SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4kr8'

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)

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	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.	1TD2_A_PXLA288_1 (PYRIDOXAMINE KINASE)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	5 / 10	ALA A 334 THR A 25 GLN A 332 TYR A 312 ASP A 311	None	1.38A	1td2A-4kr8A: undetectable	1td2A-4kr8A: 22.43
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.	1TSN_A_C2FA266_0 (THYMIDYLATE SYNTHASE)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	5 / 12	TRP A 23 GLY A 19 TYR A 112 VAL A 335 ALA A 334	None	1.12A	1tsnA-4kr8A: undetectable	1tsnA-4kr8A: 23.46
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.	3BWM_A_SAMA301_1 (CATECHOL O-METHYLTRANSFERASE)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	3 / 3	SER A 73 GLU A 69 ASP A 64	None	0.87A	3bwmA-4kr8A: undetectable	3bwmA-4kr8A: 20.00
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.	3BWY_A_SAMA301_1 (COMT PROTEIN)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	3 / 3	SER A 73 GLU A 69 ASP A 64	None	0.79A	3bwyA-4kr8A: undetectable	3bwyA-4kr8A: 20.00
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.	3SUG_A_SUEA1201_2 (NS3 PROTEASE, NS4A PROTEIN)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	4 / 5	PHE A 54 TYR A 93 LEU A 11 LYS A 42	None	1.43A	3sugA-4kr8A: undetectable	3sugA-4kr8A: 22.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4KR4_C_AICC401_1 (OUTER MEMBRANE PROTEIN F)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	4 / 8	LYS A 16 ARG A 77 ASP A 108 GLU A 116	None	1.42A	4kr4C-4kr8A: 45.2	4kr4C-4kr8A: 100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4KR4_C_AICC401_1 (OUTER MEMBRANE PROTEIN F)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	7 / 8	LYS A 16 TYR A 36 ARG A 60 ARG A 77 ASP A 108 GLU A 116 ARG A 130	None	0.80A	4kr4C-4kr8A: 45.2	4kr4C-4kr8A: 100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4KRA_C_CPFC401_1 (OUTER MEMBRANE PROTEIN F)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	7 / 9	TYR A 36 ARG A 60 TYR A 112 GLU A 116 GLY A 120 THR A 123 ARG A 130	None	0.90A	4kraC-4kr8A: 46.3	4kraC-4kr8A: 100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4KRA_C_CPFC401_1 (OUTER MEMBRANE PROTEIN F)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	7 / 9	TYR A 36 ARG A 77 TYR A 112 GLU A 116 GLY A 120 THR A 123 ARG A 130	None	0.64A	4kraC-4kr8A: 46.3	4kraC-4kr8A: 100.00
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.	4XUD_A_SAMA303_1 (CATECHOL O-METHYLTRANSFERASE)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	3 / 3	SER A 73 GLU A 69 ASP A 64	None	0.86A	4xudA-4kr8A: undetectable	4xudA-4kr8A: 20.00
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.	5N5D_A_SAMA306_0 (METHYLTRANSFERASE)	4kr8	OUTER MEMBRANE PROTEIN F (Salmonella enterica)	5 / 12	ALA A 17 GLY A 336 TYR A 339 ALA A 334 TYR A 112	None	1.19A	5n5dA-4kr8A: undetectable	5n5dA-4kr8A: 23.21

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1TD2_A_PXLA288_1","PYRIDOXAMINE KINASE","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",5,"ALA A 334;THR A  25;GLN A 332;TYR A 312;ASP A 311","None","1.38A","1td2A-4kr8A:undetectable","1td2A-4kr8A:22.43"],["1TSN_A_C2FA266_0","THYMIDYLATE SYNTHASE","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",5,"TRP A  23;GLY A  19;TYR A 112;VAL A 335;ALA A 334","None","1.12A","1tsnA-4kr8A:undetectable","1tsnA-4kr8A:23.46"],["3BWM_A_SAMA301_1","CATECHOL O-METHYLTRANSFERASE","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",3,"SER A  73;GLU A  69;ASP A  64","None","0.87A","3bwmA-4kr8A:undetectable","3bwmA-4kr8A:20.00"],["3BWY_A_SAMA301_1","COMT PROTEIN","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",3,"SER A  73;GLU A  69;ASP A  64","None","0.79A","3bwyA-4kr8A:undetectable","3bwyA-4kr8A:20.00"],["3SUG_A_SUEA1201_2","NS3 PROTEASE, NS4A PROTEIN","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",4,"PHE A  54;TYR A  93;LEU A  11;LYS A  42","None","1.43A","3sugA-4kr8A:undetectable","3sugA-4kr8A:22.36"],["4KR4_C_AICC401_1","OUTER MEMBRANE PROTEIN F","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",4,"LYS A  16;ARG A  77;ASP A 108;GLU A 116","None","1.42A","4kr4C-4kr8A:45.2","4kr4C-4kr8A:100.00"],["4KR4_C_AICC401_1","OUTER MEMBRANE PROTEIN F","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",7,"LYS A  16;TYR A  36;ARG A  60;ARG A  77;ASP A 108;GLU A 116;ARG A 130","None","0.80A","4kr4C-4kr8A:45.2","4kr4C-4kr8A:100.00"],["4KRA_C_CPFC401_1","OUTER MEMBRANE PROTEIN F","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",7,"TYR A  36;ARG A  60;TYR A 112;GLU A 116;GLY A 120;THR A 123;ARG A 130","None","0.90A","4kraC-4kr8A:46.3","4kraC-4kr8A:100.00"],["4KRA_C_CPFC401_1","OUTER MEMBRANE PROTEIN F","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",7,"TYR A  36;ARG A  77;TYR A 112;GLU A 116;GLY A 120;THR A 123;ARG A 130","None","0.64A","4kraC-4kr8A:46.3","4kraC-4kr8A:100.00"],["4XUD_A_SAMA303_1","CATECHOL O-METHYLTRANSFERASE","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",3,"SER A  73;GLU A  69;ASP A  64","None","0.86A","4xudA-4kr8A:undetectable","4xudA-4kr8A:20.00"],["5N5D_A_SAMA306_0","METHYLTRANSFERASE","4kr8","OUTER MEMBRANE PROTEIN F","Salmonella enterica",5,"ALA A  17;GLY A 336;TYR A 339;ALA A 334;TYR A 112","None","1.19A","5n5dA-4kr8A:undetectable","5n5dA-4kr8A:23.21"]]