Protein Variants | Comment | Organism |
---|---|---|
H447I | inhibitor TFK+ binding to the H447I mutant proceeds with a different reaction mechanism from the wild-type enzyme. A water molecule takes over the role of His447 and participates in the bond breaking and forming as a charge relayer. Unlike in the wild-type mAChE case, Glu334, a conserved residue from the catalytic triad, acts as a catalytic base in the reaction | Mus musculus |
Inhibitors | Comment | Organism | Structure |
---|---|---|---|
TFK+ | analysis of the inhibition mechanism by ab initio quantum mechanical/molecular mechanical approach and classical molecular dynamics simulations, overview | Mus musculus | |
TFK0 | analysis of the inhibition mechanism by ab initio quantum mechanical/molecular mechanical approach and classical molecular dynamics simulations, overview | Mus musculus |
Organism | UniProt | Comment | Textmining |
---|---|---|---|
Mus musculus | P21836 | - |
- |
Ki Value [mM] | Ki Value maximum [mM] | Inhibitor | Comment | Organism | Structure |
---|---|---|---|---|---|
additional information | - |
additional information | inhibition kinetics of wild-type and knockout mutant enzyme | Mus musculus |