SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '0WE'

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.	1E7A_A_PFLA4001_1 (SERUM ALBUMIN)	4fs3	ENOYL-[ACYL-CARRIER- PROTEIN] REDUCTASE [NADPH] FABI (Staphylococcus aureus)	5 / 9	LEU A 208 ILE A 207 ASN A 205 VAL A 201 GLY A 202	None 0WE A 302 ( 4.8A) None 0WE A 302 ( 4.4A) None	1.04A	1e7aA-4fs3A: undetectable	1e7aA-4fs3A: 18.26
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.	1E7A_B_PFLB4001_1 (SERUM ALBUMIN)	4fs3	ENOYL-[ACYL-CARRIER- PROTEIN] REDUCTASE [NADPH] FABI (Staphylococcus aureus)	5 / 9	LEU A 208 ILE A 207 ASN A 205 VAL A 201 GLY A 202	None 0WE A 302 ( 4.8A) None 0WE A 302 ( 4.4A) None	1.02A	1e7aB-4fs3A: undetectable	1e7aB-4fs3A: 18.26
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.	3QXY_B_SAMB6735_0 (N-LYSINE METHYLTRANSFERASE SETD6 TRANSCRIPTION FACTOR P65)	4fs3	ENOYL-[ACYL-CARRIER- PROTEIN] REDUCTASE [NADPH] FABI (Staphylococcus aureus)	5 / 11	VAL A 248 GLY A 191 TYR A 147 ALA A 21 TYR A 91	None None 0WE A 302 ( 3.8A) None None	1.34A	3qxyB-4fs3A: undetectable 3qxyQ-4fs3A: undetectable	3qxyB-4fs3A: 20.59 3qxyQ-4fs3A: 7.83
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.	5VKQ_B_PCFB1802_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	4fs3	ENOYL-[ACYL-CARRIER- PROTEIN] REDUCTASE [NADPH] FABI (Staphylococcus aureus)	4 / 7	SER A 189 VAL A 221 PRO A 192 ILE A 207	None None 0WD A 301 (-4.8A) 0WE A 302 ( 4.8A)	1.23A	5vkqA-4fs3A: undetectable 5vkqB-4fs3A: undetectable	5vkqA-4fs3A: 9.74 5vkqB-4fs3A: 9.74
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.	5VKQ_D_PCFD1803_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	4fs3	ENOYL-[ACYL-CARRIER- PROTEIN] REDUCTASE [NADPH] FABI (Staphylococcus aureus)	4 / 7	SER A 189 VAL A 221 PRO A 192 ILE A 207	None None 0WD A 301 (-4.8A) 0WE A 302 ( 4.8A)	1.22A	5vkqC-4fs3A: undetectable 5vkqD-4fs3A: undetectable	5vkqC-4fs3A: 9.74 5vkqD-4fs3A: 9.74

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1E7A_A_PFLA4001_1","SERUM ALBUMIN","4fs3","ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH] FABI","Staphylococcus aureus",5,"LEU A 208;ILE A 207;ASN A 205;VAL A 201;GLY A 202","None;0WE A 302 ( 4.8A);None;0WE A 302 ( 4.4A);None","1.04A","1e7aA-4fs3A:undetectable",null],["1E7A_B_PFLB4001_1","SERUM ALBUMIN","4fs3","ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH] FABI","Staphylococcus aureus",5,"LEU A 208;ILE A 207;ASN A 205;VAL A 201;GLY A 202","None;0WE A 302 ( 4.8A);None;0WE A 302 ( 4.4A);None","1.02A","1e7aB-4fs3A:undetectable","1e7aA-4fs3A:18.26"],["3QXY_B_SAMB6735_0","N-LYSINE METHYLTRANSFERASE SETD6;TRANSCRIPTION FACTOR P65","4fs3","ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH] FABI","Staphylococcus aureus",5,"VAL A 248;GLY A 191;TYR A 147;ALA A  21;TYR A  91","None;None;0WE A 302 ( 3.8A);None;None","1.34A","3qxyB-4fs3A:undetectable;3qxyQ-4fs3A:undetectable","1e7aB-4fs3A:18.26"],["5VKQ_B_PCFB1802_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","4fs3","ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH] FABI","Staphylococcus aureus",4,"SER A 189;VAL A 221;PRO A 192;ILE A 207","None;None;0WD A 301 (-4.8A);0WE A 302 ( 4.8A)","1.23A","5vkqA-4fs3A:undetectable;5vkqB-4fs3A:undetectable","3qxyB-4fs3A:20.59;3qxyQ-4fs3A:7.83"],["5VKQ_D_PCFD1803_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","4fs3","ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH] FABI","Staphylococcus aureus",4,"SER A 189;VAL A 221;PRO A 192;ILE A 207","None;None;0WD A 301 (-4.8A);0WE A 302 ( 4.8A)","1.22A","5vkqC-4fs3A:undetectable;5vkqD-4fs3A:undetectable","5vkqA-4fs3A:9.74;5vkqB-4fs3A:9.74"]]