SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3toe'

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.	4LV9_B_20JB602_1 (NICOTINAMIDE PHOSPHORIBOSYLTRANSF ERASE)	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	4 / 7	VAL A 32 ILE A 59 ARG A 52 ILE A 56	None	0.90A	4lv9B-3toeA: undetectable	4lv9B-3toeA: 11.38
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.	5IGJ_A_CTYA402_1 (MACROLIDE 2'-PHOSPHOTRANSFERAS E)	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	5 / 12	ILE A 61 ASP A 46 VAL A 51 VAL A 21 GLY A 10	None	1.10A	5igjA-3toeA: undetectable	5igjA-3toeA: 15.67
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.	5N0S_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	5 / 12	ILE A 9 VAL A 6 VAL A 32 ILE A 41 ALA A 40	None	1.05A	5n0sA-3toeA: 2.8	5n0sA-3toeA: 12.01
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.	5N0S_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	5 / 12	ILE A 9 VAL A 6 VAL A 32 ILE A 41 ALA A 40	None	1.06A	5n0sB-3toeA: 2.5	5n0sB-3toeA: 12.01
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.	5N0W_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	5 / 12	ILE A 9 VAL A 6 VAL A 32 ILE A 41 ALA A 40	None	1.09A	5n0wB-3toeA: 2.9	5n0wB-3toeA: 12.01
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.	5N4I_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	5 / 12	ILE A 9 VAL A 6 VAL A 32 ILE A 41 ALA A 40	None	1.08A	5n4iA-3toeA: 2.9	5n4iA-3toeA: 12.01
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.	5YWM_X_NIOX403_0 (CASEIN KINASE II SUBUNIT ALPHA')	3toe	DNA/RNA-BINDING PROTEIN ALBA (Methanothermobac ter thermautotrophic us)	4 / 7	VAL A 32 VAL A 21 ILE A 56 ILE A 59	None	0.80A	5ywmX-3toeA: undetectable	5ywmX-3toeA: 21.43

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["4LV9_B_20JB602_1","NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",4,"VAL A  32;ILE A  59;ARG A  52;ILE A  56","None","0.90A","4lv9B-3toeA:undetectable","4lv9B-3toeA:11.38"],["5IGJ_A_CTYA402_1","MACROLIDE 2'-PHOSPHOTRANSFERASE","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",5,"ILE A  61;ASP A  46;VAL A  51;VAL A  21;GLY A  10","None","1.10A","5igjA-3toeA:undetectable","5igjA-3toeA:15.67"],["5N0S_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",5,"ILE A   9;VAL A   6;VAL A  32;ILE A  41;ALA A  40","None","1.05A","5n0sA-3toeA:2.8","5n0sA-3toeA:12.01"],["5N0S_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",5,"ILE A   9;VAL A   6;VAL A  32;ILE A  41;ALA A  40","None","1.06A","5n0sB-3toeA:2.5","5n0sB-3toeA:12.01"],["5N0W_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",5,"ILE A   9;VAL A   6;VAL A  32;ILE A  41;ALA A  40","None","1.09A","5n0wB-3toeA:2.9","5n0wB-3toeA:12.01"],["5N4I_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",5,"ILE A   9;VAL A   6;VAL A  32;ILE A  41;ALA A  40","None","1.08A","5n4iA-3toeA:2.9","5n4iA-3toeA:12.01"],["5YWM_X_NIOX403_0","CASEIN KINASE II SUBUNIT ALPHA'","3toe","DNA\/RNA-BINDING PROTEIN ALBA","Methanothermobacter thermautotrophicus",4,"VAL A  32;VAL A  21;ILE A  56;ILE A  59","None","0.80A","5ywmX-3toeA:undetectable","5ywmX-3toeA:21.43"]]