SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1HS'

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.	3MG0_2_BO221405_1 (PROTEASOME COMPONENT PRE3 PROTEASOME COMPONENT PUP1)	4itu	SHORT-CHAIN DEHYDROGENASE/REDUCT ASE SDR (Xanthobacter autotrophicus)	5 / 12	ALA A 95 GLY A 149 ALA A 145 SER A 99 SER A 143	1HS A 302 ( 4.6A) None 1HS A 302 ( 4.0A) None 1HS A 302 ( 2.5A)	0.90A	3mg02-4ituA: undetectable 3mg0V-4ituA: undetectable	3mg02-4ituA: 22.58 3mg0V-4ituA: 24.46
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.	4HXY_B_ACAB502_1 (PLM1)	4itu	SHORT-CHAIN DEHYDROGENASE/REDUCT ASE SDR (Xanthobacter autotrophicus)	4 / 7	SER A 143 TYR A 156 MET A 194 LEU A 198	1HS A 302 ( 2.5A) 1HS A 302 ( 4.3A) NAI A 301 (-3.6A) None	1.10A	4hxyB-4ituA: 19.6	4hxyB-4ituA: 23.30
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.	5G08_A_Z80A1187_1 (FREQUENIN 2)	4itu	SHORT-CHAIN DEHYDROGENASE/REDUCT ASE SDR (Xanthobacter autotrophicus)	4 / 6	ILE A 150 TYR A 156 PHE A 97 THR A 192	1HS A 302 ( 4.3A) 1HS A 302 ( 4.3A) None NAI A 301 (-2.8A)	1.29A	5g08A-4ituA: undetectable	5g08A-4ituA: 20.80

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["3MG0_2_BO221405_1","PROTEASOME COMPONENT PRE3;PROTEASOME COMPONENT PUP1","4itu","SHORT-CHAIN DEHYDROGENASE\/REDUCTASE SDR","Xanthobacter autotrophicus",5,"ALA A  95;GLY A 149;ALA A 145;SER A  99;SER A 143","1HS A 302 ( 4.6A);None;1HS A 302 ( 4.0A);None;1HS A 302 ( 2.5A)","0.90A","3mg02-4ituA:undetectable;3mg0V-4ituA:undetectable",null],["4HXY_B_ACAB502_1","PLM1","4itu","SHORT-CHAIN DEHYDROGENASE\/REDUCTASE SDR","Xanthobacter autotrophicus",4,"SER A 143;TYR A 156;MET A 194;LEU A 198","1HS A 302 ( 2.5A);1HS A 302 ( 4.3A);NAI A 301 (-3.6A);None","1.10A","4hxyB-4ituA:19.6","3mg02-4ituA:22.58;3mg0V-4ituA:24.46"],["5G08_A_Z80A1187_1","FREQUENIN 2","4itu","SHORT-CHAIN DEHYDROGENASE\/REDUCTASE SDR","Xanthobacter autotrophicus",4,"ILE A 150;TYR A 156;PHE A  97;THR A 192","1HS A 302 ( 4.3A);1HS A 302 ( 4.3A);None;NAI A 301 (-2.8A)","1.29A","5g08A-4ituA:undetectable","4hxyB-4ituA:23.30"]]