SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3gvc'

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.	1KVL_A_CLSA371_1 (BETA-LACTAMASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 10	GLY A 270 LEU A 203 GLN A 266 THR A 272 GLY A 271	None	1.50A	1kvlA-3gvcA: undetectable	1kvlA-3gvcA: 21.69
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.	1QAO_A_SAMA245_0 (ERMC' METHYLTRANSFERASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 12	GLY A 36 GLY A 38 ILE A 61 ASP A 62 ASP A 83 ILE A 133	None	0.88A	1qaoA-3gvcA: 5.3	1qaoA-3gvcA: 20.00
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.	1UAY_A_ADNA1001_1 (TYPE II 3-HYDROXYACYL-COA DEHYDROGENASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 11	GLY A 36 ASP A 60 ASP A 83 VAL A 84 ALA A 111 VAL A 113	None	0.48A	1uayA-3gvcA: 31.5	1uayA-3gvcA: 28.97
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.	1UAY_B_ADNB1002_1 (TYPE II 3-HYDROXYACYL-COA DEHYDROGENASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 10	GLY A 36 ASP A 60 ASP A 83 VAL A 84 ALA A 111 VAL A 113	None	0.48A	1uayB-3gvcA: 31.5	1uayB-3gvcA: 28.97
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.	1UTD_L_TRPL81_0 (TRANSCRIPTION ATTENUATION PROTEIN MTRB)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 155 ALA A 146 ILE A 198 GLY A 103 ALA A 145	None	1.01A	1utdL-3gvcA: undetectable 1utdM-3gvcA: undetectable	1utdL-3gvcA: 13.97 1utdM-3gvcA: 13.97
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.	1UTD_O_TRPO81_0 (TRANSCRIPTION ATTENUATION PROTEIN MTRB)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 155 ALA A 146 ILE A 198 GLY A 103 ALA A 145	None	1.01A	1utdO-3gvcA: undetectable 1utdP-3gvcA: undetectable	1utdO-3gvcA: 13.97 1utdP-3gvcA: 13.97
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.	1UTD_P_TRPP81_0 (TRANSCRIPTION ATTENUATION PROTEIN MTRB)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 11	GLY A 155 ALA A 146 ILE A 198 GLY A 103 ALA A 145	None	1.01A	1utdP-3gvcA: undetectable 1utdQ-3gvcA: undetectable	1utdP-3gvcA: 13.97 1utdQ-3gvcA: 13.97
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.	2ADM_A_SAMA500_0 (ADENINE-N6-DNA-METHY LTRANSFERASE TAQI)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 11	ALA A 59 ILE A 61 ASP A 62 ALA A 65 ASP A 83	None	1.33A	2admA-3gvcA: 5.9	2admA-3gvcA: 19.68
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.	2AVS_B_MK1B902_3 (POL POLYPROTEIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.74A	2avsB-3gvcA: undetectable	2avsB-3gvcA: 16.67
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.	2BM9_E_SAME301_0 (CEPHALOSPORIN HYDROXYLASE CMCI)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 36 ASP A 60 ASP A 83 ASN A 110 ALA A 111	None	0.99A	2bm9E-3gvcA: 5.5	2bm9E-3gvcA: 21.58
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.	2F7F_A_NIOA601_1 (NICOTINATE PHOSPHORIBOSYLTRANSF ERASE, PUTATIVE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	4 / 6	SER A 186 GLY A 263 THR A 262 ARG A 199	None	1.18A	2f7fA-3gvcA: undetectable	2f7fA-3gvcA: 20.12
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.	2F8G_B_017B401_2 (POL POLYPROTEIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.91A	2f8gB-3gvcA: undetectable	2f8gB-3gvcA: 16.67
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.	2IGT_A_SAMA1001_1 (SAM DEPENDENT METHYLTRANSFERASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	3 / 3	ASP A 60 ASP A 64 ASP A 83	None	0.64A	2igtA-3gvcA: 6.7	2igtA-3gvcA: 25.74
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.	2IGT_B_SAMB1002_1 (SAM DEPENDENT METHYLTRANSFERASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	3 / 3	ASP A 60 ASP A 64 ASP A 83	None	0.65A	2igtB-3gvcA: 7.4	2igtB-3gvcA: 25.74
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.	2O4L_A_TPVA403_2 (PROTEASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.86A	2o4lB-3gvcA: undetectable	2o4lB-3gvcA: 16.73
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.	2XKW_B_P1BB1475_1 (PEROXISOME PROLIFERATOR-ACTIVAT ED RECEPTOR GAMMA)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLU A 192 ARG A 199 ALA A 258 LEU A 254 ILE A 198	None	1.32A	2xkwB-3gvcA: undetectable	2xkwB-3gvcA: 17.99
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.	3AY0_A_ADNA401_1 (UNCHARACTERIZED PROTEIN MJ0883)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 10	ASP A 60 ILE A 61 ALA A 65 ASP A 83 VAL A 82	None	1.12A	3ay0A-3gvcA: 6.3	3ay0A-3gvcA: 23.03
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.	3AY0_B_ADNB402_1 (UNCHARACTERIZED PROTEIN MJ0883)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 10	GLY A 38 ASP A 60 ILE A 61 ASP A 83 VAL A 82	None	0.99A	3ay0B-3gvcA: 6.5	3ay0B-3gvcA: 23.03
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.	3GRV_A_ADNA300_1 (DIMETHYLADENOSINE TRANSFERASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 11	GLY A 36 GLY A 38 ILE A 61 ASP A 62 ASP A 83 ILE A 133	None	1.05A	3grvA-3gvcA: 6.2	3grvA-3gvcA: 25.08
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.	3GRV_A_ADNA300_1 (DIMETHYLADENOSINE TRANSFERASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 11	GLY A 38 ILE A 61 ASP A 62 ASP A 83 ASN A 110 ILE A 133	None	1.31A	3grvA-3gvcA: 6.2	3grvA-3gvcA: 25.08
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.	3NS1_L_PM6L1_1 (XANTHINE DEHYDROGENASE/OXIDAS E)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	4 / 8	SER A 200 THR A 189 ALA A 145 ALA A 146	None	0.96A	3ns1L-3gvcA: undetectable	3ns1L-3gvcA: 18.18
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.	3NU5_B_478B401_1 (PROTEASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.87A	3nu5A-3gvcA: undetectable	3nu5A-3gvcA: 16.67
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.	3NU5_B_478B401_2 (PROTEASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.83A	3nu5B-3gvcA: undetectable	3nu5B-3gvcA: 16.67
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_B_478B200_1 (HIV-1 PROTEASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 9	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.89A	3oxvA-3gvcA: undetectable	3oxvA-3gvcA: 17.09
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.	3OXV_C_478C200_1 (HIV-1 PROTEASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 9	GLY A 137 ALA A 138 GLY A 112 VAL A 113 ILE A 182	None	0.87A	3oxvC-3gvcA: undetectable	3oxvC-3gvcA: 17.09
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.	3SUF_D_SUED1201_1 (NS3 PROTEASE, NS4A PROTEIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	VAL A 98 GLY A 102 ILE A 198 ALA A 145 ALA A 146	None	1.01A	3sufD-3gvcA: undetectable	3sufD-3gvcA: 21.90
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.	3V8V_B_SAMB801_0 (RIBOSOMAL RNA LARGE SUBUNIT METHYLTRANSFERASE L)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 11	GLY A 38 ASP A 60 ASP A 62 ASP A 83 VAL A 84	None	0.85A	3v8vB-3gvcA: 6.8	3v8vB-3gvcA: 18.09
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.	4FU9_A_ACTA311_0 (UROKINASE-TYPE PLASMINOGEN ACTIVATOR)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	3 / 3	GLN A 266 THR A 265 THR A 264	None	0.81A	4fu9A-3gvcA: undetectable	4fu9A-3gvcA: 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.	4FUF_A_ACTA310_0 (UROKINASE-TYPE PLASMINOGEN ACTIVATOR)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	3 / 3	GLN A 266 THR A 265 THR A 264	None	0.79A	4fufA-3gvcA: undetectable	4fufA-3gvcA: 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.	4HWK_A_SFYA807_0 (SEPIAPTERIN REDUCTASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 11	SER A 162 LEU A 163 TYR A 175 MET A 212 ALA A 216	None	0.87A	4hwkA-3gvcA: 25.9	4hwkA-3gvcA: 25.68
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.	4HWK_B_SFYB806_0 (SEPIAPTERIN REDUCTASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 11	SER A 162 LEU A 163 TYR A 175 MET A 212 ALA A 216	None	0.86A	4hwkB-3gvcA: 25.8	4hwkB-3gvcA: 25.68
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.	4HWK_C_SFYC804_0 (SEPIAPTERIN REDUCTASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	SER A 162 LEU A 163 TYR A 175 MET A 212 ALA A 216	None	0.86A	4hwkC-3gvcA: 25.8	4hwkC-3gvcA: 25.68
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.	4HWK_D_SFYD803_0 (SEPIAPTERIN REDUCTASE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 11	SER A 162 LEU A 163 TYR A 175 MET A 212 ALA A 216	None	0.85A	4hwkD-3gvcA: 25.8	4hwkD-3gvcA: 25.68
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.	4HXY_B_ACAB502_1 (PLM1)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	4 / 7	VAL A 114 SER A 162 TYR A 175 MET A 212	None	0.70A	4hxyB-3gvcA: 19.9	4hxyB-3gvcA: 23.76
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.	4IV8_A_SAMA301_0 (PHOSPHOETHANOLAMINE N-METHYLTRANSFERASE, PUTATIVE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 12	GLY A 36 GLY A 38 ASP A 60 ILE A 61 ASP A 83 ALA A 111	None	1.08A	4iv8A-3gvcA: 6.6	4iv8A-3gvcA: 23.40
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.	4IV8_B_SAMB301_0 (PHOSPHOETHANOLAMINE N-METHYLTRANSFERASE, PUTATIVE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	6 / 12	GLY A 36 GLY A 38 ASP A 60 ILE A 61 ASP A 83 ALA A 111	None	1.04A	4iv8B-3gvcA: 6.6	4iv8B-3gvcA: 23.40
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.	5NFP_A_8W5A804_2 (GLUCOCORTICOID RECEPTOR)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	4 / 4	LEU A 253 MET A 246 ILE A 157 LEU A 160	None	1.36A	5nfpA-3gvcA: undetectable	5nfpA-3gvcA: 21.00
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.	5SYE_B_TA1B502_1 (TUBULIN BETA CHAIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	VAL A 104 ASP A 105 LEU A 185 ALA A 145 GLY A 197	None	1.31A	5syeB-3gvcA: 7.4	5syeB-3gvcA: 20.55
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.	5TE8_C_08JC602_1 (CYTOCHROME P450 3A4)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	4 / 7	ALA A 138 THR A 142 ILE A 157 LEU A 107	None	0.96A	5te8C-3gvcA: undetectable	5te8C-3gvcA: 19.88
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.	5WY0_A_SAMA800_0 (SMALL RNA 2'-O-METHYLTRANSFERA SE)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 36 GLY A 38 ASP A 60 ILE A 61 ILE A 41	None	0.62A	5wy0A-3gvcA: 5.7	5wy0A-3gvcA: 22.10
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.	6AJI_A_AY6A1001_0 (DRUG EXPORTERS OF THE RND SUPERFAMILY-LIKE PROTEIN,ENDOLYSIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	LEU A 185 ILE A 183 TYR A 175 ALA A 138 LEU A 135	None	1.21A	6ajiA-3gvcA: undetectable	6ajiA-3gvcA: 15.63
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.	6BQ4_A_ADNA401_1 (THERMOSPERMINE SYNTHASE ACAULIS PROTEIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 36 ASP A 60 ILE A 61 ASP A 62 ASP A 83	None	0.94A	6bq4A-3gvcA: 6.9	6bq4A-3gvcA: 12.69
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.	6BQ4_B_ADNB401_1 (THERMOSPERMINE SYNTHASE ACAULIS PROTEIN)	3gvc	PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCT ASE (Mycobacterium tuberculosis)	5 / 12	GLY A 36 ASP A 60 ILE A 61 ASP A 62 ASP A 83	None	0.88A	6bq4B-3gvcA: 6.7	6bq4B-3gvcA: 12.69

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1KVL_A_CLSA371_1","BETA-LACTAMASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 270;LEU A 203;GLN A 266;THR A 272;GLY A 271","None","1.50A","1kvlA-3gvcA:undetectable","1kvlA-3gvcA:21.69"],["1QAO_A_SAMA245_0","ERMC' METHYLTRANSFERASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  36;GLY A  38;ILE A  61;ASP A  62;ASP A  83;ILE A 133","None","0.88A","1qaoA-3gvcA:5.3","1qaoA-3gvcA:20.00"],["1UAY_A_ADNA1001_1","TYPE II 3-HYDROXYACYL-COA DEHYDROGENASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  36;ASP A  60;ASP A  83;VAL A  84;ALA A 111;VAL A 113","None","0.48A","1uayA-3gvcA:31.5","1uayA-3gvcA:28.97"],["1UAY_B_ADNB1002_1","TYPE II 3-HYDROXYACYL-COA DEHYDROGENASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  36;ASP A  60;ASP A  83;VAL A  84;ALA A 111;VAL A 113","None","0.48A","1uayB-3gvcA:31.5","1uayB-3gvcA:28.97"],["1UTD_L_TRPL81_0","TRANSCRIPTION ATTENUATION PROTEIN MTRB","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 155;ALA A 146;ILE A 198;GLY A 103;ALA A 145","None","1.01A","1utdL-3gvcA:undetectable;1utdM-3gvcA:undetectable","1utdL-3gvcA:13.97;1utdM-3gvcA:13.97"],["1UTD_O_TRPO81_0","TRANSCRIPTION ATTENUATION PROTEIN MTRB","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 155;ALA A 146;ILE A 198;GLY A 103;ALA A 145","None","1.01A","1utdO-3gvcA:undetectable;1utdP-3gvcA:undetectable","1utdO-3gvcA:13.97;1utdP-3gvcA:13.97"],["1UTD_P_TRPP81_0","TRANSCRIPTION ATTENUATION PROTEIN MTRB","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 155;ALA A 146;ILE A 198;GLY A 103;ALA A 145","None","1.01A","1utdP-3gvcA:undetectable;1utdQ-3gvcA:undetectable","1utdP-3gvcA:13.97;1utdQ-3gvcA:13.97"],["2ADM_A_SAMA500_0","ADENINE-N6-DNA-METHYLTRANSFERASE TAQI","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"ALA A  59;ILE A  61;ASP A  62;ALA A  65;ASP A  83","None","1.33A","2admA-3gvcA:5.9","2admA-3gvcA:19.68"],["2AVS_B_MK1B902_3","POL POLYPROTEIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.74A","2avsB-3gvcA:undetectable","2avsB-3gvcA:16.67"],["2BM9_E_SAME301_0","CEPHALOSPORIN HYDROXYLASE CMCI","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A  36;ASP A  60;ASP A  83;ASN A 110;ALA A 111","None","0.99A","2bm9E-3gvcA:5.5","2bm9E-3gvcA:21.58"],["2F7F_A_NIOA601_1","NICOTINATE PHOSPHORIBOSYLTRANSFERASE, PUTATIVE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",4,"SER A 186;GLY A 263;THR A 262;ARG A 199","None","1.18A","2f7fA-3gvcA:undetectable","2f7fA-3gvcA:20.12"],["2F8G_B_017B401_2","POL POLYPROTEIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.91A","2f8gB-3gvcA:undetectable","2f8gB-3gvcA:16.67"],["2IGT_A_SAMA1001_1","SAM DEPENDENT METHYLTRANSFERASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",3,"ASP A  60;ASP A  64;ASP A  83","None","0.64A","2igtA-3gvcA:6.7","2igtA-3gvcA:25.74"],["2IGT_B_SAMB1002_1","SAM DEPENDENT METHYLTRANSFERASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",3,"ASP A  60;ASP A  64;ASP A  83","None","0.65A","2igtB-3gvcA:7.4","2igtB-3gvcA:25.74"],["2O4L_A_TPVA403_2","PROTEASE;PROTEASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.86A","2o4lB-3gvcA:undetectable","2o4lB-3gvcA:16.73"],["2XKW_B_P1BB1475_1","PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLU A 192;ARG A 199;ALA A 258;LEU A 254;ILE A 198","None","1.32A","2xkwB-3gvcA:undetectable","2xkwB-3gvcA:17.99"],["3AY0_A_ADNA401_1","UNCHARACTERIZED PROTEIN MJ0883","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"ASP A  60;ILE A  61;ALA A  65;ASP A  83;VAL A  82","None","1.12A","3ay0A-3gvcA:6.3","3ay0A-3gvcA:23.03"],["3AY0_B_ADNB402_1","UNCHARACTERIZED PROTEIN MJ0883","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A  38;ASP A  60;ILE A  61;ASP A  83;VAL A  82","None","0.99A","3ay0B-3gvcA:6.5","3ay0B-3gvcA:23.03"],["3GRV_A_ADNA300_1","DIMETHYLADENOSINE TRANSFERASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  36;GLY A  38;ILE A  61;ASP A  62;ASP A  83;ILE A 133","None","1.05A","3grvA-3gvcA:6.2","3grvA-3gvcA:25.08"],["3GRV_A_ADNA300_1","DIMETHYLADENOSINE TRANSFERASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  38;ILE A  61;ASP A  62;ASP A  83;ASN A 110;ILE A 133","None","1.31A","3grvA-3gvcA:6.2","3grvA-3gvcA:25.08"],["3NS1_L_PM6L1_1","XANTHINE DEHYDROGENASE\/OXIDASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",4,"SER A 200;THR A 189;ALA A 145;ALA A 146","None","0.96A","3ns1L-3gvcA:undetectable","3ns1L-3gvcA:18.18"],["3NU5_B_478B401_1","PROTEASE;PROTEASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.87A","3nu5A-3gvcA:undetectable","3nu5A-3gvcA:16.67"],["3NU5_B_478B401_2","PROTEASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.83A","3nu5B-3gvcA:undetectable","3nu5B-3gvcA:16.67"],["3OXV_B_478B200_1","HIV-1 PROTEASE;HIV-1 PROTEASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.89A","3oxvA-3gvcA:undetectable","3oxvA-3gvcA:17.09"],["3OXV_C_478C200_1","HIV-1 PROTEASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A 137;ALA A 138;GLY A 112;VAL A 113;ILE A 182","None","0.87A","3oxvC-3gvcA:undetectable","3oxvC-3gvcA:17.09"],["3SUF_D_SUED1201_1","NS3 PROTEASE, NS4A PROTEIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"VAL A  98;GLY A 102;ILE A 198;ALA A 145;ALA A 146","None","1.01A","3sufD-3gvcA:undetectable","3sufD-3gvcA:21.90"],["3V8V_B_SAMB801_0","RIBOSOMAL RNA LARGE SUBUNIT METHYLTRANSFERASE L","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A  38;ASP A  60;ASP A  62;ASP A  83;VAL A  84","None","0.85A","3v8vB-3gvcA:6.8","3v8vB-3gvcA:18.09"],["4FU9_A_ACTA311_0","UROKINASE-TYPE PLASMINOGEN ACTIVATOR","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",3,"GLN A 266;THR A 265;THR A 264","None","0.81A","4fu9A-3gvcA:undetectable","4fu9A-3gvcA:20.27"],["4FUF_A_ACTA310_0","UROKINASE-TYPE PLASMINOGEN ACTIVATOR","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",3,"GLN A 266;THR A 265;THR A 264","None","0.79A","4fufA-3gvcA:undetectable","4fufA-3gvcA:20.27"],["4HWK_A_SFYA807_0","SEPIAPTERIN REDUCTASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"SER A 162;LEU A 163;TYR A 175;MET A 212;ALA A 216","None","0.87A","4hwkA-3gvcA:25.9","4hwkA-3gvcA:25.68"],["4HWK_B_SFYB806_0","SEPIAPTERIN REDUCTASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"SER A 162;LEU A 163;TYR A 175;MET A 212;ALA A 216","None","0.86A","4hwkB-3gvcA:25.8","4hwkB-3gvcA:25.68"],["4HWK_C_SFYC804_0","SEPIAPTERIN REDUCTASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"SER A 162;LEU A 163;TYR A 175;MET A 212;ALA A 216","None","0.86A","4hwkC-3gvcA:25.8","4hwkC-3gvcA:25.68"],["4HWK_D_SFYD803_0","SEPIAPTERIN REDUCTASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"SER A 162;LEU A 163;TYR A 175;MET A 212;ALA A 216","None","0.85A","4hwkD-3gvcA:25.8","4hwkD-3gvcA:25.68"],["4HXY_B_ACAB502_1","PLM1","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",4,"VAL A 114;SER A 162;TYR A 175;MET A 212","None","0.70A","4hxyB-3gvcA:19.9","4hxyB-3gvcA:23.76"],["4IV8_A_SAMA301_0","PHOSPHOETHANOLAMINE N-METHYLTRANSFERASE,PUTATIVE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  36;GLY A  38;ASP A  60;ILE A  61;ASP A  83;ALA A 111","None","1.08A","4iv8A-3gvcA:6.6","4iv8A-3gvcA:23.40"],["4IV8_B_SAMB301_0","PHOSPHOETHANOLAMINE N-METHYLTRANSFERASE,PUTATIVE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",6,"GLY A  36;GLY A  38;ASP A  60;ILE A  61;ASP A  83;ALA A 111","None","1.04A","4iv8B-3gvcA:6.6","4iv8B-3gvcA:23.40"],["5NFP_A_8W5A804_2","GLUCOCORTICOID RECEPTOR","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",4,"LEU A 253;MET A 246;ILE A 157;LEU A 160","None","1.36A","5nfpA-3gvcA:undetectable","5nfpA-3gvcA:21.00"],["5SYE_B_TA1B502_1","TUBULIN BETA CHAIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"VAL A 104;ASP A 105;LEU A 185;ALA A 145;GLY A 197","None","1.31A","5syeB-3gvcA:7.4","5syeB-3gvcA:20.55"],["5TE8_C_08JC602_1","CYTOCHROME P450 3A4","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",4,"ALA A 138;THR A 142;ILE A 157;LEU A 107","None","0.96A","5te8C-3gvcA:undetectable","5te8C-3gvcA:19.88"],["5WY0_A_SAMA800_0","SMALL RNA 2'-O-METHYLTRANSFERASE","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A  36;GLY A  38;ASP A  60;ILE A  61;ILE A  41","None","0.62A","5wy0A-3gvcA:5.7","5wy0A-3gvcA:22.10"],["6AJI_A_AY6A1001_0","DRUG EXPORTERS OF THE RND SUPERFAMILY-LIKE PROTEIN,ENDOLYSIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"LEU A 185;ILE A 183;TYR A 175;ALA A 138;LEU A 135","None","1.21A","6ajiA-3gvcA:undetectable","6ajiA-3gvcA:15.63"],["6BQ4_A_ADNA401_1","THERMOSPERMINE SYNTHASE ACAULIS PROTEIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A  36;ASP A  60;ILE A  61;ASP A  62;ASP A  83","None","0.94A","6bq4A-3gvcA:6.9","6bq4A-3gvcA:12.69"],["6BQ4_B_ADNB401_1","THERMOSPERMINE SYNTHASE ACAULIS PROTEIN","3gvc","PROBABLE SHORT-CHAIN TYPE DEHYDROGENASE\/REDUCTASE","Mycobacterium tuberculosis",5,"GLY A  36;ASP A  60;ILE A  61;ASP A  62;ASP A  83","None","0.88A","6bq4B-3gvcA:6.7","6bq4B-3gvcA:12.69"]]