SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MF4'

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.	2FN1_B_SALB503_1 (SALICYLATE SYNTHETASE, IRP9)	5aw4	NA, K-ATPASE ALPHA SUBUNIT (Squalus acanthias)	5 / 11	GLU A 221 GLY A 718 THR A 378 GLY A 716 LYS A 698	MF4 A2001 (-3.4A) MG A2002 ( 4.7A) MF4 A2001 ( 3.9A) None MF4 A2001 (-2.7A)	1.41A	2fn1B-5aw4A: undetectable	2fn1B-5aw4A: 20.16
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.	3BUF_A_AEGA394_0 (BETA-SECRETASE 1)	5aw4	NA, K-ATPASE ALPHA SUBUNIT (Squalus acanthias)	4 / 5	LEU A 725 ASP A 721 ILE A 730 GLY A 716	None MF4 A2001 ( 4.5A) None None	0.73A	3bufA-5aw4A: undetectable	3bufA-5aw4A: 17.62
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.	3K13_A_THHA642_1 (5-METHYLTETRAHYDROFO LATE-HOMOCYSTEINE METHYLTRANSFERASE)	5aw4	NA, K-ATPASE ALPHA SUBUNIT (Squalus acanthias)	3 / 3	ASN A 720 ASP A 376 ARG A 551	MF4 A2001 (-3.4A) MF4 A2001 ( 2.4A) None	0.93A	3k13A-5aw4A: undetectable	3k13A-5aw4A: 15.39
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.	3K13_C_THHC643_1 (5-METHYLTETRAHYDROFO LATE-HOMOCYSTEINE METHYLTRANSFERASE)	5aw4	NA, K-ATPASE ALPHA SUBUNIT (Squalus acanthias)	3 / 3	ASN A 720 ASP A 376 ARG A 551	MF4 A2001 (-3.4A) MF4 A2001 ( 2.4A) None	0.94A	3k13C-5aw4A: undetectable	3k13C-5aw4A: 15.39
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.	4QWU_Y_BO2Y301_1 (PROTEASOME SUBUNIT BETA TYPE-5 PROTEASOME SUBUNIT BETA TYPE-6)	5aw4	NA, K-ATPASE ALPHA SUBUNIT (Squalus acanthias)	5 / 9	ALA A 746 ALA A 745 GLY A 735 GLY A 738 ASP A 721	None None None None MF4 A2001 ( 4.5A)	1.15A	4qwuY-5aw4A: undetectable 4qwuZ-5aw4A: undetectable	4qwuY-5aw4A: 13.05 4qwuZ-5aw4A: 12.78

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2FN1_B_SALB503_1","SALICYLATE SYNTHETASE, IRP9","5aw4","NA, K-ATPASE ALPHA SUBUNIT","Squalus acanthias",5,"GLU A 221;GLY A 718;THR A 378;GLY A 716;LYS A 698","MF4 A2001 (-3.4A); MG A2002 ( 4.7A);MF4 A2001 ( 3.9A);None;MF4 A2001 (-2.7A)","1.41A","2fn1B-5aw4A:undetectable",null],["3BUF_A_AEGA394_0","BETA-SECRETASE 1","5aw4","NA, K-ATPASE ALPHA SUBUNIT","Squalus acanthias",4,"LEU A 725;ASP A 721;ILE A 730;GLY A 716","None;MF4 A2001 ( 4.5A);None;None","0.73A","3bufA-5aw4A:undetectable","2fn1B-5aw4A:20.16"],["3K13_A_THHA642_1","5-METHYLTETRAHYDROFOLATE-HOMOCYSTEINE METHYLTRANSFERASE","5aw4","NA, K-ATPASE ALPHA SUBUNIT","Squalus acanthias",3,"ASN A 720;ASP A 376;ARG A 551","MF4 A2001 (-3.4A);MF4 A2001 ( 2.4A);None","0.93A","3k13A-5aw4A:undetectable","3bufA-5aw4A:17.62"],["3K13_C_THHC643_1","5-METHYLTETRAHYDROFOLATE-HOMOCYSTEINE METHYLTRANSFERASE","5aw4","NA, K-ATPASE ALPHA SUBUNIT","Squalus acanthias",3,"ASN A 720;ASP A 376;ARG A 551","MF4 A2001 (-3.4A);MF4 A2001 ( 2.4A);None","0.94A","3k13C-5aw4A:undetectable","3k13A-5aw4A:15.39"],["4QWU_Y_BO2Y301_1","PROTEASOME SUBUNIT BETA TYPE-5;PROTEASOME SUBUNIT BETA TYPE-6","5aw4","NA, K-ATPASE ALPHA SUBUNIT","Squalus acanthias",5,"ALA A 746;ALA A 745;GLY A 735;GLY A 738;ASP A 721","None;None;None;None;MF4 A2001 ( 4.5A)","1.15A","4qwuY-5aw4A:undetectable;4qwuZ-5aw4A:undetectable","3k13C-5aw4A:15.39"]]