440.4516
SMILES:
C[C@H](NC(=O)CC[C@H]([NH3+])C([O-])=O)C(=O)NCP([O-])(=O)OCCC[NH2+]CCCC[NH3+]
Structure:
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