SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2jnx'

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.	1L2I_B_CCSB417_0 (ESTROGEN RECEPTOR)	2jnx	CALCIUM BINDING PROTEIN 2 (Entamoeba histolytica)	4 / 6	PHE A 132 GLU A 128 GLN A 112 LYS A 115	None CA A 185 (-3.1A) None None	1.34A	1l2iB-2jnxA: undetectable	1l2iB-2jnxA: 18.39
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.	3W9T_A_W9TA1004_1 (HEMOLYTIC LECTIN CEL-III)	2jnx	CALCIUM BINDING PROTEIN 2 (Entamoeba histolytica)	4 / 5	ASP A 117 GLY A 120 TYR A 123 GLU A 128	CA A 185 (-3.2A) None CA A 185 (-4.8A) CA A 185 (-3.1A)	1.45A	3w9tA-2jnxA: undetectable	3w9tA-2jnxA: 15.57
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.	3W9T_C_W9TC1002_1 (HEMOLYTIC LECTIN CEL-III)	2jnx	CALCIUM BINDING PROTEIN 2 (Entamoeba histolytica)	4 / 5	ASP A 117 GLY A 120 TYR A 123 GLU A 128	CA A 185 (-3.2A) None CA A 185 (-4.8A) CA A 185 (-3.1A)	1.46A	3w9tC-2jnxA: undetectable	3w9tC-2jnxA: 15.57
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.	3W9T_D_W9TD512_1 (HEMOLYTIC LECTIN CEL-III)	2jnx	CALCIUM BINDING PROTEIN 2 (Entamoeba histolytica)	4 / 5	ASP A 117 GLY A 120 TYR A 123 GLU A 128	CA A 185 (-3.2A) None CA A 185 (-4.8A) CA A 185 (-3.1A)	1.45A	3w9tD-2jnxA: undetectable	3w9tD-2jnxA: 15.57
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.	3W9T_G_W9TG502_1 (HEMOLYTIC LECTIN CEL-III)	2jnx	CALCIUM BINDING PROTEIN 2 (Entamoeba histolytica)	4 / 5	ASP A 117 GLY A 120 TYR A 123 GLU A 128	CA A 185 (-3.2A) None CA A 185 (-4.8A) CA A 185 (-3.1A)	1.46A	3w9tG-2jnxA: undetectable	3w9tG-2jnxA: 15.57
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.	6HLP_A_GAWA1501_0 (SUBSTANCE-P RECEPTOR,SUBSTANCE-P RECEPTOR)	2jnx	CALCIUM BINDING PROTEIN 2 (Entamoeba histolytica)	5 / 12	ILE A 124 VAL A 109 ILE A 113 PHE A 100 PHE A 104	None	0.98A	6hlpA-2jnxA: undetectable	6hlpA-2jnxA: 13.03

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1L2I_B_CCSB417_0","ESTROGEN RECEPTOR","2jnx","CALCIUM BINDING PROTEIN 2","Entamoeba histolytica",4,"PHE A 132;GLU A 128;GLN A 112;LYS A 115","None; CA A 185 (-3.1A);None;None","1.34A","1l2iB-2jnxA:undetectable","1l2iB-2jnxA:18.39"],["3W9T_A_W9TA1004_1","HEMOLYTIC LECTIN CEL-III","2jnx","CALCIUM BINDING PROTEIN 2","Entamoeba histolytica",4,"ASP A 117;GLY A 120;TYR A 123;GLU A 128"," CA A 185 (-3.2A);None; CA A 185 (-4.8A); CA A 185 (-3.1A)","1.45A","3w9tA-2jnxA:undetectable","3w9tA-2jnxA:15.57"],["3W9T_C_W9TC1002_1","HEMOLYTIC LECTIN CEL-III","2jnx","CALCIUM BINDING PROTEIN 2","Entamoeba histolytica",4,"ASP A 117;GLY A 120;TYR A 123;GLU A 128"," CA A 185 (-3.2A);None; CA A 185 (-4.8A); CA A 185 (-3.1A)","1.46A","3w9tC-2jnxA:undetectable","3w9tC-2jnxA:15.57"],["3W9T_D_W9TD512_1","HEMOLYTIC LECTIN CEL-III","2jnx","CALCIUM BINDING PROTEIN 2","Entamoeba histolytica",4,"ASP A 117;GLY A 120;TYR A 123;GLU A 128"," CA A 185 (-3.2A);None; CA A 185 (-4.8A); CA A 185 (-3.1A)","1.45A","3w9tD-2jnxA:undetectable","3w9tD-2jnxA:15.57"],["3W9T_G_W9TG502_1","HEMOLYTIC LECTIN CEL-III","2jnx","CALCIUM BINDING PROTEIN 2","Entamoeba histolytica",4,"ASP A 117;GLY A 120;TYR A 123;GLU A 128"," CA A 185 (-3.2A);None; CA A 185 (-4.8A); CA A 185 (-3.1A)","1.46A","3w9tG-2jnxA:undetectable","3w9tG-2jnxA:15.57"],["6HLP_A_GAWA1501_0","SUBSTANCE-P RECEPTOR,SUBSTANCE-P RECEPTOR","2jnx","CALCIUM BINDING PROTEIN 2","Entamoeba histolytica",5,"ILE A 124;VAL A 109;ILE A 113;PHE A 100;PHE A 104","None","0.98A","6hlpA-2jnxA:undetectable","6hlpA-2jnxA:13.03"]]