SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3lwk'

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.	2WD9_C_IBPC1570_1 (ACYL-COENZYME A SYNTHETASE ACSM2A, MITOCHONDRIAL)	3lwk	BETA-CRYSTALLIN A4 (Homo sapiens)	5 / 10	ILE A 68 LEU A 69 VAL A 49 GLY A 72 GLN A 195	None	1.18A	2wd9C-3lwkA: undetectable	2wd9C-3lwkA: 15.61
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.	3KM6_A_EAAA222_1 (GLUTATHIONE S-TRANSFERASE P)	3lwk	BETA-CRYSTALLIN A4 (Homo sapiens)	5 / 10	TYR A 74 VAL A 49 GLY A 72 VAL A 55 GLN A 66	None	1.26A	3km6A-3lwkA: undetectable	3km6A-3lwkA: 21.92
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.	3KMO_A_EAAA214_1 (GLUTATHIONE S-TRANSFERASE P)	3lwk	BETA-CRYSTALLIN A4 (Homo sapiens)	5 / 9	TYR A 74 VAL A 49 GLY A 72 VAL A 55 GLN A 66	None	1.27A	3kmoA-3lwkA: undetectable	3kmoA-3lwkA: 21.92
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.	3KMO_A_EAAA214_1 (GLUTATHIONE S-TRANSFERASE P)	3lwk	BETA-CRYSTALLIN A4 (Homo sapiens)	5 / 9	TYR A 173 VAL A 144 GLY A 171 VAL A 150 GLN A 161	None None None GOL A 2 (-4.5A) GOL A 2 (-3.6A)	1.41A	3kmoA-3lwkA: undetectable	3kmoA-3lwkA: 21.92
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.	4R29_B_SAMB301_0 (UNCHARACTERIZED PROTEIN)	3lwk	BETA-CRYSTALLIN A4 (Homo sapiens)	5 / 12	SER A 152 GLY A 159 ALA A 79 GLY A 81 TYR A 74	GOL A 2 ( 3.7A) None None None None	1.24A	4r29B-3lwkA: undetectable	4r29B-3lwkA: 19.57

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2WD9_C_IBPC1570_1","ACYL-COENZYME A SYNTHETASE ACSM2A, MITOCHONDRIAL","3lwk","BETA-CRYSTALLIN A4","Homo sapiens",5,"ILE A  68;LEU A  69;VAL A  49;GLY A  72;GLN A 195","None","1.18A","2wd9C-3lwkA:undetectable","2wd9C-3lwkA:15.61"],["3KM6_A_EAAA222_1","GLUTATHIONE S-TRANSFERASE P","3lwk","BETA-CRYSTALLIN A4","Homo sapiens",5,"TYR A  74;VAL A  49;GLY A  72;VAL A  55;GLN A  66","None","1.26A","3km6A-3lwkA:undetectable","3km6A-3lwkA:21.92"],["3KMO_A_EAAA214_1","GLUTATHIONE S-TRANSFERASE P","3lwk","BETA-CRYSTALLIN A4","Homo sapiens",5,"TYR A  74;VAL A  49;GLY A  72;VAL A  55;GLN A  66","None","1.27A","3kmoA-3lwkA:undetectable","3kmoA-3lwkA:21.92"],["3KMO_A_EAAA214_1","GLUTATHIONE S-TRANSFERASE P","3lwk","BETA-CRYSTALLIN A4","Homo sapiens",5,"TYR A 173;VAL A 144;GLY A 171;VAL A 150;GLN A 161","None;None;None;GOL A   2 (-4.5A);GOL A   2 (-3.6A)","1.41A","3kmoA-3lwkA:undetectable","3kmoA-3lwkA:21.92"],["4R29_B_SAMB301_0","UNCHARACTERIZED PROTEIN","3lwk","BETA-CRYSTALLIN A4","Homo sapiens",5,"SER A 152;GLY A 159;ALA A  79;GLY A  81;TYR A  74","GOL A   2 ( 3.7A);None;None;None;None","1.24A","4r29B-3lwkA:undetectable","4r29B-3lwkA:19.57"]]