SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'BSU'

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.	1C3S_A_SHHA952_1 (HDLP (HISTONE DEACETYLASE-LIKE PROTEIN))	5cw2	PUTATIVE EPOXIDE HYDROLASE EPHA (Mycolicibacteriu m thermoresistibil e)	5 / 11	PRO C 276 HIS C 102 PHE C 262 ASP C 103 LEU C 271	None None None BSU C 401 (-2.8A) None	1.48A	1c3sA-5cw2C: undetectable	1c3sA-5cw2C: 19.64
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.	1ZZ1_A_SHHA2452_1 (HISTONE DEACETYLASE-LIKE AMIDOHYDROLASE)	5cw2	PUTATIVE EPOXIDE HYDROLASE EPHA (Mycolicibacteriu m thermoresistibil e)	5 / 11	LEU C 167 ILE C 201 HIS C 297 ASP C 103 TYR C 238	None None BSU C 401 (-3.8A) BSU C 401 (-2.8A) BSU C 401 (-4.4A)	1.20A	1zz1A-5cw2C: undetectable	1zz1A-5cw2C: 22.19
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.	4CD2_A_FOLA207_0 (DIHYDROFOLATE REDUCTASE)	5cw2	PUTATIVE EPOXIDE HYDROLASE EPHA (Mycolicibacteriu m thermoresistibil e)	5 / 12	ALA C 163 GLU C 166 ILE C 201 PHE C 200 LEU C 182	None None None None BSU C 401 ( 4.9A)	1.04A	4cd2A-5cw2C: undetectable	4cd2A-5cw2C: 16.82
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)	5cw2	PUTATIVE EPOXIDE HYDROLASE EPHA (Mycolicibacteriu m thermoresistibil e)	6 / 12	ASP C 103 TYR C 153 PHE C 157 TYR C 238 HIS C 297 TRP C 298	BSU C 401 (-2.8A) BSU C 401 (-4.4A) None BSU C 401 (-4.4A) BSU C 401 (-3.8A) None	0.38A	4j03A-5cw2C: 39.6	4j03A-5cw2C: 26.23

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1C3S_A_SHHA952_1","HDLP (HISTONE DEACETYLASE-LIKE PROTEIN)","5cw2","PUTATIVE EPOXIDE HYDROLASE EPHA","Mycolicibacterium thermoresistibile",5,"PRO C 276;HIS C 102;PHE C 262;ASP C 103;LEU C 271","None;None;None;BSU C 401 (-2.8A);None","1.48A","1c3sA-5cw2C:undetectable",null],["1ZZ1_A_SHHA2452_1","HISTONE DEACETYLASE-LIKE AMIDOHYDROLASE","5cw2","PUTATIVE EPOXIDE HYDROLASE EPHA","Mycolicibacterium thermoresistibile",5,"LEU C 167;ILE C 201;HIS C 297;ASP C 103;TYR C 238","None;None;BSU C 401 (-3.8A);BSU C 401 (-2.8A);BSU C 401 (-4.4A)","1.20A","1zz1A-5cw2C:undetectable","1c3sA-5cw2C:19.64"],["4CD2_A_FOLA207_0","DIHYDROFOLATE REDUCTASE","5cw2","PUTATIVE EPOXIDE HYDROLASE EPHA","Mycolicibacterium thermoresistibile",5,"ALA C 163;GLU C 166;ILE C 201;PHE C 200;LEU C 182","None;None;None;None;BSU C 401 ( 4.9A)","1.04A","4cd2A-5cw2C:undetectable","1zz1A-5cw2C:22.19"],["4J03_A_FVSA603_1","BIFUNCTIONAL EPOXIDE HYDROLASE 2","5cw2","PUTATIVE EPOXIDE HYDROLASE EPHA","Mycolicibacterium thermoresistibile",6,"ASP C 103;TYR C 153;PHE C 157;TYR C 238;HIS C 297;TRP C 298","BSU C 401 (-2.8A);BSU C 401 (-4.4A);None;BSU C 401 (-4.4A);BSU C 401 (-3.8A);None","0.38A","4j03A-5cw2C:39.6","4cd2A-5cw2C:16.82"]]