SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5YA'

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.	3AVP_A_MV2A313_1 (PANTOTHENATE KINASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	4 / 7	ASP B 81 HIS B 135 LEU B 223 ILE B 190	5YA B 302 ( 2.5A) ZN B 303 ( 3.7A) None None	0.94A	3avpA-5o6yB: undetectable	3avpA-5o6yB: 11.36
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.	3DZG_B_NCAB302_0 (ADP-RIBOSYL CYCLASE 1)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	4 / 7	LEU B 232 ASP B 81 SER B 235 THR B 197	None 5YA B 302 ( 2.5A) None None	1.15A	3dzgB-5o6yB: undetectable	3dzgB-5o6yB: undetectable
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.	5NCD_A_ACTA301_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	5 / 6	ASP B 80 ASP B 81 HIS B 131 HIS B 135 HIS B 225	5YA B 302 (-3.7A) 5YA B 302 ( 2.5A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) 5YA B 302 (-4.3A)	0.51A	5ncdA-5o6yB: 24.6 5ncdD-5o6yB: 24.8	5ncdA-5o6yB: undetectable 5ncdD-5o6yB: undetectable
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.	5NCD_C_ACTC301_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	5 / 6	ASP B 80 ASP B 81 HIS B 131 HIS B 135 HIS B 225	5YA B 302 (-3.7A) 5YA B 302 ( 2.5A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) 5YA B 302 (-4.3A)	0.43A	5ncdB-5o6yB: 24.8 5ncdC-5o6yB: 24.7	5ncdB-5o6yB: undetectable 5ncdC-5o6yB: undetectable
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.	5NCD_D_ACTD301_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	4 / 4	ASP B 80 HIS B 131 HIS B 135 HIS B 225	5YA B 302 (-3.7A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) 5YA B 302 (-4.3A)	0.44A	5ncdD-5o6yB: 24.8	5ncdD-5o6yB: undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	5NEK_B_AZMB302_1 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	6 / 8	ASP B 80 ASP B 81 HIS B 131 HIS B 135 TRP B 200 HIS B 225	5YA B 302 (-3.7A) 5YA B 302 ( 2.5A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) 5YA B 302 ( 4.6A) 5YA B 302 (-4.3A)	0.58A	5nekB-5o6yB: 24.7	5nekB-5o6yB: 36.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	5NEK_D_AZMD302_1 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	7 / 8	ASP B 80 ASP B 81 HIS B 131 HIS B 135 TRP B 193 TRP B 200 HIS B 225	5YA B 302 (-3.7A) 5YA B 302 ( 2.5A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) None 5YA B 302 ( 4.6A) 5YA B 302 (-4.3A)	0.65A	5nekD-5o6yB: 24.5	5nekD-5o6yB: 36.08
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.	5NEL_A_ACTA302_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	5 / 6	ASP B 80 ASP B 81 HIS B 131 HIS B 135 HIS B 225	5YA B 302 (-3.7A) 5YA B 302 ( 2.5A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) 5YA B 302 (-4.3A)	0.53A	5nelA-5o6yB: 24.6 5nelD-5o6yB: 24.5	5nelA-5o6yB: undetectable 5nelD-5o6yB: undetectable
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.	5NEL_C_ACTC302_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	5o6y	PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE (Bacillus cereus)	5 / 6	ASP B 80 HIS B 131 HIS B 135 LEU B 223 HIS B 225	5YA B 302 (-3.7A) ZN B 303 ( 3.4A) ZN B 303 ( 3.7A) None 5YA B 302 (-4.3A)	0.46A	5nelB-5o6yB: 24.6 5nelC-5o6yB: 24.6	5nelB-5o6yB: undetectable 5nelC-5o6yB: undetectable

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["3AVP_A_MV2A313_1","PANTOTHENATE KINASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",4,"ASP B  81;HIS B 135;LEU B 223;ILE B 190","5YA B 302 ( 2.5A); ZN B 303 ( 3.7A);None;None","0.94A","3avpA-5o6yB:undetectable",null],["3DZG_B_NCAB302_0","ADP-RIBOSYL CYCLASE 1","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",4,"LEU B 232;ASP B  81;SER B 235;THR B 197","None;5YA B 302 ( 2.5A);None;None","1.15A","3dzgB-5o6yB:undetectable","3avpA-5o6yB:11.36"],["5NCD_A_ACTA301_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",5,"ASP B  80;ASP B  81;HIS B 131;HIS B 135;HIS B 225","5YA B 302 (-3.7A);5YA B 302 ( 2.5A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);5YA B 302 (-4.3A)","0.51A","5ncdA-5o6yB:24.6;5ncdD-5o6yB:24.8","3dzgB-5o6yB:undetectable"],["5NCD_C_ACTC301_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",5,"ASP B  80;ASP B  81;HIS B 131;HIS B 135;HIS B 225","5YA B 302 (-3.7A);5YA B 302 ( 2.5A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);5YA B 302 (-4.3A)","0.43A","5ncdB-5o6yB:24.8;5ncdC-5o6yB:24.7","5ncdA-5o6yB:undetectable;5ncdD-5o6yB:undetectable"],["5NCD_D_ACTD301_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",4,"ASP B  80;HIS B 131;HIS B 135;HIS B 225","5YA B 302 (-3.7A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);5YA B 302 (-4.3A)","0.44A","5ncdD-5o6yB:24.8","5ncdB-5o6yB:undetectable;5ncdC-5o6yB:undetectable"],["5NEK_B_AZMB302_1","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",6,"ASP B  80;ASP B  81;HIS B 131;HIS B 135;TRP B 200;HIS B 225","5YA B 302 (-3.7A);5YA B 302 ( 2.5A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);5YA B 302 ( 4.6A);5YA B 302 (-4.3A)","0.58A","5nekB-5o6yB:24.7","5ncdD-5o6yB:undetectable"],["5NEK_D_AZMD302_1","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",7,"ASP B  80;ASP B  81;HIS B 131;HIS B 135;TRP B 193;TRP B 200;HIS B 225","5YA B 302 (-3.7A);5YA B 302 ( 2.5A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);None;5YA B 302 ( 4.6A);5YA B 302 (-4.3A)","0.65A","5nekD-5o6yB:24.5","5nekB-5o6yB:36.08"],["5NEL_A_ACTA302_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",5,"ASP B  80;ASP B  81;HIS B 131;HIS B 135;HIS B 225","5YA B 302 (-3.7A);5YA B 302 ( 2.5A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);5YA B 302 (-4.3A)","0.53A","5nelA-5o6yB:24.6;5nelD-5o6yB:24.5","5nekD-5o6yB:36.08"],["5NEL_C_ACTC302_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","5o6y","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","Bacillus cereus",5,"ASP B  80;HIS B 131;HIS B 135;LEU B 223;HIS B 225","5YA B 302 (-3.7A); ZN B 303 ( 3.4A); ZN B 303 ( 3.7A);None;5YA B 302 (-4.3A)","0.46A","5nelB-5o6yB:24.6;5nelC-5o6yB:24.6","5nelA-5o6yB:undetectable;5nelD-5o6yB:undetectable"]]