SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3tox'

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 (%)		 View Dock
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.
1C9S_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.98A 1c9sN-3toxA:
undetectable
1c9sO-3toxA:
undetectable		 1c9sN-3toxA:
15.71
1c9sO-3toxA:
15.71
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.
1C9S_P_TRPP81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.98A 1c9sP-3toxA:
undetectable
1c9sQ-3toxA:
undetectable		 1c9sP-3toxA:
15.71
1c9sQ-3toxA:
15.71
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.
1C9S_Q_TRPQ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.99A 1c9sQ-3toxA:
undetectable
1c9sR-3toxA:
undetectable		 1c9sQ-3toxA:
15.71
1c9sR-3toxA:
15.71
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.
1C9S_V_TRPV81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.95A 1c9sL-3toxA:
undetectable
1c9sV-3toxA:
undetectable		 1c9sL-3toxA:
15.71
1c9sV-3toxA:
15.71
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.
1CMA_B_SAMB105_0
(PROTEIN (MET
REPRESSOR))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ARG A  22
LEU A  48
GLU A  51
ALA A  29
GLY A  32
 None
 1.30A 1cmaA-3toxA:
undetectable
1cmaB-3toxA:
undetectable		 1cmaA-3toxA:
15.36
1cmaB-3toxA:
15.36
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.
1CMC_A_SAMA105_0
(MET REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ALA A  29
GLY A  32
ARG A  22
LEU A  48
GLU A  51
 None
 1.23A 1cmcA-3toxA:
undetectable
1cmcB-3toxA:
undetectable		 1cmcA-3toxA:
15.36
1cmcB-3toxA:
15.36
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.
1CMC_B_SAMB105_0
(MET REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ARG A  22
LEU A  48
GLU A  51
ALA A  29
GLY A  32
 None
 1.19A 1cmcA-3toxA:
undetectable
1cmcB-3toxA:
undetectable		 1cmcA-3toxA:
15.36
1cmcB-3toxA:
15.36
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.
1GTF_E_TRPE81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.96A 1gtfD-3toxA:
undetectable
1gtfE-3toxA:
undetectable		 1gtfD-3toxA:
15.71
1gtfE-3toxA:
15.71
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.
1GTF_K_TRPK81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.97A 1gtfJ-3toxA:
undetectable
1gtfK-3toxA:
undetectable		 1gtfJ-3toxA:
15.71
1gtfK-3toxA:
15.71
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.
1GTF_Q_TRPQ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.97A 1gtfQ-3toxA:
undetectable
1gtfR-3toxA:
undetectable		 1gtfQ-3toxA:
15.71
1gtfR-3toxA:
15.71
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.
1GTF_R_TRPR81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.97A 1gtfR-3toxA:
undetectable
1gtfS-3toxA:
undetectable		 1gtfR-3toxA:
15.71
1gtfS-3toxA:
15.71
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.
1GTF_S_TRPS81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.97A 1gtfS-3toxA:
undetectable
1gtfT-3toxA:
undetectable		 1gtfS-3toxA:
15.71
1gtfT-3toxA:
15.71
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.
1GTN_T_TRPT81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.99A 1gtnT-3toxA:
undetectable
1gtnU-3toxA:
undetectable		 1gtnT-3toxA:
15.71
1gtnU-3toxA:
15.71
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.
1GTN_V_TRPV81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A  94
SER A 120
ALA A 121
ALA A 124
THR A  14
 NAP  A 601 (-3.2A)
None
None
None
None
 1.00A 1gtnL-3toxA:
undetectable
1gtnV-3toxA:
undetectable		 1gtnL-3toxA:
15.71
1gtnV-3toxA:
15.71
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.
1GTN_V_TRPV81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.96A 1gtnL-3toxA:
undetectable
1gtnV-3toxA:
undetectable		 1gtnL-3toxA:
15.71
1gtnV-3toxA:
15.71
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.
1HK2_A_T44A3002_1
(SERUM ALBUMIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 8 ASN A 197
LEU A  96
TYR A 159
SER A 145
 NAP  A 601 (-4.3A)
None
NAP  A 601 (-4.7A)
NAP  A 601 (-3.3A)
 1.11A 1hk2A-3toxA:
undetectable		 1hk2A-3toxA:
18.60
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.
1MJ2_A_SAMA2200_0
(PROTEIN (METHIONINE
REPRESSOR))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A  29
GLY A  32
ARG A  22
LEU A  48
GLU A  51
 None
 1.23A 1mj2A-3toxA:
undetectable
1mj2B-3toxA:
undetectable		 1mj2A-3toxA:
15.36
1mj2B-3toxA:
15.36
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.
1MJ2_C_SAMC2199_0
(PROTEIN (METHIONINE
REPRESSOR))		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A  29
GLY A  32
ARG A  22
LEU A  48
GLU A  51
 None
 1.28A 1mj2C-3toxA:
undetectable
1mj2D-3toxA:
undetectable		 1mj2C-3toxA:
15.36
1mj2D-3toxA:
15.36
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.
1MJL_A_SAMA200_0
(METHIONINE REPRESSOR
PROTEIN METJ)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 GLU A  31
ARG A   5
LEU A 232
GLU A 229
ALA A 228
 None
 0.98A 1mjlA-3toxA:
undetectable
1mjlB-3toxA:
undetectable		 1mjlA-3toxA:
15.36
1mjlB-3toxA:
15.36
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.
1MJO_C_SAMC200_0
(METHIONINE REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A  29
GLY A  32
ARG A  22
LEU A  48
GLU A  51
 None
 1.25A 1mjoC-3toxA:
undetectable
1mjoD-3toxA:
undetectable		 1mjoC-3toxA:
15.36
1mjoD-3toxA:
15.36
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.
1MJQ_A_SAMA200_0
(METHIONINE REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ARG A  22
LEU A  48
GLU A  51
ALA A  29
GLY A  32
 None
 1.26A 1mjqA-3toxA:
undetectable
1mjqB-3toxA:
undetectable		 1mjqA-3toxA:
15.36
1mjqB-3toxA:
15.36
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.
1MJQ_C_SAMC199_0
(METHIONINE REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ARG A  22
LEU A  48
GLU A  51
ALA A  29
GLY A  32
 None
 1.23A 1mjqC-3toxA:
undetectable
1mjqD-3toxA:
undetectable		 1mjqC-3toxA:
15.36
1mjqD-3toxA:
15.36
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.
1MJQ_I_SAMI199_0
(METHIONINE REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ARG A  22
LEU A  48
GLU A  51
ALA A  29
GLY A  32
 None
 1.23A 1mjqI-3toxA:
undetectable
1mjqJ-3toxA:
undetectable		 1mjqI-3toxA:
15.36
1mjqJ-3toxA:
15.36
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.
1MJQ_J_SAMJ200_0
(METHIONINE REPRESSOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLU A  31
ARG A   5
LEU A 232
GLU A 229
ALA A 228
 None
 1.08A 1mjqI-3toxA:
undetectable
1mjqJ-3toxA:
undetectable		 1mjqI-3toxA:
15.36
1mjqJ-3toxA:
15.36
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.
1URM_A_BEZA201_0
(PEROXIREDOXIN 5)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 THR A  88
SER A 139
LEU A 232
PHE A  28
ARG A 183
 None
 1.37A 1urmA-3toxA:
2.3		 1urmA-3toxA:
24.24
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.
1UTD_E_TRPE81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.93A 1utdE-3toxA:
undetectable
1utdF-3toxA:
undetectable		 1utdE-3toxA:
15.71
1utdF-3toxA:
15.71
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.
1UTD_H_TRPH81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.97A 1utdH-3toxA:
undetectable
1utdI-3toxA:
undetectable		 1utdH-3toxA:
15.71
1utdI-3toxA:
15.71
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.
1UTD_L_TRPL81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 1.03A 1utdL-3toxA:
undetectable
1utdM-3toxA:
undetectable		 1utdL-3toxA:
15.71
1utdM-3toxA:
15.71
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.
1UTD_O_TRPO81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A 124
THR A  14
GLY A  94
SER A 120
ALA A 121
 None
None
NAP  A 601 (-3.2A)
None
None
 1.00A 1utdO-3toxA:
undetectable
1utdP-3toxA:
undetectable		 1utdO-3toxA:
15.71
1utdP-3toxA:
15.71
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.
1UTD_O_TRPO81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.99A 1utdO-3toxA:
undetectable
1utdP-3toxA:
undetectable		 1utdO-3toxA:
15.71
1utdP-3toxA:
15.71
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.
1UTD_P_TRPP81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
GLY A  94
SER A 120
ALA A 121
 None
None
NAP  A 601 (-3.2A)
None
None
 1.03A 1utdP-3toxA:
undetectable
1utdQ-3toxA:
undetectable		 1utdP-3toxA:
15.71
1utdQ-3toxA:
15.71
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.
1UTD_P_TRPP81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 1.02A 1utdP-3toxA:
undetectable
1utdQ-3toxA:
undetectable		 1utdP-3toxA:
15.71
1utdQ-3toxA:
15.71
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.
1UTD_S_TRPS81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.98A 1utdS-3toxA:
undetectable
1utdT-3toxA:
undetectable		 1utdS-3toxA:
15.71
1utdT-3toxA:
15.71
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.
1UTD_U_TRPU81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 ALA A 124
THR A  14
ILE A  12
GLY A  94
SER A 120
 None
None
None
NAP  A 601 (-3.2A)
None
 0.98A 1utdU-3toxA:
undetectable
1utdV-3toxA:
undetectable		 1utdU-3toxA:
15.71
1utdV-3toxA:
15.71
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.
1UTD_V_TRPV81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 1.02A 1utdL-3toxA:
undetectable
1utdV-3toxA:
undetectable		 1utdL-3toxA:
15.71
1utdV-3toxA:
15.71
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.
2AOF_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LEU A  86
PRO A 130
ALA A 131
ILE A 132
 None
 1.00A 2aofB-3toxA:
undetectable		 2aofB-3toxA:
18.94
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.
2BM9_E_SAME301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A  15
ARG A  40
ASP A  65
ASN A  92
ALA A  93
 NAP  A 601 (-3.3A)
NAP  A 601 (-3.7A)
NAP  A 601 (-3.4A)
NAP  A 601 (-3.1A)
NAP  A 601 (-3.9A)
 1.03A 2bm9E-3toxA:
5.4		 2bm9E-3toxA:
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.
2BXF_A_DZPA2001_1
(SERUM ALBUMIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ILE A 132
PHE A 142
LEU A 169
VAL A 184
LEU A 177
 None
 1.17A 2bxfA-3toxA:
undetectable		 2bxfA-3toxA:
18.60
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.
3D91_A_REMA350_1
(RENIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A 252
PHE A 153
ASP A 250
SER A 145
ALA A 249
 None
None
None
NAP  A 601 (-3.3A)
None
 1.26A 3d91A-3toxA:
undetectable		 3d91A-3toxA:
22.78
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.
3G89_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A  94
THR A 143
ALA A 124
ARG A  40
ALA A  39
 NAP  A 601 (-3.2A)
NAP  A 601 (-3.9A)
None
NAP  A 601 (-3.7A)
NAP  A 601 (-3.6A)
 1.07A 3g89A-3toxA:
6.4		 3g89A-3toxA:
26.71
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.
3G89_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 GLY A  94
THR A 143
ALA A 124
ARG A  40
ALA A  39
 NAP  A 601 (-3.2A)
NAP  A 601 (-3.9A)
None
NAP  A 601 (-3.7A)
NAP  A 601 (-3.6A)
 1.07A 3g89B-3toxA:
6.4		 3g89B-3toxA:
26.71
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.
3G8B_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A  94
THR A 143
ALA A 124
ARG A  40
ALA A  39
 NAP  A 601 (-3.2A)
NAP  A 601 (-3.9A)
None
NAP  A 601 (-3.7A)
NAP  A 601 (-3.6A)
 1.09A 3g8bA-3toxA:
6.5		 3g8bA-3toxA:
26.71
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.
3T7S_A_SAMA300_0
(PUTATIVE
METHYLTRANSFERASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ARG A 220
GLY A 191
SER A 144
GLU A 226
ALA A 249
 None
NAP  A 601 (-3.5A)
None
None
None
 1.09A 3t7sA-3toxA:
6.7		 3t7sA-3toxA:
22.80
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.
3T7S_C_SAMC300_0
(PUTATIVE
METHYLTRANSFERASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ARG A 220
GLY A 191
SER A 144
GLU A 226
ALA A 249
 None
NAP  A 601 (-3.5A)
None
None
None
 1.08A 3t7sC-3toxA:
6.6		 3t7sC-3toxA:
22.80
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.
3UBO_B_ADNB353_2
(ADENOSINE KINASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 SER A 145
ILE A  20
TYR A 159
GLY A 190
 NAP  A 601 (-3.3A)
NAP  A 601 (-3.9A)
NAP  A 601 (-4.7A)
None
 0.93A 3uboB-3toxA:
6.3		 3uboB-3toxA:
28.83
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.
4ACB_C_DXCC1477_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 6 GLY A 190
ARG A 223
ILE A 227
LEU A 248
 None
 1.00A 4acbC-3toxA:
6.0		 4acbC-3toxA:
21.02
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.
4K4Y_A_ACTA502_0
(RNA-DEPENDENT RNA
POLYMERASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LYS A   4
LEU A   6
GLU A  31
LEU A 232
 None
 1.32A 4k4yA-3toxA:
undetectable		 4k4yA-3toxA:
23.06
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.
4K4Y_E_ACTE503_0
(RNA-DEPENDENT RNA
POLYMERASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 4 LYS A   4
LEU A   6
GLU A  31
LEU A 232
 None
 1.33A 4k4yE-3toxA:
undetectable		 4k4yE-3toxA:
23.06
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.
4K4Y_I_ACTI503_0
(RNA-DEPENDENT RNA
POLYMERASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LYS A   4
LEU A   6
GLU A  31
LEU A 232
 None
 1.30A 4k4yI-3toxA:
undetectable		 4k4yI-3toxA:
23.06
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.
4L8F_D_MTXD301_1
(GAMMA-GLUTAMYL
HYDROLASE)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 GLY A 136
GLY A 137
GLY A 138
ALA A 134
GLN A 128
 None
 0.99A 4l8fD-3toxA:
4.2		 4l8fD-3toxA:
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.
4MME_A_29QA603_1
(TRANSPORTER)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 VAL A 156
TYR A 159
PHE A 153
SER A 145
GLY A 148
 None
NAP  A 601 (-4.7A)
None
NAP  A 601 (-3.3A)
None
 1.23A 4mmeA-3toxA:
undetectable		 4mmeA-3toxA:
22.80
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.
4XNX_A_41XA707_1
(TRANSPORTER)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 PHE A 146
VAL A 156
TYR A 159
SER A 145
GLY A 148
 None
None
NAP  A 601 (-4.7A)
NAP  A 601 (-3.3A)
None
 1.10A 4xnxA-3toxA:
undetectable		 4xnxA-3toxA:
20.70
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.
4XP4_A_COCA706_1
(DOPAMINE TRANSPORTER)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 PHE A 146
ALA A 196
VAL A 156
TYR A 159
SER A 145
 None
NAP  A 601 (-3.2A)
None
NAP  A 601 (-4.7A)
NAP  A 601 (-3.3A)
 1.24A 4xp4A-3toxA:
undetectable		 4xp4A-3toxA:
20.95
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.
5EEV_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.93A 5eevA-3toxA:
undetectable
5eevB-3toxA:
undetectable		 5eevA-3toxA:
15.71
5eevB-3toxA:
15.71
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.
5EEW_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.93A 5eewA-3toxA:
undetectable
5eewB-3toxA:
undetectable		 5eewA-3toxA:
15.71
5eewB-3toxA:
15.71
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.
5EEX_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.93A 5eexA-3toxA:
undetectable
5eexB-3toxA:
undetectable		 5eexA-3toxA:
15.71
5eexB-3toxA:
15.71
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.
5EEY_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.93A 5eeyA-3toxA:
undetectable
5eeyB-3toxA:
undetectable		 5eeyA-3toxA:
15.71
5eeyB-3toxA:
15.71
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.
5EEZ_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.94A 5eezA-3toxA:
undetectable
5eezB-3toxA:
undetectable		 5eezA-3toxA:
15.71
5eezB-3toxA:
15.71
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.
5EF0_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.93A 5ef0A-3toxA:
undetectable
5ef0B-3toxA:
undetectable		 5ef0A-3toxA:
15.71
5ef0B-3toxA:
15.71
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.
5EF1_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.94A 5ef1A-3toxA:
undetectable
5ef1B-3toxA:
undetectable		 5ef1A-3toxA:
15.71
5ef1B-3toxA:
15.71
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.
5EF2_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.94A 5ef2A-3toxA:
undetectable
5ef2B-3toxA:
undetectable		 5ef2A-3toxA:
15.71
5ef2B-3toxA:
15.71
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.
5EF3_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 0.94A 5ef3A-3toxA:
undetectable
5ef3B-3toxA:
undetectable		 5ef3A-3toxA:
15.71
5ef3B-3toxA:
15.71
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.
5JW1_B_CELB602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 LEU A 232
LEU A 187
ALA A  33
GLY A 238
ALA A 239
 None
 1.03A 5jw1B-3toxA:
undetectable		 5jw1B-3toxA:
18.74
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.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		6 / 12 GLN A 128
VAL A  35
ALA A 124
GLY A  21
ALA A  16
LEU A  48
 None
 1.34A 5kirB-3toxA:
undetectable		 5kirB-3toxA:
18.08
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.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 145
ALA A 246
GLY A 252
ALA A 253
LEU A 215
 NAP  A 601 (-3.3A)
None
None
None
None
 1.06A 5kirB-3toxA:
undetectable		 5kirB-3toxA:
18.08
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.
5M50_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 ASP A  65
LEU A 140
HIS A  72
THR A 141
GLY A  94
 NAP  A 601 (-3.4A)
None
None
None
NAP  A 601 (-3.2A)
 1.24A 5m50E-3toxA:
7.3		 5m50E-3toxA:
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.
5VEU_A_RITA602_1
(CYTOCHROME P450 3A5)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 145
PHE A 153
ALA A 196
THR A 194
ALA A 222
 NAP  A 601 (-3.3A)
None
NAP  A 601 (-3.2A)
NAP  A 601 (-2.8A)
None
 1.11A 5veuA-3toxA:
undetectable		 5veuA-3toxA:
19.92
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)		 3tox SHORT CHAIN
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 145
GLY A 214
PHE A 153
ALA A 196
THR A 194
 NAP  A 601 (-3.3A)
None
None
NAP  A 601 (-3.2A)
NAP  A 601 (-2.8A)
 1.02A 5veuH-3toxA:
undetectable		 5veuH-3toxA:
19.92