SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hrg'

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.	2W3M_B_FOLB1188_0 (DIHYDROFOLATE REDUCTASE)	3hrg	UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD (Bacteroides thetaiotaomicron)	5 / 12	ILE A 70 GLN A 142 ASN A 246 TYR A 134 THR A 126	None	1.24A	2w3mB-3hrgA: undetectable	2w3mB-3hrgA: 20.47
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.	4M11_D_MXMD606_1 (PROSTAGLANDIN G/H SYNTHASE 2)	3hrg	UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD (Bacteroides thetaiotaomicron)	5 / 12	VAL A 202 ILE A 235 LEU A 227 VAL A 166 ALA A 164	None	1.37A	4m11D-3hrgA: undetectable	4m11D-3hrgA: 19.44
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.	4R38_A_RBFA201_2 (BLUE-LIGHT-ACTIVATED HISTIDINE KINASE 2)	3hrg	UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD (Bacteroides thetaiotaomicron)	4 / 8	ILE A 152 VAL A 116 LEU A 111 ILE A 118	None	0.81A	4r38A-3hrgA: undetectable	4r38A-3hrgA: 20.23
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.	6C2M_D_SUED1202_1 (NS3 PROTEASE)	3hrg	UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD (Bacteroides thetaiotaomicron)	4 / 9	PHE A 21 VAL A 54 LEU A 36 ASP A 59	None	0.99A	6c2mD-3hrgA: undetectable	6c2mD-3hrgA: 14.35
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.	6NKN_J_CHDJ101_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	3hrg	UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD (Bacteroides thetaiotaomicron)	3 / 3	ARG A 15 PHE A 139 PHE A 21	None	1.02A	6nknC-3hrgA: undetectable 6nknJ-3hrgA: undetectable	6nknC-3hrgA: 21.75 6nknJ-3hrgA: 16.24

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2W3M_B_FOLB1188_0","DIHYDROFOLATE REDUCTASE","3hrg","UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD","Bacteroides thetaiotaomicron",5,"ILE A  70;GLN A 142;ASN A 246;TYR A 134;THR A 126","None","1.24A","2w3mB-3hrgA:undetectable","2w3mB-3hrgA:20.47"],["4M11_D_MXMD606_1","PROSTAGLANDIN G\/H SYNTHASE 2","3hrg","UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD","Bacteroides thetaiotaomicron",5,"VAL A 202;ILE A 235;LEU A 227;VAL A 166;ALA A 164","None","1.37A","4m11D-3hrgA:undetectable","4m11D-3hrgA:19.44"],["4R38_A_RBFA201_2","BLUE-LIGHT-ACTIVATED HISTIDINE KINASE 2","3hrg","UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD","Bacteroides thetaiotaomicron",4,"ILE A 152;VAL A 116;LEU A 111;ILE A 118","None","0.81A","4r38A-3hrgA:undetectable","4r38A-3hrgA:20.23"],["6C2M_D_SUED1202_1","NS3 PROTEASE","3hrg","UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD","Bacteroides thetaiotaomicron",4,"PHE A  21;VAL A  54;LEU A  36;ASP A  59","None","0.99A","6c2mD-3hrgA:undetectable","6c2mD-3hrgA:14.35"],["6NKN_J_CHDJ101_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","3hrg","UNCHARACTERIZED PROTEIN BT_3980 WITH ACTIN-LIKE ATPASE FOLD","Bacteroides thetaiotaomicron",3,"ARG A  15;PHE A 139;PHE A  21","None","1.02A","6nknC-3hrgA:undetectable;6nknJ-3hrgA:undetectable","6nknC-3hrgA:21.75;6nknJ-3hrgA:16.24"]]