Reaction Details |
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Target | Pantothenate synthetase |
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Ligand | BDBM41554 |
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Substrate/Competitor | n/a |
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Meas. Tech. | Mycobacterium tuberculosis Pantothenate Synthetase Secondary Assay |
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IC50 | 0.128±n/a nM |
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Citation | PubChem, PC Mycobacterium tuberculosis Pantothenate Synthetase Secondary Assay PubChem Bioassay(2007)[AID] |
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More Info.: | Get all data from this article, Solution Info, Assay Method |
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Pantothenate synthetase |
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Name: | Pantothenate synthetase |
Synonyms: | Chain A, Crystal Structure Of A Pantothenate Synthetase, Apo Enzyme In C2 Space Group | PANC_MYCTU | Pantothenate synthetase | panC |
Type: | n/a |
Mol. Mass.: | 32675.10 |
Organism: | Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) |
Description: | ChEMBL_102878 |
Residue: | 309 |
Sequence: | MTIPAFHPGELNVYSAPGDVADVSRALRLTGRRVMLVPTMGALHEGHLALVRAAKRVPGS
VVVVSIFVNPMQFGAGEDLDAYPRTPDDDLAQLRAEGVEIAFTPTTAAMYPDGLRTTVQP
GPLAAELEGGPRPTHFAGVLTVVLKLLQIVRPDRVFFGEKDYQQLVLIRQLVADFNLDVA
VVGVPTVREADGLAMSSRNRYLDPAQRAAAVALSAALTAAAHAATAGAQAALDAARAVLD
AAPGVAVDYLELRDIGLGPMPLNGSGRLLVAARLGTTRLLDNIAIEIGTFAGTDRPDGYR
AILESHWRN
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BDBM41554 |
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n/a |
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Name | BDBM41554 |
Synonyms: | 5-tert-butyl-N-[1-(2,4-difluorobenzyl)pyrazol-4-yl]-4,5,6,7-tetrahydroindoxazene-3-carboxamide | 5-tert-butyl-N-[1-[(2,4-difluorophenyl)methyl]-4-pyrazolyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide | 5-tert-butyl-N-[1-[(2,4-difluorophenyl)methyl]pyrazol-4-yl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide | AB00538134 | N-[1-[[2,4-bis(fluoranyl)phenyl]methyl]pyrazol-4-yl]-5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide | cid_16740890 |
Type | Small organic molecule |
Emp. Form. | C22H24F2N4O2 |
Mol. Mass. | 414.4484 |
SMILES | CC(C)(C)C1CCc2onc(C(=O)Nc3cnn(Cc4ccc(F)cc4F)c3)c2C1 |
Structure |
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