Reaction Details |
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Target | Mycothiol S-conjugate amidase |
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Ligand | BDBM50117081 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_140808 |
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IC50 | 100000±n/a nM |
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Citation | Nicholas, GM; Eckman, LL; Ray, S; Hughes, RO; Pfefferkorn, JA; Barluenga, S; Nicolaou, KC; Bewley, CA Bromotyrosine-derived natural and synthetic products as inhibitors of mycothiol-S-conjugate amidase. Bioorg Med Chem Lett12:2487-90 (2002) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Mycothiol S-conjugate amidase |
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Name: | Mycothiol S-conjugate amidase |
Synonyms: | MCA_MYCTU | mca |
Type: | PROTEIN |
Mol. Mass.: | 32719.79 |
Organism: | Mycobacterium tuberculosis |
Description: | ChEMBL_626858 |
Residue: | 288 |
Sequence: | MSELRLMAVHAHPDDESSKGAATLARYADEGHRVLVVTLTGGERGEILNPAMDLPDVHGR
IAEIRRDEMTKAAEILGVEHTWLGFVDSGLPKGDLPPPLPDDCFARVPLEVSTEALVRVV
REFRPHVMTTYDENGGYPHPDHIRCHQVSVAAYEAAGDFCRFPDAGEPWTVSKLYYVHGF
LRERMQMLQDEFARHGQRGPFEQWLAYWDPDHDFLTSRVTTRVECSKYFSQRDDALRAHA
TQIDPNAEFFAAPLAWQERLWPTEEFELARSRIPARPPETELFAGIEP
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BDBM50117081 |
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n/a |
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Name | BDBM50117081 |
Synonyms: | (S)-7,9-Dibromo-8-methoxy-1-oxa-2-aza-spiro[4.5]deca-2,6,8-triene-3-carboxylic acid [2-(2-amino-3H-imidazol-4-yl)-ethyl]-amide | CHEMBL82521 |
Type | Small organic molecule |
Emp. Form. | C15H17Br2N5O3 |
Mol. Mass. | 475.135 |
SMILES | COC1=C(Br)C[C@@]2(CC(=NO2)C(=O)NCCc2cnc(N)[nH]2)C=C1Br |c:2,8,24| |
Structure |
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