Reaction Details |
![](/images/Email.png) | Report a problem with these data |
Target | Metallo-beta-lactamase type 2 |
---|
Ligand | BDBM50149467 |
---|
Substrate/Competitor | n/a |
---|
Meas. Tech. | ChEMBL_430087 (CHEMBL918108) |
---|
IC50 | 240±n/a nM |
---|
Citation | Venkatesan, AM; Gu, Y; Dos Santos, O; Abe, T; Agarwal, A; Yang, Y; Petersen, PJ; Weiss, WJ; Mansour, TS; Nukaga, M; Hujer, AM; Bonomo, RA; Knox, JR Structure-activity relationship of 6-methylidene penems bearing tricyclic heterocycles as broad-spectrum beta-lactamase inhibitors: crystallographic structures show unexpected binding of 1,4-thiazepine intermediates. J Med Chem47:6556-68 (2004) [PubMed] Article |
---|
More Info.: | Get all data from this article, Assay Method |
---|
|
Metallo-beta-lactamase type 2 |
---|
Name: | Metallo-beta-lactamase type 2 |
Synonyms: | BLAB_BACFG | Beta-lactamase type II | ccrA | cfiA |
Type: | PROTEIN |
Mol. Mass.: | 27252.87 |
Organism: | Bacteroides fragilis |
Description: | ChEMBL_1502123 |
Residue: | 249 |
Sequence: | MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVI
NNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYA
NQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGG
CMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVN
QYIESTSKP
|
|
|
BDBM50149467 |
---|
n/a |
---|
Name | BDBM50149467 |
Synonyms: | (5R,6Z)-6-(6,7-dihydro-5H-cyclopenta-[d]imidazo[2,1-b][1,3]thiazol-2-ylmethylene)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid sodium | CHEMBL122450 | Sodium; (R)-6-[1-(6,7-dihydro-5H-cyclopenta[d]imidazo[2,1-b]thiazol-2-yl)-meth-(Z)-ylidene]-7-oxo-4-thia-1-aza-bicyclo[3.2.0]hept-2-ene-2-carboxylate | sodium (R)-6-[1-(6,7-dihydro-5H-cyclopenta[d]imidazo[2,1-b]thiazol-2-yl)-meth-(Z)-ylidene]-7-oxo-4-thia-1-aza-bicyclo[3.2.0]hept-2-ene-2-carboxylate |
Type | Small organic molecule |
Emp. Form. | C15H10N3O3S2 |
Mol. Mass. | 344.389 |
SMILES | [O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cn2c3CCCc3sc2n1 |t:3| |
Structure |
|