SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2CH'

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.	1D4F_B_ADNB602_1 (S-ADENOSYLHOMOCYSTEI NE HYDROLASE)	4qor	CATALASE (Bacillus pumilus)	5 / 12	LEU A 150 ASP A 447 HIS A 100 LEU A 108 GLY A 186	2CH A 503 (-4.2A) 2CH A 503 ( 4.6A) None None None	1.43A	1d4fB-4qorA: undetectable	1d4fB-4qorA: 22.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4QOP_A_HQEA503_1 (CATALASE)	4qor	CATALASE (Bacillus pumilus)	9 / 9	ILE A 99 ASP A 110 PRO A 111 PHE A 136 LEU A 150 TYR A 164 LEU A 181 PHE A 182 ASP A 447	None 2CH A 503 (-4.1A) None 2CH A 503 (-4.1A) 2CH A 503 (-4.2A) 2CH A 503 (-4.1A) 2CH A 503 (-4.8A) 2CH A 503 ( 4.8A) 2CH A 503 ( 4.6A)	0.11A	4qopA-4qorA: 64.6	4qopA-4qorA: 100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4QOP_B_HQEB503_1 (CATALASE)	4qor	CATALASE (Bacillus pumilus)	9 / 9	ILE A 99 ASP A 110 PRO A 111 PHE A 136 LEU A 150 TYR A 164 LEU A 181 PHE A 182 ASP A 447	None 2CH A 503 (-4.1A) None 2CH A 503 (-4.1A) 2CH A 503 (-4.2A) 2CH A 503 (-4.1A) 2CH A 503 (-4.8A) 2CH A 503 ( 4.8A) 2CH A 503 ( 4.6A)	0.12A	4qopB-4qorA: 64.3	4qopB-4qorA: 100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4QOP_C_HQEC503_1 (CATALASE)	4qor	CATALASE (Bacillus pumilus)	8 / 8	ILE A 99 ASP A 110 PRO A 111 PHE A 136 LEU A 150 TYR A 164 LEU A 181 PHE A 182	None 2CH A 503 (-4.1A) None 2CH A 503 (-4.1A) 2CH A 503 (-4.2A) 2CH A 503 (-4.1A) 2CH A 503 (-4.8A) 2CH A 503 ( 4.8A)	0.12A	4qopC-4qorA: 64.4	4qopC-4qorA: 100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4QOP_D_HQED503_1 (CATALASE)	4qor	CATALASE (Bacillus pumilus)	9 / 9	ILE A 99 ASP A 110 PRO A 111 LEU A 150 GLN A 159 TYR A 164 LEU A 181 PHE A 182 ASP A 447	None 2CH A 503 (-4.1A) None 2CH A 503 (-4.2A) 2CH A 503 ( 4.5A) 2CH A 503 (-4.1A) 2CH A 503 (-4.8A) 2CH A 503 ( 4.8A) 2CH A 503 ( 4.6A)	0.10A	4qopD-4qorA: 64.5	4qopD-4qorA: 100.00

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1D4F_B_ADNB602_1","S-ADENOSYLHOMOCYSTEINE HYDROLASE","4qor","CATALASE","Bacillus pumilus",5,"LEU A 150;ASP A 447;HIS A 100;LEU A 108;GLY A 186","2CH A 503 (-4.2A);2CH A 503 ( 4.6A);None;None;None","1.43A","1d4fB-4qorA:undetectable",null],["4QOP_A_HQEA503_1","CATALASE","4qor","CATALASE","Bacillus pumilus",9,"ILE A  99;ASP A 110;PRO A 111;PHE A 136;LEU A 150;TYR A 164;LEU A 181;PHE A 182;ASP A 447","None;2CH A 503 (-4.1A);None;2CH A 503 (-4.1A);2CH A 503 (-4.2A);2CH A 503 (-4.1A);2CH A 503 (-4.8A);2CH A 503 ( 4.8A);2CH A 503 ( 4.6A)","0.11A","4qopA-4qorA:64.6","1d4fB-4qorA:22.52"],["4QOP_B_HQEB503_1","CATALASE","4qor","CATALASE","Bacillus pumilus",9,"ILE A  99;ASP A 110;PRO A 111;PHE A 136;LEU A 150;TYR A 164;LEU A 181;PHE A 182;ASP A 447","None;2CH A 503 (-4.1A);None;2CH A 503 (-4.1A);2CH A 503 (-4.2A);2CH A 503 (-4.1A);2CH A 503 (-4.8A);2CH A 503 ( 4.8A);2CH A 503 ( 4.6A)","0.12A","4qopB-4qorA:64.3","4qopA-4qorA:100.00"],["4QOP_C_HQEC503_1","CATALASE","4qor","CATALASE","Bacillus pumilus",8,"ILE A  99;ASP A 110;PRO A 111;PHE A 136;LEU A 150;TYR A 164;LEU A 181;PHE A 182","None;2CH A 503 (-4.1A);None;2CH A 503 (-4.1A);2CH A 503 (-4.2A);2CH A 503 (-4.1A);2CH A 503 (-4.8A);2CH A 503 ( 4.8A)","0.12A","4qopC-4qorA:64.4","4qopB-4qorA:100.00"],["4QOP_D_HQED503_1","CATALASE","4qor","CATALASE","Bacillus pumilus",9,"ILE A  99;ASP A 110;PRO A 111;LEU A 150;GLN A 159;TYR A 164;LEU A 181;PHE A 182;ASP A 447","None;2CH A 503 (-4.1A);None;2CH A 503 (-4.2A);2CH A 503 ( 4.5A);2CH A 503 (-4.1A);2CH A 503 (-4.8A);2CH A 503 ( 4.8A);2CH A 503 ( 4.6A)","0.10A","4qopD-4qorA:64.5","4qopC-4qorA:100.00"]]