| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Pantothenate synthetase |
|---|
| Ligand | BDBM41555 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | Mycobacterium tuberculosis Pantothenate Synthetase Secondary Assay |
|---|
| IC50 | 0.274±n/a nM |
|---|
| Citation |  PubChem, PC Mycobacterium tuberculosis Pantothenate Synthetase Secondary Assay PubChem Bioassay(2007)[AID] |
|---|
| More Info.: | Get all data from this article, Solution Info, Assay Method |
|---|
| |
| Pantothenate synthetase |
|---|
| 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
|
|
|
|---|
| BDBM41555 |
|---|
| n/a |
|---|
| Name | BDBM41555 |
|---|
| Synonyms: | 5-tert-butyl-N-[1-[2-(trifluoromethyl)benzyl]pyrazol-4-yl]-4,5,6,7-tetrahydroindoxazene-3-carboxamide | 5-tert-butyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide | 5-tert-butyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide | AB00538135 | cid_16740891 |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C23H25F3N4O2 |
|---|
| Mol. Mass. | 446.4654 |
|---|
| SMILES | CC(C)(C)C1CCc2onc(C(=O)Nc3cnn(Cc4ccccc4C(F)(F)F)c3)c2C1 |
|---|
| Structure | 
|
|---|
Search and Browse
