SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2ash'

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)

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	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.	1A27_A_ESTA350_1 (17-BETA-HYDROXYSTERO ID-DEHYDROGENASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	SER A 262 GLY A 243 LEU A 248 MET A 339 VAL A 257	None	1.22A	1a27A-2ashA: 2.1	1a27A-2ashA: 22.25
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.	1HXB_A_ROCA100_1 (HIV-1 PROTEASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ASP A 142 GLY A 92 GLY A 242 ILE A 214 ILE A 182	None None EDO A 404 ( 4.5A) EDO A 404 (-4.0A) None	0.87A	1hxbA-2ashA: undetectable	1hxbA-2ashA: 12.86
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.	1LHU_A_ESTA301_1 (SEX HORMONE-BINDING GLOBULIN)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	GLY A 181 MET A 259 LEU A 87 MET A 139 ILE A 182	None	0.90A	1lhuA-2ashA: undetectable	1lhuA-2ashA: 20.27
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.	1V8B_C_ADNC2502_2 (ADENOSYLHOMOCYSTEINA SE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	3 / 3	GLU A 226 THR A 225 LEU A 248	None	0.63A	1v8bC-2ashA: undetectable	1v8bC-2ashA: 22.18
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.	2QO4_A_CHDA130_0 (LIVER-BASIC FATTY ACID BINDING PROTEIN)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 53 VAL A 257 MET A 241 ASP A 261 MET A 17	None None EDO A 404 (-4.4A) None None	1.40A	2qo4A-2ashA: undetectable	2qo4A-2ashA: 16.71
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.	3AG1_J_CHDJ60_0 (CYTOCHROME C OXIDASE POLYPEPTIDE 7A1)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 5	ARG A 255 MET A 224 THR A 221 LEU A 220	None	1.37A	3ag1J-2ashA: undetectable	3ag1J-2ashA: 9.35
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.	3B9L_A_AZZA1010_1 (SERUM ALBUMIN)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 8	LEU A 212 ILE A 209 ARG A 255 GLY A 256	None	0.89A	3b9lA-2ashA: undetectable	3b9lA-2ashA: 20.34
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.	3MWS_B_017B201_1 (HIV-1 PROTEASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	GLY A 50 ALA A 49 ASP A 45 ILE A 53 ILE A 332	None	1.05A	3mwsA-2ashA: undetectable	3mwsA-2ashA: 14.87
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.	4ACB_B_DXCB1473_0 (TRANSLATION ELONGATION FACTOR SELB)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 8	ILE A 202 GLY A 203 PHE A 204 SER A 126	None	0.90A	4acbB-2ashA: 2.5 4acbC-2ashA: 2.3	4acbB-2ashA: 22.04 4acbC-2ashA: 22.04
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.	4E1G_A_LNLA701_1 (PROSTAGLANDIN G/H SYNTHASE 2)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 209 PHE A 240 GLY A 243 SER A 213 GLY A 211	None None None None EDO A 404 (-3.0A)	0.97A	4e1gA-2ashA: 0.1	4e1gA-2ashA: 22.11
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.	4E1G_B_LNLB701_1 (PROSTAGLANDIN G/H SYNTHASE 2)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 209 PHE A 240 GLY A 243 SER A 213 GLY A 211	None None None None EDO A 404 (-3.0A)	0.99A	4e1gB-2ashA: undetectable	4e1gB-2ashA: 22.11
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.	4MWR_A_ZMRA513_2 (NEURAMINIDASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 5	ASP A 105 ARG A 160 TRP A 164 ILE A 103	None	1.39A	4mwrA-2ashA: undetectable	4mwrA-2ashA: 21.92
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.	4MWX_A_ZMRA513_2 (NEURAMINIDASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	3 / 3	ARG A 160 TRP A 164 ILE A 103	None	0.97A	4mwxA-2ashA: undetectable	4mwxA-2ashA: 21.92
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.	4NJV_A_RITA500_1 (PROTEASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	GLY A 50 ALA A 49 ASP A 45 ILE A 53 ILE A 332	None	1.01A	4njvA-2ashA: undetectable	4njvA-2ashA: 14.83
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.	4NJV_D_RITD500_2 (PROTEASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	GLY A 50 ALA A 49 ASP A 45 ILE A 53 ILE A 332	None	1.01A	4njvD-2ashA: undetectable	4njvD-2ashA: 14.83
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.	4QOP_C_HQEC503_1 (CATALASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 8	ILE A 114 PHE A 59 LEU A 63 LEU A 98	None	0.79A	4qopC-2ashA: undetectable	4qopC-2ashA: 21.26
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.	4ZE1_A_X2NA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	GLY A 300 PHE A 29 GLY A 244 LEU A 275 HIS A 330	None None None None ZN A 400 (-3.2A)	1.33A	4ze1A-2ashA: undetectable	4ze1A-2ashA: 21.11
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.	5A06_A_SORA1342_0 (ALDOSE-ALDOSE OXIDOREDUCTASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	ILE A 214 LEU A 212 GLY A 210 GLY A 211	EDO A 404 (-4.0A) None EDO A 404 (-3.4A) EDO A 404 (-3.0A)	0.84A	5a06A-2ashA: undetectable	5a06A-2ashA: 22.25
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.	5A06_B_SORB1342_0 (ALDOSE-ALDOSE OXIDOREDUCTASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	ILE A 214 LEU A 212 GLY A 210 GLY A 211	EDO A 404 (-4.0A) None EDO A 404 (-3.4A) EDO A 404 (-3.0A)	0.82A	5a06B-2ashA: undetectable	5a06B-2ashA: 22.25
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.	5A06_C_SORC1342_0 (ALDOSE-ALDOSE OXIDOREDUCTASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	ILE A 214 LEU A 212 GLY A 210 GLY A 211	EDO A 404 (-4.0A) None EDO A 404 (-3.4A) EDO A 404 (-3.0A)	0.83A	5a06C-2ashA: 2.4	5a06C-2ashA: 22.25
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.	5A06_E_SORE1341_0 (ALDOSE-ALDOSE OXIDOREDUCTASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	ILE A 214 LEU A 212 GLY A 210 GLY A 211	EDO A 404 (-4.0A) None EDO A 404 (-3.4A) EDO A 404 (-3.0A)	0.84A	5a06E-2ashA: undetectable	5a06E-2ashA: 22.25
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.	5A06_F_SORF1341_0 (ALDOSE-ALDOSE OXIDOREDUCTASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	ILE A 214 LEU A 212 GLY A 210 GLY A 211	EDO A 404 (-4.0A) None EDO A 404 (-3.4A) EDO A 404 (-3.0A)	0.85A	5a06F-2ashA: 2.2	5a06F-2ashA: 22.25
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.	5BMV_C_VLBC507_2 (TUBULIN ALPHA-1B CHAIN)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	VAL A 342 ILE A 346 VAL A 253 ILE A 249	None	0.78A	5bmvC-2ashA: undetectable	5bmvC-2ashA: 21.73
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.	5EQB_A_1YNA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	6 / 12	GLY A 300 PHE A 29 GLY A 242 GLY A 244 LEU A 275 HIS A 330	None None EDO A 404 ( 4.5A) None None ZN A 400 (-3.2A)	1.38A	5eqbA-2ashA: undetectable	5eqbA-2ashA: 21.17
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.	5HRQ_E_IPHE101_0 (INSULIN A-CHAIN INSULIN B-CHAIN)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 7	ILE A 86 HIS A 20 LEU A 19 HIS A 77	None	1.00A	5hrqE-2ashA: undetectable 5hrqF-2ashA: undetectable 5hrqJ-2ashA: undetectable	5hrqE-2ashA: 6.32 5hrqF-2ashA: 6.86 5hrqJ-2ashA: 6.86
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.	5JGL_B_SAMB301_0 (UBIE/COQ5 FAMILY METHYLTRANSFERASE, PUTATIVE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	THR A 161 ALA A 208 GLY A 181 LEU A 252 GLY A 210	None None None None EDO A 404 (-3.4A)	1.07A	5jglB-2ashA: undetectable	5jglB-2ashA: 23.56
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.	5N0O_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.10A	5n0oA-2ashA: undetectable	5n0oA-2ashA: 21.95
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.	5N0O_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.11A	5n0oB-2ashA: undetectable	5n0oB-2ashA: 21.95
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.	5N0R_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.06A	5n0rA-2ashA: undetectable	5n0rA-2ashA: 22.37
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.	5N0S_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.05A	5n0sA-2ashA: undetectable	5n0sA-2ashA: 22.37
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.	5N0S_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.02A	5n0sB-2ashA: undetectable	5n0sB-2ashA: 22.37
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.	5N0T_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.03A	5n0tA-2ashA: undetectable	5n0tA-2ashA: 22.59
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.	5N0T_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.03A	5n0tB-2ashA: undetectable	5n0tB-2ashA: 22.59
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.	5N0W_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.06A	5n0wA-2ashA: undetectable	5n0wA-2ashA: 22.37
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.	5N0W_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.06A	5n0wB-2ashA: undetectable	5n0wB-2ashA: 22.37
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.	5N0X_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.09A	5n0xA-2ashA: undetectable	5n0xA-2ashA: 22.37
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.	5N0X_B_SAMB501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.09A	5n0xB-2ashA: undetectable	5n0xB-2ashA: 22.37
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.	5N4I_A_SAMA501_0 (PEPTIDE N-METHYLTRANSFERASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ILE A 182 HIS A 143 PHE A 93 VAL A 95 ALA A 208	None None EDO A 404 ( 4.6A) None None	1.08A	5n4iA-2ashA: undetectable	5n4iA-2ashA: 22.37
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.	5V3C_A_AMHA402_1 (QUEUINE TRNA-RIBOSYLTRANSFER ASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	6 / 9	ASP A 142 CYH A 144 GLN A 184 GLY A 210 GLY A 211 MET A 241	None EDO A 404 (-3.4A) EDO A 404 ( 4.0A) EDO A 404 (-3.4A) EDO A 404 (-3.0A) EDO A 404 (-4.4A)	0.64A	5v3cA-2ashA: 53.9	5v3cA-2ashA: 11.17
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.	5V3C_A_AMHA402_1 (QUEUINE TRNA-RIBOSYLTRANSFER ASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 9	ASP A 142 CYH A 144 GLN A 184 GLY A 211 MET A 241	None EDO A 404 (-3.4A) EDO A 404 ( 4.0A) EDO A 404 (-3.0A) EDO A 404 (-4.4A)	1.25A	5v3cA-2ashA: 53.9	5v3cA-2ashA: 11.17
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.	5WAU_J_CHDJ101_1 (CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 5	ARG A 255 MET A 224 THR A 221 LEU A 220	None	1.37A	5wauJ-2ashA: undetectable	5wauJ-2ashA: 9.35
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.	5X19_J_CHDJ101_0 (CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 5	ARG A 255 MET A 224 THR A 221 LEU A 220	None	1.19A	5x19J-2ashA: undetectable	5x19J-2ashA: 9.35
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.	5X1B_J_CHDJ101_0 (CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 5	ARG A 255 MET A 224 THR A 221 LEU A 220	None	1.17A	5x1bJ-2ashA: undetectable	5x1bJ-2ashA: 9.35
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.	6DJ1_B_AB1B201_0 (HIV-1 PROTEASE)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	5 / 12	ASP A 142 GLY A 92 GLY A 242 ILE A 214 ILE A 182	None None EDO A 404 ( 4.5A) EDO A 404 (-4.0A) None	0.81A	6dj1A-2ashA: undetectable	6dj1A-2ashA: 12.61
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.	6GIQ_T_PCFT101_0 (CYTOCHROME B-C1 COMPLEX SUBUNIT 1, MITOCHONDRIAL CYTOCHROME B-C1 COMPLEX SUBUNIT 9 CYTOCHROME B-C1 COMPLEX SUBUNIT RIESKE, MITOCHONDRIAL)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 8	ASP A 89 SER A 90 GLY A 186 VAL A 183	None	1.12A	6giqL-2ashA: undetectable 6giqP-2ashA: undetectable 6giqT-2ashA: undetectable	6giqL-2ashA: 22.20 6giqP-2ashA: 19.79 6giqT-2ashA: 12.94
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.	6NKN_J_CHDJ102_0 (CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2ash	QUEUINE TRNA-RIBOSYLTRANSFER ASE (Thermotoga maritima)	4 / 5	ARG A 255 MET A 224 THR A 221 LEU A 220	None	1.33A	6nknJ-2ashA: undetectable	6nknJ-2ashA: 9.35

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1A27_A_ESTA350_1","17-BETA-HYDROXYSTEROID-DEHYDROGENASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"SER A 262;GLY A 243;LEU A 248;MET A 339;VAL A 257","None","1.22A","1a27A-2ashA:2.1","1a27A-2ashA:22.25"],["1HXB_A_ROCA100_1","HIV-1 PROTEASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ASP A 142;GLY A  92;GLY A 242;ILE A 214;ILE A 182","None;None;EDO A 404 ( 4.5A);EDO A 404 (-4.0A);None","0.87A","1hxbA-2ashA:undetectable","1hxbA-2ashA:12.86"],["1LHU_A_ESTA301_1","SEX HORMONE-BINDING GLOBULIN","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"GLY A 181;MET A 259;LEU A  87;MET A 139;ILE A 182","None","0.90A","1lhuA-2ashA:undetectable","1lhuA-2ashA:20.27"],["1V8B_C_ADNC2502_2","ADENOSYLHOMOCYSTEINASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",3,"GLU A 226;THR A 225;LEU A 248","None","0.63A","1v8bC-2ashA:undetectable","1v8bC-2ashA:22.18"],["2QO4_A_CHDA130_0","LIVER-BASIC FATTY ACID BINDING PROTEIN","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A  53;VAL A 257;MET A 241;ASP A 261;MET A  17","None;None;EDO A 404 (-4.4A);None;None","1.40A","2qo4A-2ashA:undetectable","2qo4A-2ashA:16.71"],["3AG1_J_CHDJ60_0","CYTOCHROME C OXIDASE POLYPEPTIDE 7A1","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ARG A 255;MET A 224;THR A 221;LEU A 220","None","1.37A","3ag1J-2ashA:undetectable","3ag1J-2ashA:9.35"],["3B9L_A_AZZA1010_1","SERUM ALBUMIN","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"LEU A 212;ILE A 209;ARG A 255;GLY A 256","None","0.89A","3b9lA-2ashA:undetectable","3b9lA-2ashA:20.34"],["3MWS_B_017B201_1","HIV-1 PROTEASE;HIV-1 PROTEASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"GLY A  50;ALA A  49;ASP A  45;ILE A  53;ILE A 332","None","1.05A","3mwsA-2ashA:undetectable","3mwsA-2ashA:14.87"],["4ACB_B_DXCB1473_0","TRANSLATION ELONGATION FACTOR SELB","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 202;GLY A 203;PHE A 204;SER A 126","None","0.90A","4acbB-2ashA:2.5;4acbC-2ashA:2.3","4acbB-2ashA:22.04;4acbC-2ashA:22.04"],["4E1G_A_LNLA701_1","PROSTAGLANDIN G\/H SYNTHASE 2","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 209;PHE A 240;GLY A 243;SER A 213;GLY A 211","None;None;None;None;EDO A 404 (-3.0A)","0.97A","4e1gA-2ashA:0.1","4e1gA-2ashA:22.11"],["4E1G_B_LNLB701_1","PROSTAGLANDIN G\/H SYNTHASE 2","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 209;PHE A 240;GLY A 243;SER A 213;GLY A 211","None;None;None;None;EDO A 404 (-3.0A)","0.99A","4e1gB-2ashA:undetectable","4e1gB-2ashA:22.11"],["4MWR_A_ZMRA513_2","NEURAMINIDASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ASP A 105;ARG A 160;TRP A 164;ILE A 103","None","1.39A","4mwrA-2ashA:undetectable","4mwrA-2ashA:21.92"],["4MWX_A_ZMRA513_2","NEURAMINIDASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",3,"ARG A 160;TRP A 164;ILE A 103","None","0.97A","4mwxA-2ashA:undetectable","4mwxA-2ashA:21.92"],["4NJV_A_RITA500_1","PROTEASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"GLY A  50;ALA A  49;ASP A  45;ILE A  53;ILE A 332","None","1.01A","4njvA-2ashA:undetectable","4njvA-2ashA:14.83"],["4NJV_D_RITD500_2","PROTEASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"GLY A  50;ALA A  49;ASP A  45;ILE A  53;ILE A 332","None","1.01A","4njvD-2ashA:undetectable","4njvD-2ashA:14.83"],["4QOP_C_HQEC503_1","CATALASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 114;PHE A  59;LEU A  63;LEU A  98","None","0.79A","4qopC-2ashA:undetectable","4qopC-2ashA:21.26"],["4ZE1_A_X2NA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"GLY A 300;PHE A  29;GLY A 244;LEU A 275;HIS A 330","None;None;None;None; ZN A 400 (-3.2A)","1.33A","4ze1A-2ashA:undetectable","4ze1A-2ashA:21.11"],["5A06_A_SORA1342_0","ALDOSE-ALDOSE OXIDOREDUCTASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 214;LEU A 212;GLY A 210;GLY A 211","EDO A 404 (-4.0A);None;EDO A 404 (-3.4A);EDO A 404 (-3.0A)","0.84A","5a06A-2ashA:undetectable","5a06A-2ashA:22.25"],["5A06_B_SORB1342_0","ALDOSE-ALDOSE OXIDOREDUCTASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 214;LEU A 212;GLY A 210;GLY A 211","EDO A 404 (-4.0A);None;EDO A 404 (-3.4A);EDO A 404 (-3.0A)","0.82A","5a06B-2ashA:undetectable","5a06B-2ashA:22.25"],["5A06_C_SORC1342_0","ALDOSE-ALDOSE OXIDOREDUCTASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 214;LEU A 212;GLY A 210;GLY A 211","EDO A 404 (-4.0A);None;EDO A 404 (-3.4A);EDO A 404 (-3.0A)","0.83A","5a06C-2ashA:2.4","5a06C-2ashA:22.25"],["5A06_E_SORE1341_0","ALDOSE-ALDOSE OXIDOREDUCTASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 214;LEU A 212;GLY A 210;GLY A 211","EDO A 404 (-4.0A);None;EDO A 404 (-3.4A);EDO A 404 (-3.0A)","0.84A","5a06E-2ashA:undetectable","5a06E-2ashA:22.25"],["5A06_F_SORF1341_0","ALDOSE-ALDOSE OXIDOREDUCTASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A 214;LEU A 212;GLY A 210;GLY A 211","EDO A 404 (-4.0A);None;EDO A 404 (-3.4A);EDO A 404 (-3.0A)","0.85A","5a06F-2ashA:2.2","5a06F-2ashA:22.25"],["5BMV_C_VLBC507_2","TUBULIN ALPHA-1B CHAIN","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"VAL A 342;ILE A 346;VAL A 253;ILE A 249","None","0.78A","5bmvC-2ashA:undetectable","5bmvC-2ashA:21.73"],["5EQB_A_1YNA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",6,"GLY A 300;PHE A  29;GLY A 242;GLY A 244;LEU A 275;HIS A 330","None;None;EDO A 404 ( 4.5A);None;None; ZN A 400 (-3.2A)","1.38A","5eqbA-2ashA:undetectable","5eqbA-2ashA:21.17"],["5HRQ_E_IPHE101_0","INSULIN A-CHAIN;INSULIN B-CHAIN","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ILE A  86;HIS A  20;LEU A  19;HIS A  77","None","1.00A","5hrqE-2ashA:undetectable;5hrqF-2ashA:undetectable;5hrqJ-2ashA:undetectable","5hrqE-2ashA:6.32;5hrqF-2ashA:6.86;5hrqJ-2ashA:6.86"],["5JGL_B_SAMB301_0","UBIE\/COQ5 FAMILY METHYLTRANSFERASE, PUTATIVE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"THR A 161;ALA A 208;GLY A 181;LEU A 252;GLY A 210","None;None;None;None;EDO A 404 (-3.4A)","1.07A","5jglB-2ashA:undetectable","5jglB-2ashA:23.56"],["5N0O_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.10A","5n0oA-2ashA:undetectable","5n0oA-2ashA:21.95"],["5N0O_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.11A","5n0oB-2ashA:undetectable","5n0oB-2ashA:21.95"],["5N0R_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.06A","5n0rA-2ashA:undetectable","5n0rA-2ashA:22.37"],["5N0S_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.05A","5n0sA-2ashA:undetectable","5n0sA-2ashA:22.37"],["5N0S_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.02A","5n0sB-2ashA:undetectable","5n0sB-2ashA:22.37"],["5N0T_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.03A","5n0tA-2ashA:undetectable","5n0tA-2ashA:22.59"],["5N0T_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.03A","5n0tB-2ashA:undetectable","5n0tB-2ashA:22.59"],["5N0W_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.06A","5n0wA-2ashA:undetectable","5n0wA-2ashA:22.37"],["5N0W_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.06A","5n0wB-2ashA:undetectable","5n0wB-2ashA:22.37"],["5N0X_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.09A","5n0xA-2ashA:undetectable","5n0xA-2ashA:22.37"],["5N0X_B_SAMB501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.09A","5n0xB-2ashA:undetectable","5n0xB-2ashA:22.37"],["5N4I_A_SAMA501_0","PEPTIDE N-METHYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ILE A 182;HIS A 143;PHE A  93;VAL A  95;ALA A 208","None;None;EDO A 404 ( 4.6A);None;None","1.08A","5n4iA-2ashA:undetectable","5n4iA-2ashA:22.37"],["5V3C_A_AMHA402_1","QUEUINE TRNA-RIBOSYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",6,"ASP A 142;CYH A 144;GLN A 184;GLY A 210;GLY A 211;MET A 241","None;EDO A 404 (-3.4A);EDO A 404 ( 4.0A);EDO A 404 (-3.4A);EDO A 404 (-3.0A);EDO A 404 (-4.4A)","0.64A","5v3cA-2ashA:53.9","5v3cA-2ashA:11.17"],["5V3C_A_AMHA402_1","QUEUINE TRNA-RIBOSYLTRANSFERASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ASP A 142;CYH A 144;GLN A 184;GLY A 211;MET A 241","None;EDO A 404 (-3.4A);EDO A 404 ( 4.0A);EDO A 404 (-3.0A);EDO A 404 (-4.4A)","1.25A","5v3cA-2ashA:53.9","5v3cA-2ashA:11.17"],["5WAU_J_CHDJ101_1","CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ARG A 255;MET A 224;THR A 221;LEU A 220","None","1.37A","5wauJ-2ashA:undetectable","5wauJ-2ashA:9.35"],["5X19_J_CHDJ101_0","CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ARG A 255;MET A 224;THR A 221;LEU A 220","None","1.19A","5x19J-2ashA:undetectable","5x19J-2ashA:9.35"],["5X1B_J_CHDJ101_0","CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ARG A 255;MET A 224;THR A 221;LEU A 220","None","1.17A","5x1bJ-2ashA:undetectable","5x1bJ-2ashA:9.35"],["6DJ1_B_AB1B201_0","HIV-1 PROTEASE","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",5,"ASP A 142;GLY A  92;GLY A 242;ILE A 214;ILE A 182","None;None;EDO A 404 ( 4.5A);EDO A 404 (-4.0A);None","0.81A","6dj1A-2ashA:undetectable","6dj1A-2ashA:12.61"],["6GIQ_T_PCFT101_0","CYTOCHROME B-C1 COMPLEX SUBUNIT 1, MITOCHONDRIAL;CYTOCHROME B-C1 COMPLEX SUBUNIT 9;CYTOCHROME B-C1 COMPLEX SUBUNIT RIESKE, MITOCHONDRIAL","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ASP A  89;SER A  90;GLY A 186;VAL A 183","None","1.12A","6giqL-2ashA:undetectable;6giqP-2ashA:undetectable;6giqT-2ashA:undetectable","6giqL-2ashA:22.20;6giqP-2ashA:19.79;6giqT-2ashA:12.94"],["6NKN_J_CHDJ102_0","CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2ash","QUEUINE TRNA-RIBOSYLTRANSFERASE","Thermotoga maritima",4,"ARG A 255;MET A 224;THR A 221;LEU A 220","None","1.33A","6nknJ-2ashA:undetectable","6nknJ-2ashA:9.35"]]