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TargetBeta-lactamase
LigandBDBM50191388
Substrate/Competitorn/a
Meas. Tech.ChEMBL_365445
IC50 5±n/a nM
Citation Venkatesan AMAgarwal AAbe TUshirogochi HYamamura IAdo MTsuyoshi TDos Santos OGu YSum FWLi ZFrancisco GLin YIPetersen PJYang YKumagai TWeiss WJShlaes DMKnox JRMansour TS Structure-activity relationship of 6-methylidene penems bearing 6,5 bicyclic heterocycles as broad-spectrum beta-lactamase inhibitors: evidence for 1,4-thiazepine intermediates with C7 R stereochemistry by computational methods. J Med Chem 49:4623-37 (2006) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Beta-lactamase
Name:Beta-lactamase
Synonyms:n/a
Type:PROTEIN
Mol. Mass.:41306.67
Organism:Enterobacter cloacae
Description:ChEMBL_40258
Residue:381
Sequence:
MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHY
YTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQ
WQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGA
LAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQA
YGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEA
NTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLA
NTSYPNPARVEAAYHILEALQ
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BDBM50191388
n/a
NameBDBM50191388
Synonyms:(5R)(6Z)-6-(6,7-5H-dihydropyrazolo[5,1-b]-oxazin-2-ylmethylene)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid sodium salt | CHEMBL377001
TypeSmall organic molecule
Emp. Form.C13H10N3O4S
Mol. Mass.304.302
SMILES[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2OCCCn2n1 |t:3|
Structure
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