SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qrq'

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.	4XI3_A_29SA601_1 (ESTROGEN RECEPTOR)	3qrq	PUTATIVE UNCHARACTERIZED PROTEIN TTHB192 (Thermus thermophilus)	5 / 12	THR A 152 ALA A 173 LEU A 175 LEU A 202 PRO A 50	None	1.33A	4xi3A-3qrqA: undetectable	4xi3A-3qrqA: 22.06
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.	4ZGF_A_BEZA210_0 (UNCHARACTERIZED PROTEIN)	3qrq	PUTATIVE UNCHARACTERIZED PROTEIN TTHB192 (Thermus thermophilus)	4 / 4	VAL A 114 ALA A 115 ASN A 102 GLN A 172	U B 5 ( 4.3A) U B 5 ( 3.4A) U B 5 ( 3.0A) G B 4 ( 4.1A)	1.43A	4zgfA-3qrqA: undetectable	4zgfA-3qrqA: 21.53
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.	5MTH_A_ACTA301_0 (ANTIBODY FAB HEAVY CHAIN)	3qrq	PUTATIVE UNCHARACTERIZED PROTEIN TTHB192 (Thermus thermophilus)	4 / 4	THR A 63 VAL A 61 PRO A 82 THR A 4	None	1.44A	5mthA-3qrqA: undetectable 5mthH-3qrqA: undetectable	5mthA-3qrqA: 19.42 5mthH-3qrqA: 19.42
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.	5XDX_C_CHDC308_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT VIIA-HEART)	3qrq	PUTATIVE UNCHARACTERIZED PROTEIN TTHB192 (Thermus thermophilus)	4 / 5	LEU A 137 PHE A 135 LEU A 126 PHE A 176	None	1.27A	5xdxC-3qrqA: undetectable 5xdxJ-3qrqA: undetectable	5xdxC-3qrqA: 21.71 5xdxJ-3qrqA: 11.11
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.	5XDX_P_CHDP306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT VIIA-HEART)	3qrq	PUTATIVE UNCHARACTERIZED PROTEIN TTHB192 (Thermus thermophilus)	4 / 5	LEU A 137 PHE A 135 LEU A 126 PHE A 176	None	1.22A	5xdxP-3qrqA: undetectable 5xdxW-3qrqA: undetectable	5xdxP-3qrqA: 21.71 5xdxW-3qrqA: 11.11

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["4XI3_A_29SA601_1","ESTROGEN RECEPTOR","3qrq","PUTATIVE UNCHARACTERIZED PROTEIN TTHB192","Thermus thermophilus",5,"THR A 152;ALA A 173;LEU A 175;LEU A 202;PRO A  50","None","1.33A","4xi3A-3qrqA:undetectable","4xi3A-3qrqA:22.06"],["4ZGF_A_BEZA210_0","UNCHARACTERIZED PROTEIN","3qrq","PUTATIVE UNCHARACTERIZED PROTEIN TTHB192","Thermus thermophilus",4,"VAL A 114;ALA A 115;ASN A 102;GLN A 172","  U B   5 ( 4.3A);  U B   5 ( 3.4A);  U B   5 ( 3.0A);  G B   4 ( 4.1A)","1.43A","4zgfA-3qrqA:undetectable","4zgfA-3qrqA:21.53"],["5MTH_A_ACTA301_0","ANTIBODY FAB HEAVY CHAIN","3qrq","PUTATIVE UNCHARACTERIZED PROTEIN TTHB192","Thermus thermophilus",4,"THR A  63;VAL A  61;PRO A  82;THR A   4","None","1.44A","5mthA-3qrqA:undetectable;5mthH-3qrqA:undetectable","5mthA-3qrqA:19.42;5mthH-3qrqA:19.42"],["5XDX_C_CHDC308_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT VIIA-HEART","3qrq","PUTATIVE UNCHARACTERIZED PROTEIN TTHB192","Thermus thermophilus",4,"LEU A 137;PHE A 135;LEU A 126;PHE A 176","None","1.27A","5xdxC-3qrqA:undetectable;5xdxJ-3qrqA:undetectable","5xdxC-3qrqA:21.71;5xdxJ-3qrqA:11.11"],["5XDX_P_CHDP306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT VIIA-HEART","3qrq","PUTATIVE UNCHARACTERIZED PROTEIN TTHB192","Thermus thermophilus",4,"LEU A 137;PHE A 135;LEU A 126;PHE A 176","None","1.22A","5xdxP-3qrqA:undetectable;5xdxW-3qrqA:undetectable","5xdxP-3qrqA:21.71;5xdxW-3qrqA:11.11"]]