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Compile Data Set for Download or QSAR

Found 1 hit of kd for drug = Cefoxitin   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
N-acetyltransferase domain-containing protein


(Pseudomonas aeruginosa)
BDBM50335563
PNG
((6R,7R)-3-(carbamoyloxymethyl)-7-methoxy-8-oxo-7-(...)
Show SMILES CO[C@]1(NC(=O)Cc2cccs2)[C@H]2SCC(COC(N)=O)=C(N2C1=O)C(O)=O |r,c:21|
Show InChI InChI=1S/C16H17N3O7S2/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22)/t14-,16+/m1/s1
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PDB
Article
PubMed
n/an/an/a 4.93E+4n/an/an/a7.525



University of Virginia



Assay Description
Isothermal titration calorimetry (ITC) measurements were performed at 25 °C using an iTC200 calorimeter (MicroCal). Preparations of purified pr...


J Biol Chem 288: 30223-35 (2013)


Article DOI: 10.1074/jbc.M113.501353
BindingDB Entry DOI: 10.7270/Q22N514W
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)