SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1iv3'

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.	1E7W_A_MTXA301_1 (PTERIDINE REDUCTASE)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	5 / 12	PRO A 26 ASP A 38 LEU A 23 LEU A 116 LEU A 129	None	1.43A	1e7wA-1iv3A: undetectable	1e7wA-1iv3A: 19.31
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.	1ISM_B_NCAB305_0 (BONE MARROW STROMAL CELL ANTIGEN 1)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	4 / 7	HIS A 42 SER A 35 ASP A 36 PHE A 61	MG A1561 (-3.0A) MG A1561 ( 4.7A) None None	1.27A	1ismB-1iv3A: 1.5	1ismB-1iv3A: 20.66
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.	1PK7_B_ADNB1246_1 (PURINE NUCLEOSIDE PHOSPHORYLASE)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	4 / 8	GLY A 4 VAL A 147 SER A 50 ILE A 3	None	0.73A	1pk7B-1iv3A: undetectable	1pk7B-1iv3A: 20.58
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.	2RIW_A_T44A1395_1 (THYROXINE-BINDING GLOBULIN)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	5 / 10	ALA A 39 LEU A 129 LEU A 98 LEU A 96 ARG A 145	None	1.16A	2riwA-1iv3A: 0.0 2riwB-1iv3A: undetectable	2riwA-1iv3A: 18.65 2riwB-1iv3A: 21.79
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.	3ERD_B_DESB800_1 (ESTROGEN RECEPTOR ALPHA)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	5 / 10	ALA A 40 LEU A 129 LEU A 96 HIS A 108 LEU A 112	None	1.45A	3erdB-1iv3A: undetectable	3erdB-1iv3A: 22.09
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.	4Z90_A_4LEA401_1 (GAMMA-AMINOBUTYRIC-A CID RECEPTOR SUBUNIT BETA-1)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	5 / 8	LEU A 44 ALA A 94 LEU A 116 LEU A 98 ALA A 146	None	1.07A	4z90A-1iv3A: 0.0 4z90B-1iv3A: 0.0 4z90C-1iv3A: 0.0 4z90D-1iv3A: 0.0 4z90E-1iv3A: 0.0	4z90A-1iv3A: 18.61 4z90B-1iv3A: 18.61 4z90C-1iv3A: 18.61 4z90D-1iv3A: 18.61 4z90E-1iv3A: 18.61
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.	5HPU_A_IPHA101_0 (INSULIN, CHAIN A INSULIN, CHAIN B)	1iv3	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Thermus thermophilus)	4 / 4	CYH A 21 LEU A 96 LEU A 116 ALA A 94	None	1.03A	5hpuA-1iv3A: undetectable 5hpuB-1iv3A: undetectable	5hpuA-1iv3A: 6.04 5hpuB-1iv3A: 12.03

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1E7W_A_MTXA301_1","PTERIDINE REDUCTASE","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",5,"PRO A  26;ASP A  38;LEU A  23;LEU A 116;LEU A 129","None","1.43A","1e7wA-1iv3A:undetectable","1e7wA-1iv3A:19.31"],["1ISM_B_NCAB305_0","BONE MARROW STROMAL CELL ANTIGEN 1","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",4,"HIS A  42;SER A  35;ASP A  36;PHE A  61"," MG A1561 (-3.0A); MG A1561 ( 4.7A);None;None","1.27A","1ismB-1iv3A:1.5","1ismB-1iv3A:20.66"],["1PK7_B_ADNB1246_1","PURINE NUCLEOSIDE PHOSPHORYLASE","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",4,"GLY A   4;VAL A 147;SER A  50;ILE A   3","None","0.73A","1pk7B-1iv3A:undetectable","1pk7B-1iv3A:20.58"],["2RIW_A_T44A1395_1","THYROXINE-BINDING GLOBULIN;THYROXINE-BINDING GLOBULIN","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",5,"ALA A  39;LEU A 129;LEU A  98;LEU A  96;ARG A 145","None","1.16A","2riwA-1iv3A:0.0;2riwB-1iv3A:undetectable","2riwA-1iv3A:18.65;2riwB-1iv3A:21.79"],["3ERD_B_DESB800_1","ESTROGEN RECEPTOR ALPHA","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",5,"ALA A  40;LEU A 129;LEU A  96;HIS A 108;LEU A 112","None","1.45A","3erdB-1iv3A:undetectable","3erdB-1iv3A:22.09"],["4Z90_A_4LEA401_1","GAMMA-AMINOBUTYRIC-ACID RECEPTOR SUBUNIT BETA-1;GAMMA-AMINOBUTYRIC-ACID RECEPTOR SUBUNIT BETA-1;GAMMA-AMINOBUTYRIC-ACID RECEPTOR SUBUNIT BETA-1;GAMMA-AMINOBUTYRIC-ACID RECEPTOR SUBUNIT BETA-1;GAMMA-AMINOBUTYRIC-ACID RECEPTOR SUBUNIT BETA-1","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",5,"LEU A  44;ALA A  94;LEU A 116;LEU A  98;ALA A 146","None","1.07A","4z90A-1iv3A:0.0;4z90B-1iv3A:0.0;4z90C-1iv3A:0.0;4z90D-1iv3A:0.0;4z90E-1iv3A:0.0","4z90A-1iv3A:18.61;4z90B-1iv3A:18.61;4z90C-1iv3A:18.61;4z90D-1iv3A:18.61;4z90E-1iv3A:18.61"],["5HPU_A_IPHA101_0","INSULIN, CHAIN A;INSULIN, CHAIN B","1iv3","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Thermus thermophilus",4,"CYH A  21;LEU A  96;LEU A 116;ALA A  94","None","1.03A","5hpuA-1iv3A:undetectable;5hpuB-1iv3A:undetectable","5hpuA-1iv3A:6.04;5hpuB-1iv3A:12.03"]]