SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3cr7'

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.	1KIA_D_SAMD3293_0 (GLYCINE N-METHYLTRANSFERASE)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	5 / 12	GLY A 37 VAL A 140 ALA A 42 SER A 39 TYR A 172	ADP A2001 (-3.0A) None None ADP A2001 (-2.3A) None	1.36A	1kiaD-3cr7A: undetectable	1kiaD-3cr7A: 20.62
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.	1NBH_A_SAMA293_0 (GLYCINE N-METHYLTRANSFERASE)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	5 / 12	GLY A 37 VAL A 140 ALA A 42 SER A 39 TYR A 172	ADP A2001 (-3.0A) None None ADP A2001 (-2.3A) None	1.37A	1nbhA-3cr7A: undetectable	1nbhA-3cr7A: 20.62
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.	1NBH_D_SAMD3293_0 (GLYCINE N-METHYLTRANSFERASE)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	5 / 12	GLY A 37 VAL A 140 ALA A 42 SER A 39 TYR A 172	ADP A2001 (-3.0A) None None ADP A2001 (-2.3A) None	1.36A	1nbhD-3cr7A: undetectable	1nbhD-3cr7A: 20.62
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.	2X2N_A_X2NA1480_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	5 / 12	TYR A 205 PRO A 207 ALA A 208 ALA A 101 ALA A 95	None	1.24A	2x2nA-3cr7A: undetectable	2x2nA-3cr7A: 17.65
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.	3JQ7_C_DX2C270_1 (PTERIDINE REDUCTASE 1)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	4 / 8	SER A 107 PHE A 105 VAL A 90 LEU A 69	PPS A2002 (-4.9A) PPS A2002 (-4.6A) None None	1.11A	3jq7C-3cr7A: 2.2	3jq7C-3cr7A: 21.62
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.	3KIV_A_ACAA100_1 (APOLIPOPROTEIN)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	4 / 7	ARG A 66 ASP A 72 PHE A 75 ARG A 80	PPS A2002 (-4.0A) None PPS A2002 (-3.5A) PPS A2002 (-3.3A)	1.50A	3kivA-3cr7A: undetectable	3kivA-3cr7A: 15.23
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.	3REM_A_SALA301_1 (SALICYLATE BIOSYNTHESIS PROTEIN PCHB)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	4 / 8	VAL A 134 VAL A 182 TYR A 199 ILE A 196	None	0.93A	3remA-3cr7A: undetectable	3remA-3cr7A: 24.34
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.	3REM_B_SALB301_1 (SALICYLATE BIOSYNTHESIS PROTEIN PCHB)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	4 / 8	VAL A 134 VAL A 182 TYR A 199 ILE A 196	None	0.93A	3remB-3cr7A: undetectable	3remB-3cr7A: 24.34
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.	4L1W_B_STRB402_1 (ALDO-KETO REDUCTASE FAMILY 1 MEMBER C2)	3cr7	ADENYLYL-SULFATE KINASE (Penicillium chrysogenum)	4 / 6	VAL A 180 VAL A 134 ILE A 28 LEU A 41	None	0.94A	4l1wB-3cr7A: undetectable	4l1wB-3cr7A: 21.64

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1KIA_D_SAMD3293_0","GLYCINE N-METHYLTRANSFERASE","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",5,"GLY A  37;VAL A 140;ALA A  42;SER A  39;TYR A 172","ADP A2001 (-3.0A);None;None;ADP A2001 (-2.3A);None","1.36A","1kiaD-3cr7A:undetectable","1kiaD-3cr7A:20.62"],["1NBH_A_SAMA293_0","GLYCINE N-METHYLTRANSFERASE","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",5,"GLY A  37;VAL A 140;ALA A  42;SER A  39;TYR A 172","ADP A2001 (-3.0A);None;None;ADP A2001 (-2.3A);None","1.37A","1nbhA-3cr7A:undetectable","1nbhA-3cr7A:20.62"],["1NBH_D_SAMD3293_0","GLYCINE N-METHYLTRANSFERASE","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",5,"GLY A  37;VAL A 140;ALA A  42;SER A  39;TYR A 172","ADP A2001 (-3.0A);None;None;ADP A2001 (-2.3A);None","1.36A","1nbhD-3cr7A:undetectable","1nbhD-3cr7A:20.62"],["2X2N_A_X2NA1480_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",5,"TYR A 205;PRO A 207;ALA A 208;ALA A 101;ALA A  95","None","1.24A","2x2nA-3cr7A:undetectable","2x2nA-3cr7A:17.65"],["3JQ7_C_DX2C270_1","PTERIDINE REDUCTASE 1","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",4,"SER A 107;PHE A 105;VAL A  90;LEU A  69","PPS A2002 (-4.9A);PPS A2002 (-4.6A);None;None","1.11A","3jq7C-3cr7A:2.2","3jq7C-3cr7A:21.62"],["3KIV_A_ACAA100_1","APOLIPOPROTEIN","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",4,"ARG A  66;ASP A  72;PHE A  75;ARG A  80","PPS A2002 (-4.0A);None;PPS A2002 (-3.5A);PPS A2002 (-3.3A)","1.50A","3kivA-3cr7A:undetectable","3kivA-3cr7A:15.23"],["3REM_A_SALA301_1","SALICYLATE BIOSYNTHESIS PROTEIN PCHB","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",4,"VAL A 134;VAL A 182;TYR A 199;ILE A 196","None","0.93A","3remA-3cr7A:undetectable","3remA-3cr7A:24.34"],["3REM_B_SALB301_1","SALICYLATE BIOSYNTHESIS PROTEIN PCHB","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",4,"VAL A 134;VAL A 182;TYR A 199;ILE A 196","None","0.93A","3remB-3cr7A:undetectable","3remB-3cr7A:24.34"],["4L1W_B_STRB402_1","ALDO-KETO REDUCTASE FAMILY 1 MEMBER C2","3cr7","ADENYLYL-SULFATE KINASE","Penicillium chrysogenum",4,"VAL A 180;VAL A 134;ILE A  28;LEU A  41","None","0.94A","4l1wB-3cr7A:undetectable","4l1wB-3cr7A:21.64"]]