SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '0ET'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)

Filter list by:

	DrReposER ID / Desc.	Hit PDBID	Hit Macromolecule	Res. Matches	Interface	HETATM	RMSD	Dali Z-score	Seq. Identity (%)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	2IEN_B_017B402_2 (PROTEASE)	4gah	THIOESTERASE SUPERFAMILY MEMBER 4 (Homo sapiens)	5 / 12	GLY A 154 ALA A 157 ASP A 161 ILE A 188 ILE A 182	None None 0ET A 301 (-3.6A) None None	0.96A	2ienB-4gahA: undetectable	2ienB-4gahA: 19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3MWS_B_017B201_1 (HIV-1 PROTEASE)	4gah	THIOESTERASE SUPERFAMILY MEMBER 4 (Homo sapiens)	5 / 12	GLY A 154 ALA A 157 ASP A 161 ILE A 188 ILE A 182	None None 0ET A 301 (-3.6A) None None	0.98A	3mwsA-4gahA: undetectable	3mwsA-4gahA: 18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	4NJV_A_RITA500_1 (PROTEASE)	4gah	THIOESTERASE SUPERFAMILY MEMBER 4 (Homo sapiens)	5 / 12	GLY A 154 ALA A 157 ASP A 161 ILE A 188 ILE A 182	None None 0ET A 301 (-3.6A) None None	1.03A	4njvA-4gahA: undetectable	4njvA-4gahA: 17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	4NJV_D_RITD500_2 (PROTEASE)	4gah	THIOESTERASE SUPERFAMILY MEMBER 4 (Homo sapiens)	5 / 12	GLY A 154 ALA A 157 ASP A 161 ILE A 188 ILE A 182	None None 0ET A 301 (-3.6A) None None	1.07A	4njvD-4gahA: undetectable	4njvD-4gahA: 17.86

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2IEN_B_017B402_2","PROTEASE","4gah","THIOESTERASE SUPERFAMILY MEMBER 4","Homo sapiens",5,"GLY A 154;ALA A 157;ASP A 161;ILE A 188;ILE A 182","None;None;0ET A 301 (-3.6A);None;None","0.96A","2ienB-4gahA:undetectable",null],["3MWS_B_017B201_1","HIV-1 PROTEASE;HIV-1 PROTEASE","4gah","THIOESTERASE SUPERFAMILY MEMBER 4","Homo sapiens",5,"GLY A 154;ALA A 157;ASP A 161;ILE A 188;ILE A 182","None;None;0ET A 301 (-3.6A);None;None","0.98A","3mwsA-4gahA:undetectable","2ienB-4gahA:19.19"],["4NJV_A_RITA500_1","PROTEASE","4gah","THIOESTERASE SUPERFAMILY MEMBER 4","Homo sapiens",5,"GLY A 154;ALA A 157;ASP A 161;ILE A 188;ILE A 182","None;None;0ET A 301 (-3.6A);None;None","1.03A","4njvA-4gahA:undetectable","3mwsA-4gahA:18.18"],["4NJV_D_RITD500_2","PROTEASE","4gah","THIOESTERASE SUPERFAMILY MEMBER 4","Homo sapiens",5,"GLY A 154;ALA A 157;ASP A 161;ILE A 188;ILE A 182","None;None;0ET A 301 (-3.6A);None;None","1.07A","4njvD-4gahA:undetectable","4njvA-4gahA:17.86"]]