SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3k60'

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 (%)	View	Dock
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.	1MXG_A_ACRA442_1 (ALPHA AMYLASE)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	5 / 11	GLU A 59 GLY A 168 GLN A 145 GLY A 81 ASP A 79	None None None None ADP A 400 (-3.6A)	1.10A	1mxgA-3k60A: undetectable	1mxgA-3k60A: 17.77
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.	1Q23_B_FUAB703_2 (CHLORAMPHENICOL ACETYLTRANSFERASE)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	3 / 3	VAL A 130 ALA A 131 HIS A 133	None	0.70A	1q23C-3k60A: undetectable	1q23C-3k60A: 18.88
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.	1Q23_C_FUAC701_1 (CHLORAMPHENICOL ACETYLTRANSFERASE)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	4 / 4	ALA A 127 VAL A 130 ALA A 131 HIS A 133	None	1.02A	1q23A-3k60A: undetectable	1q23A-3k60A: 18.88
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.	1Q23_K_FUAK712_2 (CHLORAMPHENICOL ACETYLTRANSFERASE)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	3 / 3	VAL A 130 ALA A 131 HIS A 133	None	0.65A	1q23L-3k60A: undetectable	1q23L-3k60A: 18.88
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.	1S14_A_NOVA1300_1 (TOPOISOMERASE IV SUBUNIT B)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	5 / 12	ASP A 40 ASP A 79 MET A 84 ASP A 142 THR A 171	None ADP A 400 (-3.6A) ADP A 400 (-3.6A) None ADP A 400 (-3.7A)	1.30A	1s14A-3k60A: 12.3	1s14A-3k60A: 23.36
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.	2OPX_A_DXCA1001_0 (ALDEHYDE DEHYDROGENASE A)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	4 / 7	LEU A 175 ILE A 173 ASN A 37 PHE A 124	None None ADP A 400 (-2.7A) None	0.92A	2opxA-3k60A: undetectable	2opxA-3k60A: 19.20
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.	2YGQ_A_PCFA1275_0 (WNT INHIBITORY FACTOR 1)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	5 / 12	LEU A 34 LEU A 89 ILE A 173 PHE A 124 PHE A 8	None	0.88A	2ygqA-3k60A: undetectable	2ygqA-3k60A: 20.33
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.	5IKR_B_ID8B602_2 (PROSTAGLANDIN G/H SYNTHASE 2)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	3 / 3	SER A 80 LEU A 89 MET A 84	None None ADP A 400 (-3.6A)	0.87A	5ikrB-3k60A: undetectable	5ikrB-3k60A: 17.61
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.	5WEA_A_IPHA901_0 (PROTEIN ARGONAUTE-2)	3k60	HEAT SHOCK PROTEIN 86 (Plasmodium falciparum)	4 / 5	LEU A 75 TYR A 184 LEU A 185 GLU A 186	None	1.30A	5weaA-3k60A: undetectable	5weaA-3k60A: 13.76

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1MXG_A_ACRA442_1","ALPHA AMYLASE","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",5,"GLU A  59;GLY A 168;GLN A 145;GLY A  81;ASP A  79","None;None;None;None;ADP A 400 (-3.6A)","1.10A","1mxgA-3k60A:undetectable","1mxgA-3k60A:17.77"],["1Q23_B_FUAB703_2","CHLORAMPHENICOL ACETYLTRANSFERASE;CHLORAMPHENICOL ACETYLTRANSFERASE","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",3,"VAL A 130;ALA A 131;HIS A 133","None","0.70A","1q23C-3k60A:undetectable","1q23C-3k60A:18.88"],["1Q23_C_FUAC701_1","CHLORAMPHENICOL ACETYLTRANSFERASE;CHLORAMPHENICOL ACETYLTRANSFERASE","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",4,"ALA A 127;VAL A 130;ALA A 131;HIS A 133","None","1.02A","1q23A-3k60A:undetectable","1q23A-3k60A:18.88"],["1Q23_K_FUAK712_2","CHLORAMPHENICOL ACETYLTRANSFERASE;CHLORAMPHENICOL ACETYLTRANSFERASE","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",3,"VAL A 130;ALA A 131;HIS A 133","None","0.65A","1q23L-3k60A:undetectable","1q23L-3k60A:18.88"],["1S14_A_NOVA1300_1","TOPOISOMERASE IV SUBUNIT B","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",5,"ASP A  40;ASP A  79;MET A  84;ASP A 142;THR A 171","None;ADP A 400 (-3.6A);ADP A 400 (-3.6A);None;ADP A 400 (-3.7A)","1.30A","1s14A-3k60A:12.3","1s14A-3k60A:23.36"],["2OPX_A_DXCA1001_0","ALDEHYDE DEHYDROGENASE A","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",4,"LEU A 175;ILE A 173;ASN A  37;PHE A 124","None;None;ADP A 400 (-2.7A);None","0.92A","2opxA-3k60A:undetectable","2opxA-3k60A:19.20"],["2YGQ_A_PCFA1275_0","WNT INHIBITORY FACTOR 1","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",5,"LEU A  34;LEU A  89;ILE A 173;PHE A 124;PHE A   8","None","0.88A","2ygqA-3k60A:undetectable","2ygqA-3k60A:20.33"],["5IKR_B_ID8B602_2","PROSTAGLANDIN G\/H SYNTHASE 2","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",3,"SER A  80;LEU A  89;MET A  84","None;None;ADP A 400 (-3.6A)","0.87A","5ikrB-3k60A:undetectable","5ikrB-3k60A:17.61"],["5WEA_A_IPHA901_0","PROTEIN ARGONAUTE-2","3k60","HEAT SHOCK PROTEIN 86","Plasmodium falciparum",4,"LEU A  75;TYR A 184;LEU A 185;GLU A 186","None","1.30A","5weaA-3k60A:undetectable","5weaA-3k60A:13.76"]]