SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MUP'

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.	1MAA_D_DMED999_1 (ACETYLCHOLINESTERASE)	1lpb	LIPASE (Homo sapiens)	4 / 8	TRP B 85 GLY B 76 SER B 152 HIS B 263	None MUP B 901 (-3.0A) MUP B 901 ( 1.6A) MUP B 901 ( 4.1A)	0.97A	1maaD-1lpbB: 8.7	1maaD-1lpbB: 24.09
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.	4E7C_A_ACTA504_0 (UDP-N-ACETYLGLUCOSAM INE 1-CARBOXYVINYLTRANSF ERASE)	1lpb	LIPASE (Homo sapiens)	3 / 3	ARG B 111 TRP B 106 GLY B 76	BOG B 450 (-3.6A) None MUP B 901 (-3.0A)	0.92A	4e7cA-1lpbB: 0.0	4e7cA-1lpbB: 22.45
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.	4E7C_C_ACTC506_0 (UDP-N-ACETYLGLUCOSAM INE 1-CARBOXYVINYLTRANSF ERASE)	1lpb	LIPASE (Homo sapiens)	4 / 5	ARG B 111 TRP B 106 HIS B 75 GLY B 76	BOG B 450 (-3.6A) None None MUP B 901 (-3.0A)	1.15A	4e7cC-1lpbB: 0.0	4e7cC-1lpbB: 22.45
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.	4LRH_D_FOLD301_1 (FOLATE RECEPTOR ALPHA)	1lpb	LIPASE (Homo sapiens)	3 / 3	HIS B 151 TRP B 106 SER B 266	MUP B 901 (-4.5A) None None	1.14A	4lrhD-1lpbB: undetectable	4lrhD-1lpbB: 18.26
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.	5KR2_A_ROCA101_2 (PROTEASE PR5-SQV)	1lpb	LIPASE (Homo sapiens)	5 / 11	ARG B 111 ALA B 178 ASP B 176 GLY B 150 ILE B 74	BOG B 450 (-3.6A) MUP B 901 (-3.3A) None None None	1.21A	5kr2B-1lpbB: undetectable	5kr2B-1lpbB: 11.22

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1MAA_D_DMED999_1","ACETYLCHOLINESTERASE","1lpb","LIPASE","Homo sapiens",4,"TRP B  85;GLY B  76;SER B 152;HIS B 263","None;MUP B 901 (-3.0A);MUP B 901 ( 1.6A);MUP B 901 ( 4.1A)","0.97A","1maaD-1lpbB:8.7",null],["4E7C_A_ACTA504_0","UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE","1lpb","LIPASE","Homo sapiens",3,"ARG B 111;TRP B 106;GLY B  76","BOG B 450 (-3.6A);None;MUP B 901 (-3.0A)","0.92A","4e7cA-1lpbB:0.0","1maaD-1lpbB:24.09"],["4E7C_C_ACTC506_0","UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE","1lpb","LIPASE","Homo sapiens",4,"ARG B 111;TRP B 106;HIS B  75;GLY B  76","BOG B 450 (-3.6A);None;None;MUP B 901 (-3.0A)","1.15A","4e7cC-1lpbB:0.0","4e7cA-1lpbB:22.45"],["4LRH_D_FOLD301_1","FOLATE RECEPTOR ALPHA","1lpb","LIPASE","Homo sapiens",3,"HIS B 151;TRP B 106;SER B 266","MUP B 901 (-4.5A);None;None","1.14A","4lrhD-1lpbB:undetectable","4e7cC-1lpbB:22.45"],["5KR2_A_ROCA101_2","PROTEASE PR5-SQV;PROTEASE PR5-SQV","1lpb","LIPASE","Homo sapiens",5,"ARG B 111;ALA B 178;ASP B 176;GLY B 150;ILE B  74","BOG B 450 (-3.6A);MUP B 901 (-3.3A);None;None;None","1.21A","5kr2B-1lpbB:undetectable","4lrhD-1lpbB:18.26"]]