SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4h54'

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 (%)	View	Dock
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.	1CEA_A_ACAA90_1 (PLASMINOGEN)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	4 / 8	ASP A 65 ASP A 67 TYR A 120 TYR A 123	None	1.16A	1ceaA-4h54A: undetectable 1ceaB-4h54A: undetectable	1ceaA-4h54A: 12.29 1ceaB-4h54A: 12.29
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.	1CEA_B_ACAB90_1 (PLASMINOGEN)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	4 / 7	ASP A 65 ASP A 67 TYR A 120 TYR A 123	None	1.22A	1ceaB-4h54A: undetectable	1ceaB-4h54A: 12.29
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.	1CEB_B_AMHB90_1 (PLASMINOGEN)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	4 / 7	ASP A 65 ASP A 67 TYR A 120 TYR A 123	None	1.16A	1cebB-4h54A: undetectable	1cebB-4h54A: 12.29
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.	1DMA_B_NCAB700_0 (EXOTOXIN A)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	4 / 6	GLY A 267 TYR A 274 ALA A 272 GLU A 275	None	0.96A	1dmaB-4h54A: undetectable	1dmaB-4h54A: 21.25
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.	3K13_A_THHA642_1 (5-METHYLTETRAHYDROFO LATE-HOMOCYSTEINE METHYLTRANSFERASE)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	3 / 3	ASN A 173 ASP A 182 ARG A 140	GAV A 402 (-3.1A) GAV A 402 (-3.5A) None	0.78A	3k13A-4h54A: undetectable	3k13A-4h54A: 21.57
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.	5ZRD_A_CUA607_0 (TYROSINASE)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	3 / 3	HIS A 79 HIS A 83 HIS A 22	ZN A 401 (-3.5A) ZN A 401 (-3.2A) ZN A 401 (-3.3A)	0.35A	5zrdA-4h54A: undetectable	5zrdA-4h54A: 19.67
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.	5ZRD_B_CUB606_0 (TYROSINASE)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	4 / 5	HIS A 22 PHE A 113 HIS A 83 HIS A 79	ZN A 401 (-3.3A) None ZN A 401 (-3.2A) ZN A 401 (-3.5A)	1.05A	5zrdB-4h54A: undetectable	5zrdB-4h54A: 19.67
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.	6FGD_A_ACTA819_0 (GEPHYRIN)	4h54	DIGUANYLATE CYCLASE YDEH (Escherichia coli)	3 / 3	ARG A 204 GLY A 207 GLU A 208	GAV A 402 (-3.2A) GAV A 402 (-3.3A) MG A 403 ( 2.2A)	0.41A	6fgdA-4h54A: undetectable	6fgdA-4h54A: 22.20

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1CEA_A_ACAA90_1","PLASMINOGEN;PLASMINOGEN","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",4,"ASP A  65;ASP A  67;TYR A 120;TYR A 123","None","1.16A","1ceaA-4h54A:undetectable;1ceaB-4h54A:undetectable","1ceaA-4h54A:12.29;1ceaB-4h54A:12.29"],["1CEA_B_ACAB90_1","PLASMINOGEN","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",4,"ASP A  65;ASP A  67;TYR A 120;TYR A 123","None","1.22A","1ceaB-4h54A:undetectable","1ceaB-4h54A:12.29"],["1CEB_B_AMHB90_1","PLASMINOGEN","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",4,"ASP A  65;ASP A  67;TYR A 120;TYR A 123","None","1.16A","1cebB-4h54A:undetectable","1cebB-4h54A:12.29"],["1DMA_B_NCAB700_0","EXOTOXIN A","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",4,"GLY A 267;TYR A 274;ALA A 272;GLU A 275","None","0.96A","1dmaB-4h54A:undetectable","1dmaB-4h54A:21.25"],["3K13_A_THHA642_1","5-METHYLTETRAHYDROFOLATE-HOMOCYSTEINE METHYLTRANSFERASE","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",3,"ASN A 173;ASP A 182;ARG A 140","GAV A 402 (-3.1A);GAV A 402 (-3.5A);None","0.78A","3k13A-4h54A:undetectable","3k13A-4h54A:21.57"],["5ZRD_A_CUA607_0","TYROSINASE","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",3,"HIS A  79;HIS A  83;HIS A  22"," ZN A 401 (-3.5A); ZN A 401 (-3.2A); ZN A 401 (-3.3A)","0.35A","5zrdA-4h54A:undetectable","5zrdA-4h54A:19.67"],["5ZRD_B_CUB606_0","TYROSINASE","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",4,"HIS A  22;PHE A 113;HIS A  83;HIS A  79"," ZN A 401 (-3.3A);None; ZN A 401 (-3.2A); ZN A 401 (-3.5A)","1.05A","5zrdB-4h54A:undetectable","5zrdB-4h54A:19.67"],["6FGD_A_ACTA819_0","GEPHYRIN","4h54","DIGUANYLATE CYCLASE YDEH","Escherichia coli",3,"ARG A 204;GLY A 207;GLU A 208","GAV A 402 (-3.2A);GAV A 402 (-3.3A); MG A 403 ( 2.2A)","0.41A","6fgdA-4h54A:undetectable","6fgdA-4h54A:22.20"]]