SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '0DN'

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.	1KI2_A_GA2A1_1 (THYMIDINE KINASE)	3uxm	THYMIDYLATE KINASE (Pseudomonas aeruginosa)	5 / 11	GLN A 105 MET A 70 ARG A 96 TYR A 104 ARG A 109	0DN A 800 (-3.0A) 0DN A 800 (-3.3A) 0DN A 800 (-4.6A) 0DN A 800 (-3.7A) None	1.40A	1ki2A-3uxmA: 9.8	1ki2A-3uxmA: 25.89
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.	1KI2_B_GA2B2_1 (THYMIDINE KINASE)	3uxm	THYMIDYLATE KINASE (Pseudomonas aeruginosa)	5 / 12	GLN A 105 MET A 70 ARG A 96 TYR A 104 ARG A 109	0DN A 800 (-3.0A) 0DN A 800 (-3.3A) 0DN A 800 (-4.6A) 0DN A 800 (-3.7A) None	1.42A	1ki2B-3uxmA: 10.3	1ki2B-3uxmA: 25.89
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.	1KI7_B_ID2B2_0 (THYMIDINE KINASE)	3uxm	THYMIDYLATE KINASE (Pseudomonas aeruginosa)	5 / 12	GLN A 105 MET A 70 ARG A 96 TYR A 104 ARG A 50	0DN A 800 (-3.0A) 0DN A 800 (-3.3A) 0DN A 800 (-4.6A) 0DN A 800 (-3.7A) 0DN A 800 (-3.4A)	1.36A	1ki7B-3uxmA: 10.8	1ki7B-3uxmA: 25.89
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.	2KI5_B_AC2B2_1 (PROTEIN (THYMIDINE KINASE))	3uxm	THYMIDYLATE KINASE (Pseudomonas aeruginosa)	5 / 12	GLN A 105 MET A 70 ARG A 96 TYR A 104 ARG A 109	0DN A 800 (-3.0A) 0DN A 800 (-3.3A) 0DN A 800 (-4.6A) 0DN A 800 (-3.7A) None	1.47A	2ki5B-3uxmA: 10.7	2ki5B-3uxmA: 25.89

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1KI2_A_GA2A1_1","THYMIDINE KINASE","3uxm","THYMIDYLATE KINASE","Pseudomonas aeruginosa",5,"GLN A 105;MET A  70;ARG A  96;TYR A 104;ARG A 109","0DN A 800 (-3.0A);0DN A 800 (-3.3A);0DN A 800 (-4.6A);0DN A 800 (-3.7A);None","1.40A","1ki2A-3uxmA:9.8",null],["1KI2_B_GA2B2_1","THYMIDINE KINASE","3uxm","THYMIDYLATE KINASE","Pseudomonas aeruginosa",5,"GLN A 105;MET A  70;ARG A  96;TYR A 104;ARG A 109","0DN A 800 (-3.0A);0DN A 800 (-3.3A);0DN A 800 (-4.6A);0DN A 800 (-3.7A);None","1.42A","1ki2B-3uxmA:10.3","1ki2A-3uxmA:25.89"],["1KI7_B_ID2B2_0","THYMIDINE KINASE","3uxm","THYMIDYLATE KINASE","Pseudomonas aeruginosa",5,"GLN A 105;MET A  70;ARG A  96;TYR A 104;ARG A  50","0DN A 800 (-3.0A);0DN A 800 (-3.3A);0DN A 800 (-4.6A);0DN A 800 (-3.7A);0DN A 800 (-3.4A)","1.36A","1ki7B-3uxmA:10.8","1ki2B-3uxmA:25.89"],["2KI5_B_AC2B2_1","PROTEIN (THYMIDINE KINASE)","3uxm","THYMIDYLATE KINASE","Pseudomonas aeruginosa",5,"GLN A 105;MET A  70;ARG A  96;TYR A 104;ARG A 109","0DN A 800 (-3.0A);0DN A 800 (-3.3A);0DN A 800 (-4.6A);0DN A 800 (-3.7A);None","1.47A","2ki5B-3uxmA:10.7","1ki7B-3uxmA:25.89"]]