Reaction Details |
| Report a problem with these data |
Target | Adenosine 5'-phosphosulfate reductase |
---|
Ligand | BDBM25468 |
---|
Substrate/Competitor | BDBM25461 |
---|
Meas. Tech. | Determination of Dissociation Constant (Kd) |
---|
pH | 7.5±n/a |
---|
Temperature | 303.15±n/a K |
---|
Kd | 44590±n/a nM |
---|
Citation | Cosconati, S; Hong, JA; Novellino, E; Carroll, KS; Goodsell, DS; Olson, AJ Structure-based virtual screening and biological evaluation of Mycobacterium tuberculosis adenosine 5'-phosphosulfate reductase inhibitors. J Med Chem51:6627-30 (2008) [PubMed] Article |
---|
More Info.: | Get all data from this article, Solution Info, Assay Method |
---|
|
Adenosine 5'-phosphosulfate reductase |
---|
Name: | Adenosine 5'-phosphosulfate reductase |
Synonyms: | 3-phosphoadenylylsulfate reductase | Adenosine Phosphosulfate Reductase (APSR) | CYSH_MYCTO | PAPS reductase, thioredoxin dependent | PAPS sulfotransferase | PAdoPS reductase | cysH | phosphoadenosine phosphosulfate reductase |
Type: | Oxidoreductase |
Mol. Mass.: | 27417.08 |
Organism: | Mycobacterium tuberculosis |
Description: | Proteins were expressed by transforming a reductase-containing plasmid into E. coli cells. |
Residue: | 254 |
Sequence: | MSGETTRLTEPQLRELAARGAAELDGATATDMLRWTDETFGDIGGAGGGVSGHRGWTTCN
YVVASNMADAVLVDLAAKVRPGVPVIFLDTGYHFVETIGTRDAIESVYDVRVLNVTPEHT
VAEQDELLGKDLFARNPHECCRLRKVVPLGKTLRGYSAWVTGLRRVDAPTRANAPLVSFD
ETFKLVKVNPLAAWTDQDVQEYIADNDVLVNPLVREGYPSIGCAPCTAKPAEGADPRSGR
WQGLAKTECGLHAS
|
|
|
BDBM25468 |
---|
BDBM25461 |
---|
Name | BDBM25468 |
Synonyms: | 3,7-difluoro-2-nitro-9H-fluoren-9-one | NSC57476 |
Type | Small organic molecule |
Emp. Form. | C13H5F2NO3 |
Mol. Mass. | 261.1805 |
SMILES | [O-][N+](=O)c1cc2C(=O)c3cc(F)ccc3-c2cc1F |
Structure |
|