Reaction Details |
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Target | Lactoylglutathione lyase |
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Ligand | BDBM50092826 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_71286 (CHEMBL684427) |
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Ki | 1200±n/a nM |
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Citation | Kalsi, A; Kavarana, MJ; Lu, T; Whalen, DL; Hamilton, DS; Creighton, DJ Role of hydrophobic interactions in binding S-(N-aryl/alkyl-N-hydroxycarbamoyl)glutathiones to the active site of the antitumor target enzyme glyoxalase I. J Med Chem43:3981-6 (2000) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Lactoylglutathione lyase |
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Name: | Lactoylglutathione lyase |
Synonyms: | Aldoketomutase | GLO1 | Glx I | Glyoxalase 1 (GLO1) | Glyoxalase I | Ketone-aldehyde mutase | LGUL_HUMAN | Methylglyoxalase | S-D-lactoylglutathione methylglyoxal lyase |
Type: | Enzyme |
Mol. Mass.: | 20772.95 |
Organism: | Homo sapiens (Human) |
Description: | Q04760 |
Residue: | 184 |
Sequence: | MAEPQPPSGGLTDEAALSCCSDADPSTKDFLLQQTMLRVKDPKKSLDFYTRVLGMTLIQK
CDFPIMKFSLYFLAYEDKNDIPKEKDEKIAWALSRKATLELTHNWGTEDDETQSYHNGNS
DPRGFGHIGIAVPDVYSACKRFEELGVKFVKKPDDGKMKGLAFIQDPDGYWIEILNPNKM
ATLM
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BDBM50092826 |
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n/a |
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Name | BDBM50092826 |
Synonyms: | (2S)-2-amino-5-{[(1R)-1-[({[(4-bromophenyl)(hydroxy)amino]carbonyl}thio)methyl]-2-(carboxyamino)-2-oxoethyl]amino}-5-oxopentanoic acid | (S)-2-amino-5-((R)-3-((4-bromophenyl)hydroxycarbamoylthio)-1-(carboxymethylamino)-1-oxopropan-2-ylamino)-5-oxopentanoic acid | CHEMBL128872 | S-(N-4bromophenyl-N-hydroxycarbamoyl)glutathione |
Type | Small organic molecule |
Emp. Form. | C17H21BrN4O8S |
Mol. Mass. | 521.34 |
SMILES | N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O |
Structure |
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