The Gly-terminal residue of Atg8 is then bound to the active cysteine 507 of Atg7 and then activated by Atg7 (an E1-like enzyme).
The three clones studied showed inhibition of enzyme activity, suggesting that they bound to the active site and denied the access to the substrate.
First, we used a docking model of the irreversible inhibitor, Nafamostat, bound to the active site of HGFA in order to explore structure activity relationships (SAR).
Predicted binding poses of triclosan (in purple) bound to the active site of DHFRs.
The first X-ray crystal structures of prostasin with small molecule inhibitors bound to the active site are also reported.
An X-ray crystal structure of a representative member of the diphenyl ether sulfonamide series bound to the active site of caspase-1 was obtained.
An X-ray crystal structure of a representative member of this series bound to the active site of ICE, confirms the presence of the hydrogen bonding interaction.
We report a crystal structure of bacteriophage T7 primase that reveals its two domains and the presence of two Mg2+ ions bound to the active site.
Molecular docking studies showed that compound 4 bound to the active site pocket of the enzyme while compounds 15, 16, and 20 did not.
An X-ray co-crystal structure of the new inhibitor (Ki=45 nM) bound to the active site shows that the vinyl group occupies the same subsite as the amino group in GS-4071.
The X-ray crystallographic data of compound 12 bound to the active site of squalene synthase provided an important insight into the binding mode of this alternative template that formed 11-membered ring conformations with an intramolecular hydrogen bond.
