SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2ehp'

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.	1YA4_C_CTXC3_1 (CES1 PROTEIN)	2ehp	AQ_1627 PROTEIN (Aquifex aeolicus)	6 / 12	GLY A 62 GLY A 29 LEU A 47 LEU A 32 LEU A 57 LEU A 90	None	1.49A	1ya4C-2ehpA: undetectable	1ya4C-2ehpA: 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.	1YA4_C_CTXC3_1 (CES1 PROTEIN)	2ehp	AQ_1627 PROTEIN (Aquifex aeolicus)	6 / 12	GLY A 62 GLY A 29 LEU A 47 SER A 48 LEU A 32 LEU A 57	None	1.49A	1ya4C-2ehpA: undetectable	1ya4C-2ehpA: 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.	2Q9R_A_BEZA203_0 (PROTEIN OF UNKNOWN FUNCTION)	2ehp	AQ_1627 PROTEIN (Aquifex aeolicus)	4 / 5	LEU A 47 GLY A 68 PRO A 45 ILE A 78	None	0.87A	2q9rA-2ehpA: undetectable	2q9rA-2ehpA: 23.12
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.	4PGH_A_SAMA401_0 (CAFFEIC ACID O-METHYLTRANSFERASE)	2ehp	AQ_1627 PROTEIN (Aquifex aeolicus)	5 / 11	GLY A 29 GLY A 62 LEU A 47 VAL A 70 ILE A 28	None	1.13A	4pghA-2ehpA: undetectable	4pghA-2ehpA: 16.23
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.	5JQB_B_IBPB706_1 (ENVELOPE GLYCOPROTEIN 1,ENVELOPE GLYCOPROTEIN 1,ENVELOPE GLYCOPROTEIN 1 ENVELOPE GLYCOPROTEIN 2)	2ehp	AQ_1627 PROTEIN (Aquifex aeolicus)	4 / 8	LEU A 103 LEU A 107 LEU A 59 LEU A 32	None	0.73A	5jqbA-2ehpA: undetectable 5jqbB-2ehpA: undetectable	5jqbA-2ehpA: 17.82 5jqbB-2ehpA: 20.86

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1YA4_C_CTXC3_1","CES1 PROTEIN","2ehp","AQ_1627 PROTEIN","Aquifex aeolicus",6,"GLY A  62;GLY A  29;LEU A  47;LEU A  32;LEU A  57;LEU A  90","None","1.49A","1ya4C-2ehpA:undetectable","1ya4C-2ehpA:15.23"],["1YA4_C_CTXC3_1","CES1 PROTEIN","2ehp","AQ_1627 PROTEIN","Aquifex aeolicus",6,"GLY A  62;GLY A  29;LEU A  47;SER A  48;LEU A  32;LEU A  57","None","1.49A","1ya4C-2ehpA:undetectable","1ya4C-2ehpA:15.23"],["2Q9R_A_BEZA203_0","PROTEIN OF UNKNOWN FUNCTION","2ehp","AQ_1627 PROTEIN","Aquifex aeolicus",4,"LEU A  47;GLY A  68;PRO A  45;ILE A  78","None","0.87A","2q9rA-2ehpA:undetectable","2q9rA-2ehpA:23.12"],["4PGH_A_SAMA401_0","CAFFEIC ACID O-METHYLTRANSFERASE","2ehp","AQ_1627 PROTEIN","Aquifex aeolicus",5,"GLY A  29;GLY A  62;LEU A  47;VAL A  70;ILE A  28","None","1.13A","4pghA-2ehpA:undetectable","4pghA-2ehpA:16.23"],["5JQB_B_IBPB706_1","ENVELOPE GLYCOPROTEIN 1,ENVELOPE GLYCOPROTEIN 1,ENVELOPE GLYCOPROTEIN 1;ENVELOPE GLYCOPROTEIN 2","2ehp","AQ_1627 PROTEIN","Aquifex aeolicus",4,"LEU A 103;LEU A 107;LEU A  59;LEU A  32","None","0.73A","5jqbA-2ehpA:undetectable;5jqbB-2ehpA:undetectable","5jqbA-2ehpA:17.82;5jqbB-2ehpA:20.86"]]