SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1nr3'

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.	2BJF_A_DXCA330_0 (CHOLOYLGLYCINE HYDROLASE)	1nr3	DNA-BINDING PROTEIN TFX (Methanothermobac ter thermautotrophic us)	5 / 12	ALA A 24 ILE A 79 ILE A 11 THR A 84 LEU A 88	None	1.14A	2bjfA-1nr3A: undetectable	2bjfA-1nr3A: 18.24
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.	2RLC_A_CHDA332_0 (CHOLOYLGLYCINE HYDROLASE)	1nr3	DNA-BINDING PROTEIN TFX (Methanothermobac ter thermautotrophic us)	5 / 12	ALA A 24 ILE A 79 ILE A 11 THR A 84 LEU A 88	None	1.17A	2rlcA-1nr3A: 0.0	2rlcA-1nr3A: 22.01
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.	3F8W_B_ADNB301_1 (PURINE-NUCLEOSIDE PHOSPHORYLASE)	1nr3	DNA-BINDING PROTEIN TFX (Methanothermobac ter thermautotrophic us)	5 / 12	SER A 23 GLY A 75 ASN A 72 HIS A 80 VAL A 78	None	1.36A	3f8wB-1nr3A: undetectable	3f8wB-1nr3A: 17.13
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.	3OXV_A_478A200_1 (HIV-1 PROTEASE)	1nr3	DNA-BINDING PROTEIN TFX (Methanothermobac ter thermautotrophic us)	4 / 6	GLU A 115 PRO A 49 ARG A 112 GLY A 114	None	1.32A	3oxvA-1nr3A: undetectable	3oxvA-1nr3A: 21.09

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2BJF_A_DXCA330_0","CHOLOYLGLYCINE HYDROLASE","1nr3","DNA-BINDING PROTEIN TFX","Methanothermobacter thermautotrophicus",5,"ALA A  24;ILE A  79;ILE A  11;THR A  84;LEU A  88","None","1.14A","2bjfA-1nr3A:undetectable","2bjfA-1nr3A:18.24"],["2RLC_A_CHDA332_0","CHOLOYLGLYCINE HYDROLASE","1nr3","DNA-BINDING PROTEIN TFX","Methanothermobacter thermautotrophicus",5,"ALA A  24;ILE A  79;ILE A  11;THR A  84;LEU A  88","None","1.17A","2rlcA-1nr3A:0.0","2rlcA-1nr3A:22.01"],["3F8W_B_ADNB301_1","PURINE-NUCLEOSIDE PHOSPHORYLASE","1nr3","DNA-BINDING PROTEIN TFX","Methanothermobacter thermautotrophicus",5,"SER A  23;GLY A  75;ASN A  72;HIS A  80;VAL A  78","None","1.36A","3f8wB-1nr3A:undetectable","3f8wB-1nr3A:17.13"],["3OXV_A_478A200_1","HIV-1 PROTEASE","1nr3","DNA-BINDING PROTEIN TFX","Methanothermobacter thermautotrophicus",4,"GLU A 115;PRO A  49;ARG A 112;GLY A 114","None","1.32A","3oxvA-1nr3A:undetectable","3oxvA-1nr3A:21.09"]]