SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2xy1'

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.	3FRQ_B_ERYB195_1 (REPRESSOR PROTEIN MPHR(A))	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 7	ASN A 315 TYR A 313 ARG A 353 HIS A 366	None	1.30A	3frqB-2xy1A: undetectable	3frqB-2xy1A: 23.04
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.	3O7W_A_SAMA801_1 (LEUCINE CARBOXYL METHYLTRANSFERASE 1)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	3 / 3	LYS A 371 ARG A 353 ASP A 339	None	1.29A	3o7wA-2xy1A: undetectable	3o7wA-2xy1A: 20.46
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.	4HYT_A_OBNA1104_2 (SODIUM/POTASSIUM-TRA NSPORTING ATPASE SUBUNIT ALPHA-1)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 5	PRO A 209 ASP A 290 ILE A 242 VAL A 280	None	1.22A	4hytA-2xy1A: undetectable	4hytA-2xy1A: 12.05
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.	4XQE_A_AG2A506_1 (HOMOSPERMIDINE SYNTHASE)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 6	ARG A 353 ARG A 336 VAL A 370 ASP A 374	None	1.15A	4xqeA-2xy1A: undetectable	4xqeA-2xy1A: 18.83
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.	4XQE_B_AG2B505_1 (HOMOSPERMIDINE SYNTHASE)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 6	ARG A 353 ARG A 336 VAL A 370 ASP A 374	None	1.18A	4xqeB-2xy1A: undetectable	4xqeB-2xy1A: 18.83
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.	4XQG_A_AG2A505_1 (HOMOSPERMIDINE SYNTHASE)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 8	ARG A 353 ARG A 336 VAL A 370 ASP A 374	None	1.17A	4xqgA-2xy1A: undetectable	4xqgA-2xy1A: 18.53
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.	5M0I_B_ACTB303_0 (SWI5-DEPENDENT HO EXPRESSION PROTEIN 2)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 5	VAL A 370 THR A 312 ASP A 396 LEU A 395	None	1.29A	5m0iB-2xy1A: undetectable	5m0iB-2xy1A: 21.20
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.	6MN5_E_LLLE301_0 (AMINOGLYCOSIDE N(3)-ACETYLTRANSFERA SE, AAC(3)-IVA)	2xy1	NEURAL CELL ADHESION MOLECULE 2 (Homo sapiens)	4 / 7	ASP A 374 ARG A 336 TYR A 378 ASP A 339	None	1.24A	6mn5E-2xy1A: undetectable	6mn5E-2xy1A: 16.57

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["3FRQ_B_ERYB195_1","REPRESSOR PROTEIN MPHR(A)","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"ASN A 315;TYR A 313;ARG A 353;HIS A 366","None","1.30A","3frqB-2xy1A:undetectable","3frqB-2xy1A:23.04"],["3O7W_A_SAMA801_1","LEUCINE CARBOXYL METHYLTRANSFERASE 1","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",3,"LYS A 371;ARG A 353;ASP A 339","None","1.29A","3o7wA-2xy1A:undetectable","3o7wA-2xy1A:20.46"],["4HYT_A_OBNA1104_2","SODIUM\/POTASSIUM-TRANSPORTING ATPASE SUBUNIT ALPHA-1","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"PRO A 209;ASP A 290;ILE A 242;VAL A 280","None","1.22A","4hytA-2xy1A:undetectable","4hytA-2xy1A:12.05"],["4XQE_A_AG2A506_1","HOMOSPERMIDINE SYNTHASE","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"ARG A 353;ARG A 336;VAL A 370;ASP A 374","None","1.15A","4xqeA-2xy1A:undetectable","4xqeA-2xy1A:18.83"],["4XQE_B_AG2B505_1","HOMOSPERMIDINE SYNTHASE","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"ARG A 353;ARG A 336;VAL A 370;ASP A 374","None","1.18A","4xqeB-2xy1A:undetectable","4xqeB-2xy1A:18.83"],["4XQG_A_AG2A505_1","HOMOSPERMIDINE SYNTHASE","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"ARG A 353;ARG A 336;VAL A 370;ASP A 374","None","1.17A","4xqgA-2xy1A:undetectable","4xqgA-2xy1A:18.53"],["5M0I_B_ACTB303_0","SWI5-DEPENDENT HO EXPRESSION PROTEIN 2","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"VAL A 370;THR A 312;ASP A 396;LEU A 395","None","1.29A","5m0iB-2xy1A:undetectable","5m0iB-2xy1A:21.20"],["6MN5_E_LLLE301_0","AMINOGLYCOSIDE N(3)-ACETYLTRANSFERASE, AAC(3)-IVA","2xy1","NEURAL CELL ADHESION MOLECULE 2","Homo sapiens",4,"ASP A 374;ARG A 336;TYR A 378;ASP A 339","None","1.24A","6mn5E-2xy1A:undetectable","6mn5E-2xy1A:16.57"]]