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Complex Zn1·22 possesses an unique three-dimensional tri-site binding feature.
The predicted tertiary structure of caspase-6 as well as the enzyme complexed with its inhibitor (tetra-peptide aldehyde Ac-IETD-CHO) shows similar binding feature as seen in other caspases.
Docking studies of the representative highly active 12b clearly showed that this molecule has an extra hydrophobic binding feature compared to prototype drug Losartan and it fits to the extra hydrophobic cavity.
This may occur, for example, if the overall shapes of the inhibitor binding sites are similar, but one of the kinases may lack one important binding feature.
The most conserved binding feature is the central hydrophobic core that is contributed by residues L1276, L1277, I1280 in the case of ATRX and residues L31, Y34, F35 in the case of Rassf1c (Fig. 2H).
Our work acknowledges the difference between service creation and service execution, and the approaches for semi-automated service creation presented here are mostly targeted to work offline, even though the actual subservices to be executed are only selected at execution time due to the late binding feature.
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But they exhibit different substrate binding features.
The structural and binding features of bpzo in all related compounds have also been discussed.
Herein, we report structure-guided engineering of the lipid binding features of GLTP.
Homology model of Leishmania SIR2 shed new light on the ligand binding features of this enzyme.
Moreover, the findings corroborate those by Taylor and colleagues38,39 who showed that the PRC is involved in binding features from multiple modalities.
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