SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4qpk'

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.	1QCA_A_FUAA221_1 (TYPE III CHLORAMPHENICOL ACETYLTRANSFERASE)	4qpk	PHOSPHOTRANSFERASE (Brucella abortus)	4 / 7	THR A 89 PHE A 99 PHE A 64 LEU A 137	None None GOL A 301 (-4.5A) None	1.09A	1qcaA-4qpkA: undetectable	1qcaA-4qpkA: 18.25
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.	3QXV_E_MTXE2000_1 (ANTI-METHOTREXATE CDR1-4 GRAFT VHH)	4qpk	PHOSPHOTRANSFERASE (Brucella abortus)	5 / 12	ALA A 65 ARG A 19 SER A 26 ALA A 60 TYR A 91	GOL A 301 (-3.6A) GOL A 302 (-3.0A) None None GOL A 301 (-4.9A)	1.30A	3qxvE-4qpkA: undetectable	3qxvE-4qpkA: 20.00
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.	5OG9_A_TESA503_1 (-)	4qpk	PHOSPHOTRANSFERASE (Brucella abortus)	5 / 9	LEU A 186 VAL A 5 LEU A 3 LEU A 16 PRO A 170	None	1.30A	5og9A-4qpkA: undetectable	5og9A-4qpkA: 20.85
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.	5Y7P_E_CHDE401_0 (BILE SALT HYDROLASE)	4qpk	PHOSPHOTRANSFERASE (Brucella abortus)	4 / 8	ILE A 148 LEU A 116 LEU A 187 ALA A 188	None	0.82A	5y7pE-4qpkA: undetectable	5y7pE-4qpkA: 21.69

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1QCA_A_FUAA221_1","TYPE III CHLORAMPHENICOL ACETYLTRANSFERASE","4qpk","PHOSPHOTRANSFERASE","Brucella abortus",4,"THR A  89;PHE A  99;PHE A  64;LEU A 137","None;None;GOL A 301 (-4.5A);None","1.09A","1qcaA-4qpkA:undetectable","1qcaA-4qpkA:18.25"],["3QXV_E_MTXE2000_1","ANTI-METHOTREXATE CDR1-4 GRAFT VHH","4qpk","PHOSPHOTRANSFERASE","Brucella abortus",5,"ALA A  65;ARG A  19;SER A  26;ALA A  60;TYR A  91","GOL A 301 (-3.6A);GOL A 302 (-3.0A);None;None;GOL A 301 (-4.9A)","1.30A","3qxvE-4qpkA:undetectable","3qxvE-4qpkA:20.00"],["5OG9_A_TESA503_1","-","4qpk","PHOSPHOTRANSFERASE","Brucella abortus",5,"LEU A 186;VAL A   5;LEU A   3;LEU A  16;PRO A 170","None","1.30A","5og9A-4qpkA:undetectable","5og9A-4qpkA:20.85"],["5Y7P_E_CHDE401_0","BILE SALT HYDROLASE","4qpk","PHOSPHOTRANSFERASE","Brucella abortus",4,"ILE A 148;LEU A 116;LEU A 187;ALA A 188","None","0.82A","5y7pE-4qpkA:undetectable","5y7pE-4qpkA:21.69"]]