SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ij5'

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.	1N2X_B_SAMB402_1 (S-ADENOSYL-METHYLTRA NSFERASE MRAW)	3ij5	3-DEOXY-D-MANNO-OCTU LOSONATE 8-PHOSPHATE PHOSPHATASE (Yersinia pestis)	4 / 5	VAL A 32 SER A 37 ASP A 84 GLN A 96	None	1.21A	1n2xB-3ij5A: 3.7	1n2xB-3ij5A: 19.41
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.	4XOY_A_DX4A401_0 (MITOGEN-ACTIVATED PROTEIN KINASE 1)	3ij5	3-DEOXY-D-MANNO-OCTU LOSONATE 8-PHOSPHATE PHOSPHATASE (Yersinia pestis)	4 / 6	ALA A 22 GLN A 176 LEU A 171 LEU A 64	None	1.19A	4xoyA-3ij5A: undetectable	4xoyA-3ij5A: 18.82
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.	4XP3_A_DX4A401_0 (MITOGEN-ACTIVATED PROTEIN KINASE 1)	3ij5	3-DEOXY-D-MANNO-OCTU LOSONATE 8-PHOSPHATE PHOSPHATASE (Yersinia pestis)	4 / 6	ALA A 22 GLN A 176 LEU A 171 LEU A 64	None	1.22A	4xp3A-3ij5A: undetectable	4xp3A-3ij5A: 18.82
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.	5L6E_B_ACTB401_0 (N6-ADENOSINE-METHYLT RANSFERASE 70 KDA SUBUNIT N6-ADENOSINE-METHYLT RANSFERASE SUBUNIT METTL14)	3ij5	3-DEOXY-D-MANNO-OCTU LOSONATE 8-PHOSPHATE PHOSPHATASE (Yersinia pestis)	4 / 6	GLU A 49 LEU A 82 ARG A 78 ARG A 77	None	1.16A	5l6eA-3ij5A: 3.4 5l6eB-3ij5A: 3.0	5l6eA-3ij5A: 21.34 5l6eB-3ij5A: 19.11
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.	5VOP_A_C2FA3001_0 (5-METHYLTETRAHYDROFO LATE HOMOCYSTEINE S-METHYLTRANSFERASE)	3ij5	3-DEOXY-D-MANNO-OCTU LOSONATE 8-PHOSPHATE PHOSPHATASE (Yersinia pestis)	5 / 12	GLY A 39 VAL A 168 LEU A 28 VAL A 139 GLY A 123	None	1.07A	5vopA-3ij5A: undetectable	5vopA-3ij5A: 21.31

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1N2X_B_SAMB402_1","S-ADENOSYL-METHYLTRANSFERASE MRAW","3ij5","3-DEOXY-D-MANNO-OCTULOSONATE 8-PHOSPHATE PHOSPHATASE","Yersinia pestis",4,"VAL A  32;SER A  37;ASP A  84;GLN A  96","None","1.21A","1n2xB-3ij5A:3.7","1n2xB-3ij5A:19.41"],["4XOY_A_DX4A401_0","MITOGEN-ACTIVATED PROTEIN KINASE 1","3ij5","3-DEOXY-D-MANNO-OCTULOSONATE 8-PHOSPHATE PHOSPHATASE","Yersinia pestis",4,"ALA A  22;GLN A 176;LEU A 171;LEU A  64","None","1.19A","4xoyA-3ij5A:undetectable","4xoyA-3ij5A:18.82"],["4XP3_A_DX4A401_0","MITOGEN-ACTIVATED PROTEIN KINASE 1","3ij5","3-DEOXY-D-MANNO-OCTULOSONATE 8-PHOSPHATE PHOSPHATASE","Yersinia pestis",4,"ALA A  22;GLN A 176;LEU A 171;LEU A  64","None","1.22A","4xp3A-3ij5A:undetectable","4xp3A-3ij5A:18.82"],["5L6E_B_ACTB401_0","N6-ADENOSINE-METHYLTRANSFERASE 70 KDA SUBUNIT;N6-ADENOSINE-METHYLTRANSFERASE SUBUNIT METTL14","3ij5","3-DEOXY-D-MANNO-OCTULOSONATE 8-PHOSPHATE PHOSPHATASE","Yersinia pestis",4,"GLU A  49;LEU A  82;ARG A  78;ARG A  77","None","1.16A","5l6eA-3ij5A:3.4;5l6eB-3ij5A:3.0","5l6eA-3ij5A:21.34;5l6eB-3ij5A:19.11"],["5VOP_A_C2FA3001_0","5-METHYLTETRAHYDROFOLATE HOMOCYSTEINE S-METHYLTRANSFERASE","3ij5","3-DEOXY-D-MANNO-OCTULOSONATE 8-PHOSPHATE PHOSPHATASE","Yersinia pestis",5,"GLY A  39;VAL A 168;LEU A  28;VAL A 139;GLY A 123","None","1.07A","5vopA-3ij5A:undetectable","5vopA-3ij5A:21.31"]]