SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qva'

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.	2Q63_A_1UNA1001_2 (PROTEASE RETROPEPSIN)	3qva	TRANSTHYRETIN-LIKE PROTEIN (Klebsiella pneumoniae)	3 / 3	ARG A 76 ASN A -6 THR A 30	None	0.64A	2q63A-3qvaA: undetectable	2q63A-3qvaA: 22.95
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.	4KYA_D_FOLD703_0 (BIFUNCTIONAL DIHYDROFOLATE REDUCTASE-THYMIDYLAT E SYNTHASE)	3qva	TRANSTHYRETIN-LIKE PROTEIN (Klebsiella pneumoniae)	5 / 12	VAL A 22 ALA A 77 TRP A 102 LEU A 4 THR A 61	None	1.48A	4kyaD-3qvaA: undetectable	4kyaD-3qvaA: 16.77
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.	4KYA_F_FOLF703_0 (BIFUNCTIONAL DIHYDROFOLATE REDUCTASE-THYMIDYLAT E SYNTHASE)	3qva	TRANSTHYRETIN-LIKE PROTEIN (Klebsiella pneumoniae)	5 / 12	VAL A 22 ALA A 77 TRP A 102 LEU A 4 THR A 61	None	1.47A	4kyaF-3qvaA: undetectable	4kyaF-3qvaA: 16.77
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.	4KYA_H_FOLH703_0 (BIFUNCTIONAL DIHYDROFOLATE REDUCTASE-THYMIDYLAT E SYNTHASE)	3qva	TRANSTHYRETIN-LIKE PROTEIN (Klebsiella pneumoniae)	5 / 12	VAL A 22 ALA A 77 TRP A 102 LEU A 4 THR A 61	None	1.45A	4kyaH-3qvaA: undetectable	4kyaH-3qvaA: 16.77

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2Q63_A_1UNA1001_2","PROTEASE RETROPEPSIN","3qva","TRANSTHYRETIN-LIKE PROTEIN","Klebsiella pneumoniae",3,"ARG A  76;ASN A  -6;THR A  30","None","0.64A","2q63A-3qvaA:undetectable","2q63A-3qvaA:22.95"],["4KYA_D_FOLD703_0","BIFUNCTIONAL DIHYDROFOLATE REDUCTASE-THYMIDYLATE SYNTHASE","3qva","TRANSTHYRETIN-LIKE PROTEIN","Klebsiella pneumoniae",5,"VAL A  22;ALA A  77;TRP A 102;LEU A   4;THR A  61","None","1.48A","4kyaD-3qvaA:undetectable","4kyaD-3qvaA:16.77"],["4KYA_F_FOLF703_0","BIFUNCTIONAL DIHYDROFOLATE REDUCTASE-THYMIDYLATE SYNTHASE","3qva","TRANSTHYRETIN-LIKE PROTEIN","Klebsiella pneumoniae",5,"VAL A  22;ALA A  77;TRP A 102;LEU A   4;THR A  61","None","1.47A","4kyaF-3qvaA:undetectable","4kyaF-3qvaA:16.77"],["4KYA_H_FOLH703_0","BIFUNCTIONAL DIHYDROFOLATE REDUCTASE-THYMIDYLATE SYNTHASE","3qva","TRANSTHYRETIN-LIKE PROTEIN","Klebsiella pneumoniae",5,"VAL A  22;ALA A  77;TRP A 102;LEU A   4;THR A  61","None","1.45A","4kyaH-3qvaA:undetectable","4kyaH-3qvaA:16.77"]]