SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2xfe'

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.	2X2I_A_QPSA1060_1 (ALPHA-1,4-GLUCAN LYASE ISOZYME 1)	2xfe	CARBOHYDRATE BINDING MODULE (Escherichia coli)	5 / 12	SER A 18 THR A 53 VAL A 61 GLY A 10 ALA A 8	None	1.19A	2x2iA-2xfeA: undetectable	2x2iA-2xfeA: 7.71
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.	2X2I_C_QPSC1060_1 (ALPHA-1,4-GLUCAN LYASE ISOZYME 1)	2xfe	CARBOHYDRATE BINDING MODULE (Escherichia coli)	5 / 12	SER A 18 THR A 53 VAL A 61 GLY A 10 ALA A 8	None	1.22A	2x2iC-2xfeA: undetectable	2x2iC-2xfeA: 7.71
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.	3HUO_B_PNNB301_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	2xfe	CARBOHYDRATE BINDING MODULE (Escherichia coli)	5 / 12	GLY A 91 ASN A 81 GLY A 92 SER A 93 GLY A 94	None	0.77A	3huoB-2xfeA: undetectable	3huoB-2xfeA: 19.38
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.	3MDT_A_VORA506_1 (CHOLESTEROL 24-HYDROXYLASE)	2xfe	CARBOHYDRATE BINDING MODULE (Escherichia coli)	5 / 9	LEU A 19 VAL A 17 SER A 18 ALA A 8 ALA A 75	None	1.29A	3mdtA-2xfeA: undetectable	3mdtA-2xfeA: 13.92

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2X2I_A_QPSA1060_1","ALPHA-1,4-GLUCAN LYASE ISOZYME 1","2xfe","CARBOHYDRATE BINDING MODULE","Escherichia coli",5,"SER A  18;THR A  53;VAL A  61;GLY A  10;ALA A   8","None","1.19A","2x2iA-2xfeA:undetectable","2x2iA-2xfeA:7.71"],["2X2I_C_QPSC1060_1","ALPHA-1,4-GLUCAN LYASE ISOZYME 1","2xfe","CARBOHYDRATE BINDING MODULE","Escherichia coli",5,"SER A  18;THR A  53;VAL A  61;GLY A  10;ALA A   8","None","1.22A","2x2iC-2xfeA:undetectable","2x2iC-2xfeA:7.71"],["3HUO_B_PNNB301_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","2xfe","CARBOHYDRATE BINDING MODULE","Escherichia coli",5,"GLY A  91;ASN A  81;GLY A  92;SER A  93;GLY A  94","None","0.77A","3huoB-2xfeA:undetectable","3huoB-2xfeA:19.38"],["3MDT_A_VORA506_1","CHOLESTEROL 24-HYDROXYLASE","2xfe","CARBOHYDRATE BINDING MODULE","Escherichia coli",5,"LEU A  19;VAL A  17;SER A  18;ALA A   8;ALA A  75","None","1.29A","3mdtA-2xfeA:undetectable","3mdtA-2xfeA:13.92"]]