SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qyx'

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.	1I7Z_A_COCA301_2 (CHIMERA OF IG KAPPA CHAIN: HUMAN CONSTANT REGION AND MOUSE VARIABLE REGION CHIMERA OF IG GAMMA-1 CHAIN: HUMAN CONSTANT REGION AND MOUSE VARIABLE REGION)	3qyx	ESX-1 SECRETION-ASSOCIATED REGULATOR ESPR (Mycobacterium tuberculosis)	4 / 5	TYR A 75 GLU A 83 TYR A 82 ASP A 79	None	1.50A	1i7zB-3qyxA: undetectable	1i7zB-3qyxA: 21.69
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.	4J03_A_FVSA603_1 (BIFUNCTIONAL EPOXIDE HYDROLASE 2)	3qyx	ESX-1 SECRETION-ASSOCIATED REGULATOR ESPR (Mycobacterium tuberculosis)	5 / 12	ILE A 31 PHE A 14 LEU A 85 LEU A 89 LEU A 65	None	1.28A	4j03A-3qyxA: undetectable	4j03A-3qyxA: 14.05
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.	5ZJI_A_PQNA844_1 (PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1 PHOTOSYSTEM I REACTION CENTER SUBUNIT IX)	3qyx	ESX-1 SECRETION-ASSOCIATED REGULATOR ESPR (Mycobacterium tuberculosis)	5 / 10	SER A 58 GLY A 59 ILE A 39 ALA A 64 LEU A 65	None	1.09A	5zjiA-3qyxA: undetectable 5zjiJ-3qyxA: undetectable	5zjiA-3qyxA: 19.35 5zjiJ-3qyxA: 13.85

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1I7Z_A_COCA301_2","CHIMERA OF IG KAPPA CHAIN: HUMAN CONSTANT REGION AND MOUSE VARIABLE REGION;CHIMERA OF IG GAMMA-1 CHAIN: HUMAN CONSTANT REGION AND MOUSE VARIABLE REGION","3qyx","ESX-1 SECRETION-ASSOCIATED REGULATOR ESPR","Mycobacterium tuberculosis",4,"TYR A  75;GLU A  83;TYR A  82;ASP A  79","None","1.50A","1i7zB-3qyxA:undetectable","1i7zB-3qyxA:21.69"],["4J03_A_FVSA603_1","BIFUNCTIONAL EPOXIDE HYDROLASE 2","3qyx","ESX-1 SECRETION-ASSOCIATED REGULATOR ESPR","Mycobacterium tuberculosis",5,"ILE A  31;PHE A  14;LEU A  85;LEU A  89;LEU A  65","None","1.28A","4j03A-3qyxA:undetectable","4j03A-3qyxA:14.05"],["5ZJI_A_PQNA844_1","PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1;PHOTOSYSTEM I REACTION CENTER SUBUNIT IX","3qyx","ESX-1 SECRETION-ASSOCIATED REGULATOR ESPR","Mycobacterium tuberculosis",5,"SER A  58;GLY A  59;ILE A  39;ALA A  64;LEU A  65","None","1.09A","5zjiA-3qyxA:undetectable;5zjiJ-3qyxA:undetectable","5zjiA-3qyxA:19.35;5zjiJ-3qyxA:13.85"]]