SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'FLC'


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.
1AV2_C_DVAC6_0
(GRAMICIDIN A)		 4bj4 AMPDH2
(Pseudomonas
aeruginosa) 		3 / 3 ALA A  87
VAL A  89
TRP A  97
 None
None
FLC  A1260 (-4.9A)
 0.79A 1av2C-4bj4A:
undetectable
1av2D-4bj4A:
undetectable		 1av2C-4bj4A:
7.48
1av2D-4bj4A:
7.48
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.
1BDW_B_DVAB6_0
(GRAMICIDIN A)		 5d55 HDAB,HDAA (ADHESIN),
HUS-ASSOCIATED
DIFFUSE ADHERENCE
(Escherichia
coli) 		3 / 3 TRP A  38
ALA A  41
VAL A 113
 FLC  A 201 (-3.3A)
None
None
 0.99A 1bdwA-5d55A:
undetectable
1bdwB-5d55A:
undetectable		 1bdwA-5d55A:
6.37
1bdwB-5d55A:
6.37
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.
1C9S_A_TRPA81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 1c9sA-1zb7A:
undetectable
1c9sK-1zb7A:
undetectable		 1c9sA-1zb7A:
9.28
1c9sK-1zb7A:
9.28
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_C_TRPC81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.26A 1c9sB-1zb7A:
undetectable
1c9sC-1zb7A:
undetectable		 1c9sB-1zb7A:
9.28
1c9sC-1zb7A:
9.28
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_D_TRPD81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.21A 1c9sC-1zb7A:
undetectable
1c9sD-1zb7A:
undetectable		 1c9sC-1zb7A:
9.28
1c9sD-1zb7A:
9.28
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_E_TRPE81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 1c9sD-1zb7A:
undetectable
1c9sE-1zb7A:
undetectable		 1c9sD-1zb7A:
9.28
1c9sE-1zb7A:
9.28
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_G_TRPG81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.20A 1c9sF-1zb7A:
undetectable
1c9sG-1zb7A:
undetectable		 1c9sF-1zb7A:
9.28
1c9sG-1zb7A:
9.28
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_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 1c9sG-1zb7A:
undetectable
1c9sH-1zb7A:
undetectable		 1c9sG-1zb7A:
9.28
1c9sH-1zb7A:
9.28
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_I_TRPI81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 1c9sH-1zb7A:
undetectable
1c9sI-1zb7A:
undetectable		 1c9sH-1zb7A:
9.28
1c9sI-1zb7A:
9.28
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_K_TRPK81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.25A 1c9sJ-1zb7A:
undetectable
1c9sK-1zb7A:
undetectable		 1c9sJ-1zb7A:
9.28
1c9sK-1zb7A:
9.28
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.
1DF7_A_MTXA501_2
(DIHYDROFOLATE
REDUCTASE)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		3 / 3 TRP A 374
ARG A 388
THR A 373
 FLC  A 505 (-3.0A)
None
None
 0.76A 1df7A-4tx8A:
undetectable		 1df7A-4tx8A:
14.38
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.
1DMI_A_BHSA1610_1
(NITRIC OXIDE
SYNTHASE)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		4 / 8 SER A 140
ARG A 365
ALA A 144
PHE A 333
 None
FLC  A 742 (-2.9A)
None
None
 0.94A 1dmiA-1po0A:
0.0
1dmiB-1po0A:
0.0		 1dmiA-1po0A:
20.84
1dmiB-1po0A:
20.84
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.
1DX6_A_GNTA602_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 12 GLY A  42
GLY A  43
SER A 111
PHE A 236
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
None
FLC  A 402 (-3.7A)
 0.93A 1dx6A-5yhpA:
12.7		 1dx6A-5yhpA:
19.43
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.
1DX6_A_GNTA602_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 12 GLY A 113
GLY A  42
GLY A  43
SER A 111
HIS A 297
 None
FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
FLC  A 402 (-3.7A)
 1.00A 1dx6A-5yhpA:
12.7		 1dx6A-5yhpA:
19.43
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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		4 / 5 HIS A  61
HIS A 180
HIS A 232
ASP A 305
 ZN  A 423 (-3.5A)
FLC  A 424 (-4.0A)
FLC  A 424 (-4.8A)
FLC  A 424 ( 2.7A)
 0.52A 1e9yB-3d6nA:
22.0		 1e9yB-3d6nA:
22.07
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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		5 / 5 HIS A  58
HIS A  62
HIS A  80
HIS A 104
ASP A 161
 FE  A 202 (-3.3A)
FLC  A 203 (-4.0A)
FE  A 201 ( 3.4A)
FE  A 201 ( 3.4A)
FE  A 202 ( 2.5A)
 0.89A 1e9yB-4n6wA:
undetectable		 1e9yB-4n6wA:
20.38
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.
1EE2_B_CHDB1250_1
(ALCOHOL
DEHYDROGENASE)		 2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1
(Saccharomyces
cerevisiae) 		5 / 11 CYH A 365
SER A 139
HIS A 185
LEU A 352
ILE A 357
 None
None
FLC  A 502 (-4.5A)
None
None
 1.19A 1ee2B-2p4qA:
2.7		 1ee2B-2p4qA:
21.54
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.
1ESW_A_ACRA652_1
(AMYLOMALTASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		4 / 6 GLY A  86
ASP A  85
GLY A  99
SER A  34
 FLC  A 300 ( 4.5A)
None
FLC  A 300 (-3.8A)
FLC  A 300 (-2.7A)
 0.99A 1eswA-4x84A:
undetectable		 1eswA-4x84A:
18.89
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.
1F5L_A_AMRA301_1
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 GLN A  72
GLY A 144
CYH A 421
GLY A 392
 FLC  A 756 (-3.6A)
None
SF4  A 755 (-2.3A)
None
 0.70A 1f5lA-1b0kA:
undetectable		 1f5lA-1b0kA:
17.19
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.
1FWE_C_HAEC989_1
(UREASE)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 6 HIS A  61
HIS A  63
HIS A 180
HIS A 232
ASP A 305
 ZN  A 423 (-3.5A)
ZN  A 423 ( 3.4A)
FLC  A 424 (-4.0A)
FLC  A 424 (-4.8A)
FLC  A 424 ( 2.7A)
 0.46A 1fweC-3d6nA:
23.1		 1fweC-3d6nA:
23.74
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.
1FWE_C_HAEC989_1
(UREASE)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		5 / 6 HIS A  58
HIS A  62
HIS A  80
HIS A 104
ASP A 161
 FE  A 202 (-3.3A)
FLC  A 203 (-4.0A)
FE  A 201 ( 3.4A)
FE  A 201 ( 3.4A)
FE  A 202 ( 2.5A)
 0.98A 1fweC-4n6wA:
undetectable		 1fweC-4n6wA:
17.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_A_TRPA81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 1gtfA-1zb7A:
undetectable
1gtfK-1zb7A:
undetectable		 1gtfA-1zb7A:
9.28
1gtfK-1zb7A:
9.28
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_C_TRPC81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 1gtfB-1zb7A:
undetectable
1gtfC-1zb7A:
undetectable		 1gtfB-1zb7A:
9.28
1gtfC-1zb7A:
9.28
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_D_TRPD81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.27A 1gtfC-1zb7A:
undetectable
1gtfD-1zb7A:
undetectable		 1gtfC-1zb7A:
9.28
1gtfD-1zb7A:
9.28
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_F_TRPF81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 1gtfE-1zb7A:
undetectable
1gtfF-1zb7A:
undetectable		 1gtfE-1zb7A:
9.28
1gtfF-1zb7A:
9.28
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_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 1gtfG-1zb7A:
undetectable
1gtfH-1zb7A:
undetectable		 1gtfG-1zb7A:
9.28
1gtfH-1zb7A:
9.28
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_J_TRPJ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.27A 1gtfI-1zb7A:
undetectable
1gtfJ-1zb7A:
undetectable		 1gtfI-1zb7A:
9.28
1gtfJ-1zb7A:
9.28
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_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 HIS A 147
HIS A 167
THR A 168
SER A 643
 None
O  A1100 ( 3.9A)
None
FLC  A 756 (-2.8A)
 0.83A 1gtfN-1b0kA:
undetectable
1gtfO-1b0kA:
undetectable		 1gtfN-1b0kA:
8.16
1gtfO-1b0kA:
8.16
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_P_TRPP81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 1gtfP-1zb7A:
undetectable
1gtfQ-1zb7A:
undetectable		 1gtfP-1zb7A:
9.28
1gtfQ-1zb7A:
9.28
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_T_TRPT81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 1gtfT-1zb7A:
undetectable
1gtfU-1zb7A:
undetectable		 1gtfT-1zb7A:
9.28
1gtfU-1zb7A:
9.28
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_U_TRPU81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 1gtfU-1zb7A:
undetectable
1gtfV-1zb7A:
undetectable		 1gtfU-1zb7A:
9.28
1gtfV-1zb7A:
9.28
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_V_TRPV81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.20A 1gtfL-1zb7A:
undetectable
1gtfV-1zb7A:
undetectable		 1gtfL-1zb7A:
9.28
1gtfV-1zb7A:
9.28
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_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.26A 1gtnG-1zb7A:
undetectable
1gtnH-1zb7A:
undetectable		 1gtnG-1zb7A:
9.28
1gtnH-1zb7A:
9.28
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_M_TRPM81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 1gtnM-1zb7A:
undetectable
1gtnN-1zb7A:
undetectable		 1gtnM-1zb7A:
9.28
1gtnN-1zb7A:
9.28
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_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 1gtnN-1zb7A:
undetectable
1gtnO-1zb7A:
undetectable		 1gtnN-1zb7A:
9.28
1gtnO-1zb7A:
9.28
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_P_TRPP81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 8 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 1gtnP-1zb7A:
undetectable
1gtnQ-1zb7A:
undetectable		 1gtnP-1zb7A:
9.28
1gtnQ-1zb7A:
9.28
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)		 5z72 CCPC
(Bacillus
velezensis) 		5 / 12 GLY A 148
THR A 262
SER A 129
ALA A  98
ILE A 218
 None
None
FLC  A 303 ( 2.1A)
FLC  A 303 (-3.1A)
FLC  A 303 ( 4.5A)
 0.98A 1gtnL-5z72A:
undetectable
1gtnV-5z72A:
undetectable		 1gtnL-5z72A:
undetectable
1gtnV-5z72A:
undetectable
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.
1JDV_A_ADNA1260_1
(5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.31A 1jdvA-5cyfA:
23.5
1jdvD-5cyfA:
23.5		 1jdvA-5cyfA:
25.58
1jdvD-5cyfA:
25.58
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.
1JDV_B_ADNB2260_1
(5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.31A 1jdvB-5cyfA:
23.6
1jdvC-5cyfA:
6.5		 1jdvB-5cyfA:
25.58
1jdvC-5cyfA:
25.58
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.
1JDV_D_ADND3260_1
(5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.30A 1jdvA-5cyfA:
23.5
1jdvD-5cyfA:
23.5		 1jdvA-5cyfA:
25.58
1jdvD-5cyfA:
25.58
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.
1JDV_E_ADNE4260_1
(5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 12 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.32A 1jdvE-5cyfA:
23.5
1jdvF-5cyfA:
24.1		 1jdvE-5cyfA:
25.58
1jdvF-5cyfA:
25.58
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.
1JLF_A_NVPA999_1
(HIV-1 RT A-CHAIN
HIV-1 RT B-CHAIN)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		4 / 8 GLY A 175
TRP A 383
TYR A 474
GLU A 417
 None
None
None
FLC  A 743 ( 4.8A)
 1.08A 1jlfA-1po0A:
undetectable
1jlfB-1po0A:
undetectable		 1jlfA-1po0A:
22.38
1jlfB-1po0A:
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.
1K2R_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 1k2rA-4lmvA:
undetectable
1k2rB-4lmvA:
undetectable		 1k2rA-4lmvA:
21.10
1k2rB-4lmvA:
21.10
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.
1K2S_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 1k2sA-4lmvA:
undetectable
1k2sB-4lmvA:
undetectable		 1k2sA-4lmvA:
21.10
1k2sB-4lmvA:
21.10
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.
1K2U_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.07A 1k2uA-4lmvA:
undetectable
1k2uB-4lmvA:
undetectable		 1k2uA-4lmvA:
21.10
1k2uB-4lmvA:
21.10
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.
1LZX_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 1lzxA-4lmvA:
undetectable
1lzxB-4lmvA:
undetectable		 1lzxA-4lmvA:
21.10
1lzxB-4lmvA:
21.10
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.
1LZX_B_H4BB1760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 1lzxA-4lmvA:
undetectable
1lzxB-4lmvA:
undetectable		 1lzxA-4lmvA:
21.10
1lzxB-4lmvA:
21.10
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.
1LZZ_B_H4BB1760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 1lzzA-4lmvA:
undetectable
1lzzB-4lmvA:
undetectable		 1lzzA-4lmvA:
21.10
1lzzB-4lmvA:
21.10
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.
1MMV_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.07A 1mmvA-4lmvA:
undetectable
1mmvB-4lmvA:
undetectable		 1mmvA-4lmvA:
21.10
1mmvB-4lmvA:
21.10
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.
1MMW_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 1mmwA-4lmvA:
undetectable
1mmwB-4lmvA:
undetectable		 1mmwA-4lmvA:
21.10
1mmwB-4lmvA:
21.10
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.
1MMW_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 1mmwA-4lmvA:
undetectable
1mmwB-4lmvA:
undetectable		 1mmwA-4lmvA:
21.10
1mmwB-4lmvA:
21.10
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.
1MUO_A_ADNA1_1
(AURORA-RELATED
KINASE 1)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 9 GLY A 215
VAL A 222
ALA A 233
LEU A 263
TYR A 285
LEU A 343
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 ( 4.6A)
TAK  A1507 (-4.7A)
 0.88A 1muoA-4c02A:
7.8		 1muoA-4c02A:
26.14
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.
1MXD_A_ACRA732_1
(ALPHA AMYLASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		5 / 9 GLY A 430
GLY A 183
GLY A 404
GLY A 406
ASP A 407
 None
None
FLC  A 501 (-3.6A)
None
None
 1.04A 1mxdA-5x9rA:
undetectable		 1mxdA-5x9rA:
20.75
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.
1MXG_A_ACRA442_1
(ALPHA AMYLASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		5 / 11 GLY A 430
GLY A 183
GLY A 404
GLY A 406
ASP A 407
 None
None
FLC  A 501 (-3.6A)
None
None
 1.04A 1mxgA-5x9rA:
undetectable		 1mxgA-5x9rA:
20.75
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.
1MXG_A_ACRA443_1
(ALPHA AMYLASE)		 4x4w CCA TRNA
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 THR A 128
ASN A 130
ASP A 126
GLU A 215
 None
FLC  A 501 ( 3.6A)
FLC  A 501 ( 4.7A)
FLC  A 501 ( 4.8A)
 1.08A 1mxgA-4x4wA:
undetectable		 1mxgA-4x4wA:
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.
1NBI_A_SAMA293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		4 / 5 ARG A 428
ASP A 112
ASN A 109
TYR A 300
 FLC  A 501 (-2.8A)
None
None
None
 1.21A 1nbiA-5x9rA:
undetectable		 1nbiA-5x9rA:
20.45
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.
1NBI_B_SAMB1293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		4 / 5 ARG A 428
ASP A 112
ASN A 109
TYR A 300
 FLC  A 501 (-2.8A)
None
None
None
 1.21A 1nbiB-5x9rA:
undetectable		 1nbiB-5x9rA:
20.45
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.
1NW5_A_SAMA401_1
(MODIFICATION
METHYLASE RSRI)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		3 / 3 ASP A 348
HIS A 288
ASP A 155
 FLC  A 509 ( 4.8A)
ZN  A 508 (-3.1A)
None
 0.67A 1nw5A-5hvfA:
undetectable		 1nw5A-5hvfA:
19.11
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.
1ODI_A_ADNA1237_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.33A 1odiA-5cyfA:
23.8		 1odiA-5cyfA:
26.11
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.
1ODI_B_ADNB1237_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.36A 1odiB-5cyfA:
23.8		 1odiB-5cyfA:
26.11
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.
1ODI_C_ADNC1238_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.26A 1odiC-5cyfA:
24.0		 1odiC-5cyfA:
26.11
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.
1ODI_D_ADND1237_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.33A 1odiD-5cyfA:
23.9		 1odiD-5cyfA:
26.11
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.
1ODI_E_ADNE1237_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.28A 1odiE-5cyfA:
23.9		 1odiE-5cyfA:
26.11
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.
1ODI_F_ADNF1238_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.26A 1odiF-5cyfA:
23.8		 1odiF-5cyfA:
26.11
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.
1OE1_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		3 / 3 ASP A 257
HIS A 290
HIS A 231
 FLC  A 501 (-3.8A)
FLC  A 501 (-3.8A)
FLC  A 501 (-3.9A)
 0.67A 1oe1A-5jpeA:
undetectable		 1oe1A-5jpeA:
23.53
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.
1OE3_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		3 / 3 ASP A 257
HIS A 290
HIS A 231
 FLC  A 501 (-3.8A)
FLC  A 501 (-3.8A)
FLC  A 501 (-3.9A)
 0.66A 1oe3A-5jpeA:
undetectable		 1oe3A-5jpeA:
23.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ONI_A_BEZA501_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 3mqw PUTATIVE
ENDORIBONUCLEASE
L-PSP
(Entamoeba
histolytica) 		4 / 7 TYR A  19
ILE A  35
PRO A 114
GLU A 120
 FLC  A 140 (-4.0A)
FLC  A 140 (-4.8A)
FLC  A 140 (-4.5A)
FLC  A 140 (-2.8A)
 0.43A 1oniA-3mqwA:
23.0
1oniB-3mqwA:
22.8		 1oniA-3mqwA:
42.75
1oniB-3mqwA:
42.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ONI_B_BEZB503_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 3mqw PUTATIVE
ENDORIBONUCLEASE
L-PSP
(Entamoeba
histolytica) 		4 / 6 TYR A  19
ILE A  35
PRO A 114
GLU A 120
 FLC  A 140 (-4.0A)
FLC  A 140 (-4.8A)
FLC  A 140 (-4.5A)
FLC  A 140 (-2.8A)
 0.41A 1oniB-3mqwA:
22.8
1oniC-3mqwA:
22.8		 1oniB-3mqwA:
42.75
1oniC-3mqwA:
42.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ONI_C_BEZC505_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 3mqw PUTATIVE
ENDORIBONUCLEASE
L-PSP
(Entamoeba
histolytica) 		4 / 6 TYR A  19
ILE A  35
PRO A 114
GLU A 120
 FLC  A 140 (-4.0A)
FLC  A 140 (-4.8A)
FLC  A 140 (-4.5A)
FLC  A 140 (-2.8A)
 0.32A 1oniA-3mqwA:
23.0
1oniC-3mqwA:
22.8		 1oniA-3mqwA:
42.75
1oniC-3mqwA:
42.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ONI_E_BEZE509_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 3mqw PUTATIVE
ENDORIBONUCLEASE
L-PSP
(Entamoeba
histolytica) 		4 / 7 TYR A  19
ILE A  35
PRO A 114
GLU A 120
 FLC  A 140 (-4.0A)
FLC  A 140 (-4.8A)
FLC  A 140 (-4.5A)
FLC  A 140 (-2.8A)
 0.42A 1oniD-3mqwA:
23.0
1oniE-3mqwA:
22.9		 1oniD-3mqwA:
42.75
1oniE-3mqwA:
42.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ONI_I_BEZI517_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 3mqw PUTATIVE
ENDORIBONUCLEASE
L-PSP
(Entamoeba
histolytica) 		4 / 7 TYR A  19
ILE A  35
PRO A 114
GLU A 120
 FLC  A 140 (-4.0A)
FLC  A 140 (-4.8A)
FLC  A 140 (-4.5A)
FLC  A 140 (-2.8A)
 0.46A 1oniG-3mqwA:
22.8
1oniI-3mqwA:
23.0		 1oniG-3mqwA:
42.75
1oniI-3mqwA:
42.75
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.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.35A 1os2A-4a3wA:
7.9		 1os2A-4a3wA:
26.40
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.
1OS2_D_HAED574_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.34A 1os2D-4a3wA:
7.9		 1os2D-4a3wA:
26.40
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.
1P6H_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 1p6hA-4lmvA:
undetectable
1p6hB-4lmvA:
undetectable		 1p6hA-4lmvA:
21.00
1p6hB-4lmvA:
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.
1P6H_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 1p6hA-4lmvA:
undetectable
1p6hB-4lmvA:
undetectable		 1p6hA-4lmvA:
21.00
1p6hB-4lmvA:
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.
1P6I_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.14A 1p6iA-4lmvA:
undetectable
1p6iB-4lmvA:
undetectable		 1p6iA-4lmvA:
21.00
1p6iB-4lmvA:
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.
1P6K_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 1p6kA-4lmvA:
undetectable
1p6kB-4lmvA:
undetectable		 1p6kA-4lmvA:
21.00
1p6kB-4lmvA:
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.
1PW7_A_RABA645_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
SER A 125
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
None
None
None
FLC  A 301 (-2.8A)
 1.48A 1pw7A-5cyfA:
24.5		 1pw7A-5cyfA:
27.78
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.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 12 GLY A  42
GLY A  43
SER A 111
PHE A 236
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
None
FLC  A 402 (-3.7A)
 0.85A 1qtiA-5yhpA:
11.6		 1qtiA-5yhpA:
19.75
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.
1RJD_A_SAMA801_1
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 6 ARG A 121
TYR A 198
ASN A 205
GLU A 232
 FLC  A 301 (-3.0A)
None
None
None
 1.32A 1rjdA-5cyfA:
undetectable		 1rjdA-5cyfA:
21.84
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.
1RS6_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 8 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 1rs6A-4lmvA:
undetectable
1rs6B-4lmvA:
undetectable		 1rs6A-4lmvA:
21.00
1rs6B-4lmvA:
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.
1RXC_B_URFB2011_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.39A 1rxcB-5cyfA:
26.2		 1rxcB-5cyfA:
25.93
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.
1RXC_E_URFE2031_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.48A 1rxcE-5cyfA:
26.3		 1rxcE-5cyfA:
25.93
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.
1RXC_I_URFI2041_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.42A 1rxcI-5cyfA:
26.3		 1rxcI-5cyfA:
25.93
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.
1RXC_K_URFK2061_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.40A 1rxcK-5cyfA:
24.9		 1rxcK-5cyfA:
25.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1S9A_A_BEZA306_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		7 / 11 GLY A 106
PRO A 107
TYR A 160
TYR A 194
ARG A 215
HIS A 218
HIS A 220
 FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FE  A 292 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
 0.36A 1s9aA-3n9tA:
28.2		 1s9aA-3n9tA:
31.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1S9A_A_BEZA306_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		5 / 11 GLY A 106
TYR A 194
ARG A 215
HIS A 218
HIS A 234
 FLC  A 293 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
None
 1.45A 1s9aA-3n9tA:
28.2		 1s9aA-3n9tA:
31.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1S9A_B_BEZB307_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		5 / 12 GLY A 106
PRO A 107
ARG A 215
HIS A 218
HIS A 234
 FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
None
 1.42A 1s9aB-3n9tA:
28.0		 1s9aB-3n9tA:
31.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1S9A_B_BEZB307_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		7 / 12 GLY A 106
PRO A 107
TYR A 160
TYR A 194
ARG A 215
HIS A 218
HIS A 220
 FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FE  A 292 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
 0.29A 1s9aB-3n9tA:
28.0		 1s9aB-3n9tA:
31.56
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.
1S9Q_A_CHDA459_0
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 2q7b ACETYLTRANSFERASE,
GNAT FAMILY
(Streptococcus
agalactiae) 		4 / 6 ASP A 118
LEU A 117
VAL A 116
ILE A 115
 FLC  A 164 (-3.2A)
None
None
None
 0.80A 1s9qA-2q7bA:
undetectable		 1s9qA-2q7bA:
22.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		10 / 11 ASP A  80
GLY A 106
PRO A 107
TYR A 160
TYR A 194
ILE A 196
ARG A 215
HIS A 218
HIS A 220
VAL A 248
 FLC  A 293 (-3.6A)
FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FE  A 292 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
FLC  A 293 (-4.7A)
 0.49A 1tmxA-3n9tA:
33.0		 1tmxA-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		8 / 11 ASP A  80
GLY A 106
PRO A 107
TYR A 194
ILE A 196
ARG A 215
HIS A 218
HIS A 234
 FLC  A 293 (-3.6A)
FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
None
 1.30A 1tmxA-3n9tA:
33.0		 1tmxA-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		6 / 11 LEU A  77
ASP A  80
TYR A 160
ILE A 196
HIS A 218
VAL A 248
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.6A)
FE  A 292 ( 4.3A)
FLC  A 293 (-4.1A)
FE  A 292 ( 3.2A)
FLC  A 293 (-4.7A)
 1.47A 1tmxA-3n9tA:
33.0		 1tmxA-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		9 / 11 LEU A  77
ASP A  80
TYR A 160
TYR A 194
ILE A 196
ARG A 215
HIS A 218
HIS A 220
VAL A 248
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.6A)
FE  A 292 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
FLC  A 293 (-4.7A)
 0.52A 1tmxA-3n9tA:
33.0		 1tmxA-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		7 / 11 LEU A  77
ASP A  80
TYR A 194
ILE A 196
ARG A 215
HIS A 218
HIS A 234
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.6A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
None
 1.39A 1tmxA-3n9tA:
33.0		 1tmxA-3n9tA:
44.41
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.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		5 / 11 LEU A 408
ASP A 407
GLY A 403
ILE A 121
HIS A 299
 None
None
FLC  A 501 ( 3.8A)
None
None
 1.19A 1tmxA-5x9rA:
undetectable		 1tmxA-5x9rA:
20.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		5 / 12 ASP A  80
GLY A 106
TYR A 160
HIS A 218
HIS A 234
 FLC  A 293 (-3.6A)
FLC  A 293 ( 4.3A)
FE  A 292 ( 4.3A)
FE  A 292 ( 3.2A)
None
 1.34A 1tmxB-3n9tA:
33.3		 1tmxB-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		12 / 12 LEU A  77
ASP A  80
GLY A 106
PRO A 107
TYR A 160
TYR A 194
ILE A 196
ARG A 215
HIS A 218
HIS A 220
HIS A 234
VAL A 248
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.6A)
FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FE  A 292 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
None
FLC  A 293 (-4.7A)
 0.47A 1tmxB-3n9tA:
33.3		 1tmxB-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		9 / 12 LEU A  77
ASP A  80
GLY A 106
PRO A 107
TYR A 194
ILE A 196
ARG A 215
HIS A 218
HIS A 234
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.6A)
FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
None
 1.21A 1tmxB-3n9tA:
33.3		 1tmxB-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		7 / 12 LEU A  77
ASP A  80
TYR A 160
ILE A 196
HIS A 218
HIS A 234
VAL A 248
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.6A)
FE  A 292 ( 4.3A)
FLC  A 293 (-4.1A)
FE  A 292 ( 3.2A)
None
FLC  A 293 (-4.7A)
 1.48A 1tmxB-3n9tA:
33.3		 1tmxB-3n9tA:
44.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		7 / 12 LEU A  77
PRO A 107
ILE A 196
ARG A 215
HIS A 220
HIS A 218
VAL A 248
 FLC  A 293 (-4.4A)
FLC  A 293 (-3.5A)
FLC  A 293 (-4.1A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.1A)
FE  A 292 ( 3.2A)
FLC  A 293 (-4.7A)
 1.48A 1tmxB-3n9tA:
33.3		 1tmxB-3n9tA:
44.41
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.
1TW4_A_CHDA130_1
(FATTY ACID-BINDING
PROTEIN)		 2q7b ACETYLTRANSFERASE,
GNAT FAMILY
(Streptococcus
agalactiae) 		3 / 3 TYR A 130
ARG A 152
GLN A  24
 None
FLC  A 164 (-4.3A)
FLC  A 164 (-3.9A)
 0.82A 1tw4A-2q7bA:
undetectable		 1tw4A-2q7bA:
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.
1UDT_A_VIAA1000_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		5 / 12 ASN A 272
ILE A 255
VAL A 267
LEU A 275
MET A 299
 FLC  A 504 ( 4.1A)
None
None
None
None
 1.33A 1udtA-4tx8A:
undetectable		 1udtA-4tx8A:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTD_D_TRPD81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 1utdD-1zb7A:
undetectable
1utdE-1zb7A:
undetectable		 1utdD-1zb7A:
9.28
1utdE-1zb7A:
9.28
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_G_TRPG81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.28A 1utdG-1zb7A:
undetectable
1utdH-1zb7A:
undetectable		 1utdG-1zb7A:
9.28
1utdH-1zb7A:
9.28
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_K_TRPK81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.25A 1utdA-1zb7A:
undetectable
1utdK-1zb7A:
undetectable		 1utdA-1zb7A:
9.28
1utdK-1zb7A:
9.28
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)		 5z72 CCPC
(Bacillus
velezensis) 		5 / 12 ILE A 218
GLY A 148
THR A 262
SER A 129
ALA A  98
 FLC  A 303 ( 4.5A)
None
None
FLC  A 303 ( 2.1A)
FLC  A 303 (-3.1A)
 0.95A 1utdL-5z72A:
undetectable
1utdM-5z72A:
undetectable		 1utdL-5z72A:
undetectable
1utdM-5z72A:
undetectable
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_M_TRPM81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 1utdM-1zb7A:
undetectable
1utdN-1zb7A:
undetectable		 1utdM-1zb7A:
9.28
1utdN-1zb7A:
9.28
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_N_TRPN81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.25A 1utdN-1zb7A:
undetectable
1utdO-1zb7A:
undetectable		 1utdN-1zb7A:
9.28
1utdO-1zb7A:
9.28
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)		 5z72 CCPC
(Bacillus
velezensis) 		5 / 12 ILE A 218
GLY A 148
THR A 262
SER A 129
ALA A  98
 FLC  A 303 ( 4.5A)
None
None
FLC  A 303 ( 2.1A)
FLC  A 303 (-3.1A)
 0.95A 1utdO-5z72A:
undetectable
1utdP-5z72A:
undetectable		 1utdO-5z72A:
undetectable
1utdP-5z72A:
undetectable
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)		 5z72 CCPC
(Bacillus
velezensis) 		5 / 11 ILE A 218
GLY A 148
THR A 262
SER A 129
ALA A  98
 FLC  A 303 ( 4.5A)
None
None
FLC  A 303 ( 2.1A)
FLC  A 303 (-3.1A)
 0.94A 1utdP-5z72A:
undetectable
1utdQ-5z72A:
undetectable		 1utdP-5z72A:
undetectable
1utdQ-5z72A:
undetectable
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_Q_TRPQ81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.10A 1utdQ-1zb7A:
undetectable
1utdR-1zb7A:
undetectable		 1utdQ-1zb7A:
9.28
1utdR-1zb7A:
9.28
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_R_TRPR81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 1utdR-1zb7A:
undetectable
1utdS-1zb7A:
undetectable		 1utdR-1zb7A:
9.28
1utdS-1zb7A:
9.28
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.
1UTT_A_HAEA1265_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.22A 1uttA-4a3wA:
8.1		 1uttA-4a3wA:
25.14
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.
1UTZ_A_HAEA1267_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.31A 1utzA-4a3wA:
8.0		 1utzA-4a3wA:
25.14
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.
1UTZ_B_HAEB1266_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.27A 1utzB-4a3wA:
8.2		 1utzB-4a3wA:
25.14
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.
1UWH_A_BAXA1723_1
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 ALA A 233
LEU A 263
THR A 283
LEU A 319
HIS A 334
 TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
None
 0.37A 1uwhA-4c02A:
24.8		 1uwhA-4c02A:
28.08
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.
1UWH_B_BAXB1723_1
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 ALA A 233
LYS A 235
LEU A 263
THR A 283
LEU A 319
HIS A 334
 TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
None
 0.58A 1uwhB-4c02A:
24.7		 1uwhB-4c02A:
28.08
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.
1UWJ_A_BAXA1723_1
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 VAL A 222
ALA A 233
LEU A 263
THR A 283
LEU A 319
HIS A 334
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
None
 0.48A 1uwjA-4c02A:
6.9		 1uwjA-4c02A:
27.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UWJ_B_BAXB1723_1
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 VAL A 222
ALA A 233
LEU A 263
THR A 283
LEU A 319
HIS A 334
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
None
 0.47A 1uwjB-4c02A:
7.0		 1uwjB-4c02A:
27.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1W5U_C_DVAC6_0
(GRAMICIDIN D)		 4bj4 AMPDH2
(Pseudomonas
aeruginosa) 		3 / 3 ALA A  87
VAL A  89
TRP A  97
 None
None
FLC  A1260 (-4.9A)
 0.79A 1w5uC-4bj4A:
undetectable
1w5uD-4bj4A:
undetectable		 1w5uC-4bj4A:
7.48
1w5uD-4bj4A:
7.48
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.
1W76_A_GNTA1538_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 11 GLY A  42
GLY A  43
SER A 111
PHE A 228
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
None
FLC  A 402 (-3.7A)
 1.04A 1w76A-5yhpA:
12.0		 1w76A-5yhpA:
19.43
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.
1W76_B_GNTB1538_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 10 GLY A  42
GLY A  43
SER A 111
PHE A 236
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
None
FLC  A 402 (-3.7A)
 0.83A 1w76B-5yhpA:
12.1		 1w76B-5yhpA:
19.43
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.
1WG8_B_SAMB3141_0
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		5 / 12 GLY A 312
GLY A 313
GLY A 724
ASP A 720
SER A 140
 None
None
None
FLC  A 742 (-4.1A)
None
 1.11A 1wg8B-1po0A:
undetectable		 1wg8B-1po0A:
17.20
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.
1WOP_A_FFOA2887_1
(AMINOMETHYLTRANSFERA
SE)		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		3 / 3 ASP B 258
GLU B 217
ARG B  97
 None
None
FLC  B 292 (-2.8A)
 0.87A 1wopA-3d6nB:
undetectable		 1wopA-3d6nB:
23.18
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.
1WRL_D_TFPD205_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 4a1f REPLICATIVE DNA
HELICASE
(Helicobacter
pylori) 		5 / 10 MET A 234
GLU A 256
MET A 214
MET A 213
SER A 211
 FLC  A1474 (-4.0A)
None
None
None
FLC  A1474 (-2.9A)
 1.21A 1wrlC-4a1fA:
undetectable
1wrlD-4a1fA:
undetectable		 1wrlC-4a1fA:
15.22
1wrlD-4a1fA:
15.22
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.
1X70_A_715A801_2
(DIPEPTIDYL PEPTIDASE
IV)		 2p2w CITRATE SYNTHASE
(Thermotoga
maritima) 		3 / 3 ARG A 325
SER A  99
TYR A 196
 FLC  A 401 ( 3.1A)
None
None
 0.67A 1x70A-2p2wA:
undetectable		 1x70A-2p2wA:
20.26
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.
1XOQ_B_ROFB501_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		3 / 3 MET A  57
ASN A 233
GLN A  22
 None
FLC  A 302 (-4.2A)
None
 1.06A 1xoqB-4to8A:
undetectable		 1xoqB-4to8A:
22.41
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.
1Y93_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 6 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.32A 1y93A-4a3wA:
8.1		 1y93A-4a3wA:
26.55
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.
1YMX_B_CFXB1002_1
(BETA-LACTAMASE
CTX-M-9)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
GLY A 241
SER A 242
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.2A)
FLC  A 301 (-2.8A)
None
 0.74A 1ymxB-5ctmA:
18.8		 1ymxB-5ctmA:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Z35_A_2FAA300_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.33A 1z35A-5cyfA:
23.5		 1z35A-5cyfA:
26.23
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.
1Z37_A_ADNA300_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 9 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.37A 1z37A-5cyfA:
23.5		 1z37A-5cyfA:
26.23
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.
1ZVL_A_H4BA900_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 1zvlA-4lmvA:
undetectable
1zvlB-4lmvA:
undetectable		 1zvlA-4lmvA:
21.00
1zvlB-4lmvA:
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.
1ZZQ_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 1zzqA-4lmvA:
undetectable
1zzqB-4lmvA:
undetectable		 1zzqA-4lmvA:
21.10
1zzqB-4lmvA:
21.10
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.
2AC7_A_ADNA1216_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.34A 2ac7A-5cyfA:
22.6
2ac7B-5cyfA:
22.6		 2ac7A-5cyfA:
24.92
2ac7B-5cyfA:
24.92
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.
2AC7_B_ADNB1215_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.35A 2ac7A-5cyfA:
22.6
2ac7B-5cyfA:
22.6		 2ac7A-5cyfA:
24.92
2ac7B-5cyfA:
24.92
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.
2AQU_B_DR7B300_1
(HIV-1 PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 10 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 0.95A 2aquA-4x84A:
undetectable		 2aquA-4x84A:
19.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2AXN_A_EDTA737_0
(6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
PHOSPHATASE 3
(6PF-2-K/FRU-
2,6-P2ASE
BRAIN/PLACENTA-TYPE
ISOZYME) (IPFK-2)
[INCLUDES: 6-
PHOSPHOFRUCTO-2-KINA
SE (EC 2.7.1.105)
FRUCTOSE-2,6-BISPHO
SPHATASE (EC
3.1.3.46)])		 5htk 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 2
(Homo
sapiens) 		12 / 12 PRO A  47
LYS A  51
THR A  52
ASN A  73
GLY A  75
ARG A  79
PHE A  91
ARG A 102
ALA A 129
THR A 130
ARG A 193
TYR A 197
 ATP  A 602 (-4.3A)
ATP  A 602 (-2.7A)
ATP  A 602 ( 3.1A)
ATP  A 602 ( 3.9A)
FLC  A 601 (-3.0A)
ATP  A 602 ( 4.1A)
FLC  A 601 ( 4.8A)
GOL  A 606 ( 2.0A)
FLC  A 601 (-3.3A)
FLC  A 601 (-2.7A)
None
GOL  A 606 ( 3.4A)
 0.54A 2axnA-5htkA:
48.1		 2axnA-5htkA:
67.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BJF_A_DXCA330_0
(CHOLOYLGLYCINE
HYDROLASE)		 3blw ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT 1
(Saccharomyces
cerevisiae) 		5 / 12 ARG A 274
PHE A 230
ALA A 108
ILE A 214
THR A 235
 FLC  A1001 (-3.4A)
None
None
None
None
 1.13A 2bjfA-3blwA:
undetectable		 2bjfA-3blwA:
25.84
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5wxu 11S GLOBULIN
(Wrightia
tinctoria) 		5 / 12 ILE A 105
ALA A 333
LEU A 326
ILE A 295
ILE A 104
 None
None
None
FLC  A 503 (-3.9A)
None
 1.11A 2bl9A-5wxuA:
undetectable		 2bl9A-5wxuA:
14.71
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.
2BXC_A_P1ZA2001_1
(SERUM ALBUMIN)		 4uzy FLAGELLAR ASSOCIATED
PROTEIN
(Chlamydomonas
reinhardtii) 		6 / 12 SER A 423
LEU A 349
LEU A 317
ALA A 330
ILE A 357
ALA A 356
 None
FLC  A1647 (-3.9A)
None
None
None
None
 1.13A 2bxcA-4uzyA:
undetectable		 2bxcA-4uzyA:
24.54
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.
2C8A_A_NCAA1252_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 7 SER A 291
SER A 289
PHE A 372
GLU A 363
 None
None
None
FLC  A 509 (-3.3A)
 1.22A 2c8aA-5hvfA:
undetectable		 2c8aA-5hvfA:
20.24
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.
2C8A_B_NCAB1246_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		5 / 7 GLY A 371
SER A 291
SER A 289
PHE A 372
GLU A 363
 None
None
None
None
FLC  A 509 (-3.3A)
 1.27A 2c8aB-5hvfA:
undetectable		 2c8aB-5hvfA:
20.24
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.
2C8A_C_NCAC1252_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 6 SER A 291
SER A 289
PHE A 372
GLU A 363
 None
None
None
FLC  A 509 (-3.3A)
 1.28A 2c8aC-5hvfA:
undetectable		 2c8aC-5hvfA:
20.24
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.
2E1Q_D_SALD5006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		4 / 5 ARG B  97
PHE B  41
THR B  48
LEU B  50
 FLC  B 292 (-2.8A)
None
FLC  B 292 (-4.1A)
None
 1.37A 2e1qD-3d6nB:
undetectable		 2e1qD-3d6nB:
11.87
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.
2F6D_A_ACRA996_1
(GLUCOAMYLASE GLU1)		 2p2w CITRATE SYNTHASE
(Thermotoga
maritima) 		5 / 7 HIS A 211
ASN A 298
ASP A 257
THR A 318
GLY A 212
 FLC  A 401 ( 4.5A)
FLC  A 401 ( 4.0A)
None
None
FLC  A 401 ( 4.0A)
 1.35A 2f6dA-2p2wA:
undetectable		 2f6dA-2p2wA:
23.39
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.
2G6H_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 8 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.13A 2g6hA-4lmvA:
undetectable
2g6hB-4lmvA:
undetectable		 2g6hA-4lmvA:
21.10
2g6hB-4lmvA:
21.10
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.
2G6H_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 2g6hA-4lmvA:
undetectable
2g6hB-4lmvA:
undetectable		 2g6hA-4lmvA:
21.10
2g6hB-4lmvA:
21.10
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.
2G6K_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.13A 2g6kA-4lmvA:
undetectable
2g6kB-4lmvA:
undetectable		 2g6kA-4lmvA:
21.10
2g6kB-4lmvA:
21.10
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.
2G6M_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 2g6mA-4lmvA:
undetectable
2g6mB-4lmvA:
undetectable		 2g6mA-4lmvA:
21.10
2g6mB-4lmvA:
21.10
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.
2G6M_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 2g6mA-4lmvA:
undetectable
2g6mB-4lmvA:
undetectable		 2g6mA-4lmvA:
21.10
2g6mB-4lmvA:
21.10
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.
2HMA_A_SAMA375_0
(PROBABLE TRNA
(5-METHYLAMINOMETHYL
-2-THIOURIDYLATE)-ME
THYLTRANSFERASE)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		5 / 11 GLY A 180
SER A 643
ASP A 100
THR A 168
HIS A 147
 None
FLC  A 756 (-2.8A)
None
None
None
 1.40A 2hmaA-1b0kA:
undetectable		 2hmaA-1b0kA:
18.53
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.
2HS1_A_017A201_1
(HIV-1 PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 0.99A 2hs1A-4x84A:
undetectable		 2hs1A-4x84A:
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.
2HU6_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.29A 2hu6A-4a3wA:
8.1		 2hu6A-4a3wA:
26.55
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.
2HX4_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 2hx4A-4lmvA:
undetectable
2hx4B-4lmvA:
undetectable		 2hx4A-4lmvA:
21.00
2hx4B-4lmvA:
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.
2IGT_A_SAMA1001_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 3aqu AT4G19810
(Arabidopsis
thaliana) 		5 / 12 TYR A 290
ALA A 238
PRO A 198
GLY A 188
GLY A 262
 FLC  A 356 (-4.6A)
None
None
None
None
 1.04A 2igtA-3aquA:
undetectable		 2igtA-3aquA:
19.44
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_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 3aqu AT4G19810
(Arabidopsis
thaliana) 		5 / 12 TYR A 290
ALA A 238
PRO A 198
GLY A 188
GLY A 262
 FLC  A 356 (-4.6A)
None
None
None
None
 1.06A 2igtB-3aquA:
undetectable		 2igtB-3aquA:
19.44
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.
2JB7_B_ACTB1169_0
(HYPOTHETICAL PROTEIN
PAE2307)		 4x4w CCA TRNA
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 ARG A  41
ARG A 177
ARG A 181
 FLC  A 501 (-2.5A)
FLC  A 501 (-2.4A)
None
 0.94A 2jb7A-4x4wA:
undetectable
2jb7B-4x4wA:
undetectable
2jb7C-4x4wA:
undetectable		 2jb7A-4x4wA:
18.58
2jb7B-4x4wA:
18.58
2jb7C-4x4wA:
18.58
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.
2JB7_B_ACTB1169_0
(HYPOTHETICAL PROTEIN
PAE2307)		 4x4w CCA TRNA
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 ARG A 177
ARG A 181
ARG A  41
 FLC  A 501 (-2.4A)
None
FLC  A 501 (-2.5A)
 0.94A 2jb7A-4x4wA:
undetectable
2jb7B-4x4wA:
undetectable
2jb7C-4x4wA:
undetectable		 2jb7A-4x4wA:
18.58
2jb7B-4x4wA:
18.58
2jb7C-4x4wA:
18.58
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.
2JB7_B_ACTB1169_0
(HYPOTHETICAL PROTEIN
PAE2307)		 4x4w CCA TRNA
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 ARG A 181
ARG A  41
ARG A 177
 None
FLC  A 501 (-2.5A)
FLC  A 501 (-2.4A)
 0.85A 2jb7A-4x4wA:
undetectable
2jb7B-4x4wA:
undetectable
2jb7C-4x4wA:
undetectable		 2jb7A-4x4wA:
18.58
2jb7B-4x4wA:
18.58
2jb7C-4x4wA:
18.58
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.
2JIH_B_097B1001_1
(ADAMTS-1)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 8 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.31A 2jihB-4a3wA:
11.6		 2jihB-4a3wA:
21.80
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.
2NMY_A_ROCA401_2
(PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 0.97A 2nmyB-4x84A:
undetectable		 2nmyB-4x84A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OW9_A_HAEA502_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 6 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.36A 2ow9A-4a3wA:
7.7		 2ow9A-4a3wA:
20.81
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.
2OW9_B_HAEB502_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.33A 2ow9B-4a3wA:
7.7		 2ow9B-4a3wA:
20.81
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.
2OZR_C_HAEC3001_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.33A 2ozrC-4a3wA:
7.5		 2ozrC-4a3wA:
20.81
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.
2OZR_D_HAED3002_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.39A 2ozrD-4a3wA:
7.5		 2ozrD-4a3wA:
20.81
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.
2OZR_E_HAEE3003_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.33A 2ozrE-4a3wA:
5.7		 2ozrE-4a3wA:
20.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2PCP_C_1PCC212_1
(IMMUNOGLOBULIN)		 3wbd SINGLE CHAIN FV
FRAGMENT OF MAB735
(Mus
musculus) 		6 / 10 HIS A  31
PHE A  94
GLY A  96
TYR A 101
HIS A 162
TYR A 160
 FLC  A2001 (-3.6A)
None
None
None
None
None
 1.11A 2pcpC-3wbdA:
22.6
2pcpD-3wbdA:
22.5		 2pcpC-3wbdA:
54.98
2pcpD-3wbdA:
35.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2PCP_C_1PCC212_1
(IMMUNOGLOBULIN)		 3wbd SINGLE CHAIN FV
FRAGMENT OF MAB735
(Mus
musculus) 		7 / 10 HIS A  31
TYR A  37
PHE A  94
GLY A  96
TYR A 101
TYR A 160
HIS A 162
 FLC  A2001 (-3.6A)
None
None
None
None
None
None
 0.59A 2pcpC-3wbdA:
22.6
2pcpD-3wbdA:
22.5		 2pcpC-3wbdA:
54.98
2pcpD-3wbdA:
35.86
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.
2QD5_A_CHDA701_0
(FERROCHELATASE)		 2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 372
SER A 128
VAL A 184
GLY A 187
 None
FLC  A 502 (-2.4A)
None
None
 1.01A 2qd5A-2p4qA:
3.0		 2qd5A-2p4qA:
21.40
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.
2QHF_A_ACTA509_0
(CHORISMATE SYNTHASE)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		3 / 3 ARG A 159
GLN A 176
PRO A 177
 None
FLC  A 743 (-3.8A)
None
 0.98A 2qhfA-1po0A:
undetectable		 2qhfA-1po0A:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2UY4_A_AZMA1311_1
(ENDOCHITINASE)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		6 / 9 TYR A  88
PHE A 116
ASP A 194
GLN A 268
TYR A 270
TRP A 374
 None
FLC  A 506 (-4.4A)
FLC  A 506 ( 3.0A)
FLC  A 505 ( 2.7A)
FLC  A 505 (-4.2A)
FLC  A 505 (-3.0A)
 0.43A 2uy4A-4tx8A:
23.8		 2uy4A-4tx8A:
23.39
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.
2UY4_A_AZMA1311_1
(ENDOCHITINASE)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		6 / 9 TYR A  88
PHE A 116
GLY A 158
ASP A 194
GLN A 268
TYR A 270
 None
FLC  A 506 (-4.4A)
FLC  A 506 (-3.0A)
FLC  A 506 ( 3.0A)
FLC  A 505 ( 2.7A)
FLC  A 505 (-4.2A)
 0.93A 2uy4A-4tx8A:
23.8		 2uy4A-4tx8A:
23.39
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.
2UY4_A_AZMA1311_1
(ENDOCHITINASE)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		5 / 9 TYR A  88
PHE A 116
GLY A 159
TYR A 270
TRP A 374
 None
FLC  A 506 (-4.4A)
FLC  A 506 (-3.3A)
FLC  A 505 (-4.2A)
FLC  A 505 (-3.0A)
 0.70A 2uy4A-4tx8A:
23.8		 2uy4A-4tx8A:
23.39
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.
2W9S_C_TOPC1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 3ikb UNCHARACTERIZED
CONSERVED PROTEIN
(Streptococcus
mutans) 		5 / 10 ILE A  83
ILE A 112
ILE A  11
PHE A  87
TYR A  54
 None
None
None
None
FLC  A 196 (-4.2A)
 1.15A 2w9sC-3ikbA:
undetectable		 2w9sC-3ikbA:
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.
2WGJ_A_VGHA2346_1
(HEPATOCYTE GROWTH
FACTOR RECEPTOR)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		7 / 12 GLY A 215
VAL A 222
ALA A 233
LEU A 263
TYR A 285
GLY A 289
ALA A 353
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 ( 4.6A)
TAK  A1507 (-3.5A)
TAK  A1507 ( 4.2A)
 0.77A 2wgjA-4c02A:
24.7		 2wgjA-4c02A:
26.48
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.
2XNR_A_ACTA1001_0
(NUCLEAR
POLYADENYLATED
RNA-BINDING PROTEIN
3)		 4g9s INHIBITOR OF G-TYPE
LYSOZYME
(Escherichia
coli) 		3 / 3 SER B  37
ARG B  32
GLN B  39
 FLC  B 201 (-2.7A)
None
None
 0.83A 2xnrA-4g9sB:
undetectable		 2xnrA-4g9sB:
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.
2XTK_A_AZMA1339_1
(CLASS III CHITINASE
CHIA1)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		8 / 11 TYR A  88
PHE A 116
ASP A 194
GLN A 268
TYR A 270
ASN A 271
ALA A 333
TRP A 374
 None
FLC  A 506 (-4.4A)
FLC  A 506 ( 3.0A)
FLC  A 505 ( 2.7A)
FLC  A 505 (-4.2A)
FLC  A 504 ( 4.3A)
None
FLC  A 505 (-3.0A)
 0.50A 2xtkA-4tx8A:
24.5		 2xtkA-4tx8A:
22.32
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.
2XTK_A_AZMA1339_1
(CLASS III CHITINASE
CHIA1)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		6 / 11 TYR A  88
PHE A 116
GLY A 158
ASP A 194
GLN A 268
TYR A 270
 None
FLC  A 506 (-4.4A)
FLC  A 506 (-3.0A)
FLC  A 506 ( 3.0A)
FLC  A 505 ( 2.7A)
FLC  A 505 (-4.2A)
 0.96A 2xtkA-4tx8A:
24.5		 2xtkA-4tx8A:
22.32
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.
2XTK_A_AZMA1339_1
(CLASS III CHITINASE
CHIA1)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		8 / 11 TYR A  88
PHE A 116
GLY A 159
GLN A 268
TYR A 270
ASN A 271
ALA A 333
TRP A 374
 None
FLC  A 506 (-4.4A)
FLC  A 506 (-3.3A)
FLC  A 505 ( 2.7A)
FLC  A 505 (-4.2A)
FLC  A 504 ( 4.3A)
None
FLC  A 505 (-3.0A)
 0.69A 2xtkA-4tx8A:
24.5		 2xtkA-4tx8A:
22.32
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.
2XTK_B_AZMB1339_1
(CLASS III CHITINASE
CHIA1)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		6 / 10 TYR A  88
PHE A 116
ASP A 194
GLN A 268
TYR A 270
TRP A 374
 None
FLC  A 506 (-4.4A)
FLC  A 506 ( 3.0A)
FLC  A 505 ( 2.7A)
FLC  A 505 (-4.2A)
FLC  A 505 (-3.0A)
 0.44A 2xtkB-4tx8A:
24.4		 2xtkB-4tx8A:
22.32
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.
2XTK_B_AZMB1339_1
(CLASS III CHITINASE
CHIA1)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		5 / 10 TYR A  88
PHE A 116
GLY A 158
ASP A 194
GLN A 268
 None
FLC  A 506 (-4.4A)
FLC  A 506 (-3.0A)
FLC  A 506 ( 3.0A)
FLC  A 505 ( 2.7A)
 1.05A 2xtkB-4tx8A:
24.4		 2xtkB-4tx8A:
22.32
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.
2XTK_B_AZMB1339_1
(CLASS III CHITINASE
CHIA1)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		5 / 10 TYR A  88
PHE A 116
GLY A 159
TYR A 270
TRP A 374
 None
FLC  A 506 (-4.4A)
FLC  A 506 (-3.3A)
FLC  A 505 (-4.2A)
FLC  A 505 (-3.0A)
 0.81A 2xtkB-4tx8A:
24.4		 2xtkB-4tx8A:
22.32
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.
2XXG_A_CUA1338_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		3 / 3 ASP A 257
HIS A 290
HIS A 231
 FLC  A 501 (-3.8A)
FLC  A 501 (-3.8A)
FLC  A 501 (-3.9A)
 0.70A 2xxgA-5jpeA:
undetectable		 2xxgA-5jpeA:
22.85
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.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		3 / 3 ASP A 257
HIS A 290
HIS A 231
 FLC  A 501 (-3.8A)
FLC  A 501 (-3.8A)
FLC  A 501 (-3.9A)
 0.71A 2xxgC-5jpeA:
undetectable		 2xxgC-5jpeA:
22.85
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.
2Y7H_B_SAMB530_1
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		3 / 3 TYR A 292
GLU A 413
THR A 378
 None
None
FLC  A1504 ( 3.9A)
 1.04A 2y7hB-4c02A:
undetectable		 2y7hB-4c02A:
21.98
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.
2Y7W_B_SALB1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		5 / 10 GLY A 346
PHE A 237
HIS A 159
THR A 361
ILE A 158
 None
None
ZN  A 508 ( 3.2A)
FLC  A 509 ( 4.6A)
None
 1.12A 2y7wB-5hvfA:
undetectable		 2y7wB-5hvfA:
19.20
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.
2YFB_B_ACTB501_0
(METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER)		 2d4v ISOCITRATE
DEHYDROGENASE
(Acidithiobacillu
s
thiooxidans) 		4 / 6 ASP A 324
VAL A 131
ARG A 129
ILE A 151
 None
None
FLC  A3001 (-3.4A)
None
 1.13A 2yfbB-2d4vA:
undetectable		 2yfbB-2d4vA:
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.
2ZBP_A_SAMA300_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		5 / 12 GLY A 403
GLY A 189
GLY A 184
LEU A 216
ASN A 186
 FLC  A 501 ( 3.8A)
None
None
None
FLC  A 501 (-3.7A)
 1.07A 2zbpA-5x9rA:
undetectable		 2zbpA-5x9rA:
22.62
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.
2ZZN_B_SAMB402_0
(UNCHARACTERIZED
PROTEIN MJ0883)		 4uzy FLAGELLAR ASSOCIATED
PROTEIN
(Chlamydomonas
reinhardtii) 		5 / 12 PHE A 367
LEU A 349
GLY A 417
ILE A 424
ASP A 427
 None
FLC  A1647 (-3.9A)
None
None
None
 1.29A 2zznB-4uzyA:
undetectable		 2zznB-4uzyA:
18.95
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.
3B3M_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 3b3mA-4lmvA:
undetectable
3b3mB-4lmvA:
undetectable		 3b3mA-4lmvA:
21.00
3b3mB-4lmvA:
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.
3B3M_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 3b3mA-4lmvA:
undetectable
3b3mB-4lmvA:
undetectable		 3b3mA-4lmvA:
21.00
3b3mB-4lmvA:
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.
3B3P_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 8 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 3b3pA-4lmvA:
undetectable
3b3pB-4lmvA:
undetectable		 3b3pA-4lmvA:
21.00
3b3pB-4lmvA:
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.
3DD0_A_EZLA301_1
(CARBONIC ANHYDRASE 2)		 3n9t PNPC
(Pseudomonas
putida) 		5 / 10 HIS A 220
HIS A 218
HIS A 234
VAL A 104
PRO A 197
 FE  A 292 ( 3.1A)
FE  A 292 ( 3.2A)
None
None
FLC  A 293 (-4.6A)
 1.25A 3dd0A-3n9tA:
undetectable		 3dd0A-3n9tA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKY_A_DR7A100_1
(PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 10 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 0.99A 3ekyA-4x84A:
undetectable		 3ekyA-4x84A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EL1_A_DR7A100_1
(PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 11 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 1.00A 3el1A-4x84A:
undetectable		 3el1A-4x84A:
19.05
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.
3FC5_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.13A 3fc5A-4lmvA:
undetectable
3fc5B-4lmvA:
undetectable		 3fc5A-4lmvA:
20.33
3fc5B-4lmvA:
20.33
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.
3FC5_B_H4BB761_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 3fc5A-4lmvA:
undetectable
3fc5B-4lmvA:
undetectable		 3fc5A-4lmvA:
20.33
3fc5B-4lmvA:
20.33
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.
3HCN_B_CHDB2_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		3 / 3 LEU B  65
LEU B  39
ARG B  97
 None
None
FLC  B 292 (-2.8A)
 0.63A 3hcnB-3d6nB:
2.3		 3hcnB-3d6nB:
22.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3HGI_A_BEZA284_0
(CATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		7 / 12 GLY A 106
PRO A 107
TYR A 160
TYR A 194
ARG A 215
HIS A 218
HIS A 220
 FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FE  A 292 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
 0.34A 3hgiA-3n9tA:
27.9		 3hgiA-3n9tA:
31.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3HGI_A_BEZA284_0
(CATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		6 / 12 GLY A 106
PRO A 107
TYR A 194
ARG A 215
HIS A 218
HIS A 234
 FLC  A 293 ( 4.3A)
FLC  A 293 (-3.5A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
None
 1.39A 3hgiA-3n9tA:
27.9		 3hgiA-3n9tA:
31.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3HGI_A_BEZA284_0
(CATECHOL
1,2-DIOXYGENASE)		 3n9t PNPC
(Pseudomonas
putida) 		6 / 12 LEU A  77
GLY A 106
TYR A 194
ARG A 215
HIS A 218
HIS A 220
 FLC  A 293 (-4.4A)
FLC  A 293 ( 4.3A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FE  A 292 ( 3.2A)
FE  A 292 ( 3.1A)
 0.89A 3hgiA-3n9tA:
27.9		 3hgiA-3n9tA:
31.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HLW_B_CE3B302_1
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 149
LYS A 239
THR A 240
GLY A 241
SER A 242
GLY A 243
 FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
FLC  A 301 (-2.8A)
None
 0.69A 3hlwB-5ctmA:
18.9		 3hlwB-5ctmA:
22.76
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.
3HSN_B_H4BB1760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 3hsnA-4lmvA:
undetectable
3hsnB-4lmvA:
undetectable		 3hsnA-4lmvA:
21.00
3hsnB-4lmvA:
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.
3HSO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 3hsoA-4lmvA:
undetectable
3hsoB-4lmvA:
undetectable		 3hsoA-4lmvA:
21.00
3hsoB-4lmvA:
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.
3HSP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 3hspA-4lmvA:
undetectable
3hspB-4lmvA:
undetectable		 3hspA-4lmvA:
21.00
3hspB-4lmvA:
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.
3IJD_B_C2FB314_1
(UNCHARACTERIZED
PROTEIN)		 3b4y PROBABLE
F420-DEPENDENT
GLUCOSE-6-PHOSPHATE
DEHYDROGENASE FGD1
(Mycobacterium
tuberculosis) 		3 / 3 THR A 204
LYS A 259
GLU A 201
 None
FLC  A 337 (-2.8A)
None
 0.81A 3ijdB-3b4yA:
14.0		 3ijdB-3b4yA:
20.10
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.
3JT6_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 3jt6A-4lmvA:
undetectable
3jt6B-4lmvA:
undetectable		 3jt6A-4lmvA:
21.00
3jt6B-4lmvA:
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.
3JWT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 3jwtA-4lmvA:
undetectable
3jwtB-4lmvA:
undetectable		 3jwtA-4lmvA:
20.76
3jwtB-4lmvA:
20.76
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.
3JX0_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 3jx0A-4lmvA:
undetectable
3jx0B-4lmvA:
undetectable		 3jx0A-4lmvA:
21.00
3jx0B-4lmvA:
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.
3JX1_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 8 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.15A 3jx1A-4lmvA:
undetectable
3jx1B-4lmvA:
undetectable		 3jx1A-4lmvA:
21.00
3jx1B-4lmvA:
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.
3JX3_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 3jx3A-4lmvA:
undetectable
3jx3B-4lmvA:
undetectable		 3jx3A-4lmvA:
21.00
3jx3B-4lmvA:
21.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_1
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)		 4qsz MALTOSE-BINDING
PERIPLASMIC PROTEIN,
JMJC
DOMAIN-CONTAINING
PROTEIN 7 CHIMERA
(Escherichia
coli;
Mus
musculus) 		12 / 12 ASP A-357
LYS A-356
LYS A-329
GLU A-327
GLU A-326
ALA A-308
ASP A-306
ARG A-305
GLU A-260
PRO A-217
TRP A-141
TYR A -30
 GLC  A 901 (-2.9A)
GLC  A 901 (-3.0A)
None
FLC  A 903 (-3.9A)
FLC  A 903 (-3.5A)
GLC  A 902 (-3.1A)
GLC  A 902 (-2.9A)
FLC  A 903 (-3.9A)
GLC  A 901 (-3.1A)
GLC  A 902 ( 3.7A)
GLC  A 901 (-4.0A)
FLC  A 903 (-3.9A)
 0.39A 3jyrA-4qszA:
60.3		 3jyrA-4qszA:
50.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_2
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)		 4qsz MALTOSE-BINDING
PERIPLASMIC PROTEIN,
JMJC
DOMAIN-CONTAINING
PROTEIN 7 CHIMERA
(Escherichia
coli;
Mus
musculus) 		6 / 7 ASN A-359
TRP A-309
GLU A-218
TYR A-216
MET A -41
TRP A -31
 GLC  A 901 (-4.7A)
GLC  A 902 (-3.9A)
FLC  A 903 (-3.0A)
GLC  A 901 ( 3.8A)
GLC  A 902 ( 4.1A)
GLC  A 902 ( 3.6A)
 0.19A 3jyrA-4qszA:
60.3		 3jyrA-4qszA:
50.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_2
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)		 4qsz MALTOSE-BINDING
PERIPLASMIC PROTEIN,
JMJC
DOMAIN-CONTAINING
PROTEIN 7 CHIMERA
(Escherichia
coli;
Mus
musculus) 		5 / 7 GLU A-218
TYR A-216
MET A -41
TRP A -31
ARG A -27
 FLC  A 903 (-3.0A)
GLC  A 901 ( 3.8A)
GLC  A 902 ( 4.1A)
GLC  A 902 ( 3.6A)
FLC  A 903 (-2.9A)
 0.90A 3jyrA-4qszA:
60.3		 3jyrA-4qszA:
50.95
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.
3JZJ_A_ACRA405_1
(ACARBOSE/MALTOSE
BINDING PROTEIN GACH)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		5 / 12 GLU A 262
GLY A 180
ALA A  74
ASP A 568
ARG A 580
 None
None
FLC  A 756 ( 3.8A)
FLC  A 756 ( 4.7A)
FLC  A 756 (-3.3A)
 1.28A 3jzjA-1b0kA:
0.0		 3jzjA-1b0kA:
20.48
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.
3K8M_A_ACRA720_1
(ALPHA-AMYLASE, SUSG)		 4r9i SERPIN-18
(Bombyx
mori) 		4 / 7 GLU A 287
LEU A 239
LYS A 272
ASN A 238
 FLC  A 402 (-3.8A)
None
None
None
 1.26A 3k8mA-4r9iA:
undetectable		 3k8mA-4r9iA:
20.62
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.
3K8M_B_ACRB820_1
(ALPHA-AMYLASE, SUSG)		 4r9i SERPIN-18
(Bombyx
mori) 		4 / 7 GLU A 287
LEU A 239
LYS A 272
ASN A 238
 FLC  A 402 (-3.8A)
None
None
None
 1.31A 3k8mB-4r9iA:
undetectable		 3k8mB-4r9iA:
20.62
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.
3K9F_F_LFXF0_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 5 ARG A 235
ARG A 302
GLY A 336
GLU A 338
 FLC  A 509 (-2.8A)
None
None
None
 1.17A 3k9fA-5hvfA:
3.5
3k9fB-5hvfA:
3.5
3k9fC-5hvfA:
3.1		 3k9fA-5hvfA:
21.43
3k9fB-5hvfA:
21.43
3k9fC-5hvfA:
20.10
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.
3KEC_A_HAEA272_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.29A 3kecA-4a3wA:
7.6		 3kecA-4a3wA:
21.05
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.
3KP3_B_AICB2002_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 5ltg AUTOPHAGY-RELATED
PROTEIN 18
(Ogataea
angusta) 		3 / 3 ALA A 240
ARG A 248
LYS A 257
 None
FLC  A 602 (-3.2A)
None
 1.04A 3kp3B-5ltgA:
undetectable		 3kp3B-5ltgA:
17.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3KVR_A_URFA2001_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 THR A 124
PHE A 197
ARG A 203
GLU A 232
MET A 233
 FLC  A 301 (-3.7A)
None
None
None
None
 0.38A 3kvrA-5cyfA:
41.2		 3kvrA-5cyfA:
38.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3KVR_B_URFB2011_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 THR A 124
PHE A 197
ARG A 203
GLU A 232
MET A 233
 FLC  A 301 (-3.7A)
None
None
None
None
 0.41A 3kvrB-5cyfA:
41.1		 3kvrB-5cyfA:
38.71
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.
3L8L_C_DVAC6_0
(GRAMICIDIN D)		 4bj4 AMPDH2
(Pseudomonas
aeruginosa) 		3 / 3 ALA A  87
VAL A  89
TRP A  97
 None
None
FLC  A1260 (-4.9A)
 0.81A 3l8lC-4bj4A:
undetectable
3l8lD-4bj4A:
undetectable		 3l8lC-4bj4A:
7.48
3l8lD-4bj4A:
8.16
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.
3LIK_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.31A 3likA-4a3wA:
8.1		 3likA-4a3wA:
26.55
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.
3LIL_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.27A 3lilA-4a3wA:
8.1		 3lilA-4a3wA:
26.55
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.
3LJG_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.30A 3ljgA-4a3wA:
8.2		 3ljgA-4a3wA:
26.55
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.
3LKA_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.32A 3lkaA-4a3wA:
8.1		 3lkaA-4a3wA:
26.14
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.
3LZS_A_017A200_2
(HIV-1 PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 0.96A 3lzsB-4x84A:
undetectable		 3lzsB-4x84A:
19.05
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.
3LZU_A_017A200_1
(HIV-1 PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 0.95A 3lzuA-4x84A:
undetectable		 3lzuA-4x84A:
19.05
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.
3NLP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.15A 3nlpA-4lmvA:
undetectable
3nlpB-4lmvA:
undetectable		 3nlpA-4lmvA:
21.00
3nlpB-4lmvA:
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.
3NLR_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.08A 3nlrA-4lmvA:
undetectable
3nlrB-4lmvA:
undetectable		 3nlrA-4lmvA:
21.00
3nlrB-4lmvA:
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.
3NLY_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 8 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 3nlyA-4lmvA:
undetectable
3nlyB-4lmvA:
undetectable		 3nlyA-4lmvA:
21.00
3nlyB-4lmvA:
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.
3NLZ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 3nlzA-4lmvA:
undetectable
3nlzB-4lmvA:
undetectable		 3nlzA-4lmvA:
21.00
3nlzB-4lmvA:
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.
3NU5_B_478B401_2
(PROTEASE)		 6eoe 78 KDA
GLUCOSE-REGULATED
PROTEIN
(Cricetulus
griseus) 		5 / 12 GLY A 397
ALA A 398
GLY A 403
VAL A 404
ILE A 199
 None
None
None
FLC  A 601 (-4.7A)
None
 1.14A 3nu5B-6eoeA:
undetectable		 3nu5B-6eoeA:
12.09
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.
3NY4_A_SMXA308_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.45A 3ny4A-5ctmA:
17.9		 3ny4A-5ctmA:
22.06
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.
3O7W_A_SAMA801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 1)		 3wi5 MAJOR OUTER MEMBRANE
PROTEIN P.IB
(Neisseria
meningitidis) 		3 / 3 LYS A  99
ARG A 125
ASP A 108
 FLC  A 401 (-3.4A)
FLC  A 401 (-3.7A)
None
 1.00A 3o7wA-3wi5A:
undetectable		 3o7wA-3wi5A:
23.58
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.
3O9M_B_BEZB999_0
(CHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		4 / 6 GLY A  42
GLY A  43
SER A 111
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
FLC  A 402 (-3.7A)
 0.81A 3o9mB-5yhpA:
12.8		 3o9mB-5yhpA:
21.35
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.
3OG7_A_032A1_1
(AKAP9-BRAF FUSION
PROTEIN)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
GLY A 356
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
None
 0.73A 3og7A-4c02A:
25.0		 3og7A-4c02A:
28.74
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.
3OG7_A_032A1_1
(AKAP9-BRAF FUSION
PROTEIN)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.32A 3og7A-4c02A:
25.0		 3og7A-4c02A:
28.74
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.
3PHN_A_ACTA108_0
(PROTEIN P-30)		 3b4y PROBABLE
F420-DEPENDENT
GLUCOSE-6-PHOSPHATE
DEHYDROGENASE FGD1
(Mycobacterium
tuberculosis) 		3 / 3 THR A 195
SER A 196
ARG A 283
 FLC  A 337 ( 3.4A)
None
FLC  A 337 (-2.8A)
 0.75A 3phnA-3b4yA:
undetectable		 3phnA-3b4yA:
13.54
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.
3PNG_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 3pngA-4lmvA:
undetectable
3pngB-4lmvA:
undetectable		 3pngA-4lmvA:
21.00
3pngB-4lmvA:
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.
3Q07_B_WPPB400_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		5 / 12 SER A 149
LYS A 239
GLY A 241
SER A 242
GLY A 243
 FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.2A)
FLC  A 301 (-2.8A)
None
 0.63A 3q07B-5ctmA:
18.6		 3q07B-5ctmA:
22.76
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.
3Q9A_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.16A 3q9aA-4lmvA:
undetectable
3q9aB-4lmvA:
undetectable		 3q9aA-4lmvA:
21.00
3q9aB-4lmvA:
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.
3S56_A_ROCA201_2
(PROTEASE)		 5wxu 11S GLOBULIN
(Wrightia
tinctoria) 		5 / 9 LEU A 162
GLY A 111
ILE A 112
ILE A 295
ILE A 160
 None
None
None
FLC  A 503 (-3.9A)
None
 1.11A 3s56B-5wxuA:
undetectable		 3s56B-5wxuA:
20.62
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.
3T3R_A_9PLA501_1
(CYTOCHROME P450 2A6)		 2whd THIOREDOXIN
REDUCTASE
(Hordeum
vulgare) 		5 / 11 VAL A 216
PHE A 131
ILE A 253
GLY A 164
LEU A 249
 None
None
FLC  A 401 (-4.2A)
FLC  A 401 ( 4.0A)
None
 1.13A 3t3rA-2whdA:
undetectable		 3t3rA-2whdA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_A_ACTA604_0
(GBAA_1210 PROTEIN)		 2bp1 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Homo
sapiens) 		4 / 6 TYR A 226
GLY A 199
HIS A 142
SER A 172
 NDP  A1361 (-3.3A)
None
FLC  A1362 ( 3.9A)
NDP  A1361 (-2.7A)
 1.09A 3tj7A-2bp1A:
undetectable
3tj7B-2bp1A:
undetectable		 3tj7A-2bp1A:
18.33
3tj7B-2bp1A:
18.33
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.
3TJ7_A_ACTA609_0
(GBAA_1210 PROTEIN)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		3 / 3 LYS A 108
VAL A 105
HIS A 104
 FLC  A 203 (-2.8A)
None
FE  A 201 ( 3.4A)
 1.14A 3tj7A-4n6wA:
undetectable		 3tj7A-4n6wA:
23.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_C_ACTC606_0
(GBAA_1210 PROTEIN)		 2bp1 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Homo
sapiens) 		4 / 6 TYR A 226
GLY A 199
HIS A 142
SER A 172
 NDP  A1361 (-3.3A)
None
FLC  A1362 ( 3.9A)
NDP  A1361 (-2.7A)
 1.09A 3tj7C-2bp1A:
undetectable
3tj7D-2bp1A:
undetectable		 3tj7C-2bp1A:
18.33
3tj7D-2bp1A:
18.33
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.
3TJ7_D_ACTD605_0
(GBAA_1210 PROTEIN)		 2bp1 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Homo
sapiens) 		4 / 6 HIS A 142
SER A 172
TYR A 226
GLY A 199
 FLC  A1362 ( 3.9A)
NDP  A1361 (-2.7A)
NDP  A1361 (-3.3A)
None
 1.12A 3tj7C-2bp1A:
undetectable
3tj7D-2bp1A:
undetectable		 3tj7C-2bp1A:
18.33
3tj7D-2bp1A:
18.33
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.
3TYM_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 3tymA-4lmvA:
undetectable
3tymB-4lmvA:
undetectable		 3tymA-4lmvA:
21.00
3tymB-4lmvA:
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.
3UAW_A_ADNA236_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.35A 3uawA-5cyfA:
23.5		 3uawA-5cyfA:
24.92
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.
3UAY_A_ADNA236_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.30A 3uayA-5cyfA:
23.9		 3uayA-5cyfA:
25.25
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.
3UFU_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 3ufuA-4lmvA:
undetectable
3ufuB-4lmvA:
undetectable		 3ufuA-4lmvA:
21.00
3ufuB-4lmvA:
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.
3UFV_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 3ufvA-4lmvA:
undetectable
3ufvB-4lmvA:
undetectable		 3ufvA-4lmvA:
21.00
3ufvB-4lmvA:
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.
3UNC_A_SALA1338_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		5 / 9 LEU B  39
ARG B  97
PHE B  41
THR B  48
LEU B  50
 None
FLC  B 292 (-2.8A)
None
FLC  B 292 (-4.1A)
None
 1.40A 3uncA-3d6nB:
undetectable		 3uncA-3d6nB:
12.54
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.
3UNC_B_SALB1338_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		5 / 9 LEU B  39
ARG B  97
PHE B  41
THR B  48
LEU B  50
 None
FLC  B 292 (-2.8A)
None
FLC  B 292 (-4.1A)
None
 1.40A 3uncB-3d6nB:
undetectable		 3uncB-3d6nB:
12.54
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.
3UQ6_B_ADNB401_1
(ADENOSINE KINASE,
PUTATIVE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		5 / 12 ASP A 229
LEU A 428
ASN A 289
THR A 430
GLY A 288
 FLC  A 501 (-3.1A)
None
FLC  A 501 (-3.1A)
None
None
 1.10A 3uq6B-5jpeA:
undetectable		 3uq6B-5jpeA:
22.50
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.
3V4T_D_ACTD502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1
(Saccharomyces
cerevisiae) 		3 / 3 GLY A 262
THR A 265
ASN A 186
 None
None
FLC  A 502 (-2.6A)
 0.68A 3v4tD-2p4qA:
1.3		 3v4tD-2p4qA:
22.50
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.
3VAQ_B_ADNB401_1
(PUTATIVE ADENOSINE
KINASE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		5 / 12 ASP A 229
LEU A 428
ASN A 289
THR A 430
GLY A 288
 FLC  A 501 (-3.1A)
None
FLC  A 501 (-3.1A)
None
None
 1.12A 3vaqB-5jpeA:
undetectable		 3vaqB-5jpeA:
22.50
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.
3VYW_C_SAMC401_1
(MNMC2)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 6 GLY A 641
GLU A 640
ASP A 568
ASN A 448
 None
None
FLC  A 756 ( 4.7A)
None
 0.91A 3vywC-1b0kA:
undetectable		 3vywC-1b0kA:
18.64
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.
3ZS3_A_ACTA1224_0
(THAUMATIN-LIKE
PROTEIN)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		4 / 5 SER A  57
GLU A 107
THR A  60
ASP A  85
 None
FLC  A 300 ( 4.1A)
None
None
 1.17A 3zs3A-4x84A:
undetectable		 3zs3A-4x84A:
22.52
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.
4A3U_A_ACTA1358_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 4iis BETA-1,3-GLUCANASE
FORM 'RRII GLN 2'
(Hevea
brasiliensis) 		5 / 9 ALA A 134
ARG A  32
GLY A  54
VAL A  55
ASN A  93
 None
None
None
None
FLC  A 402 (-4.5A)
 0.99A 4a3uA-4iisA:
5.7		 4a3uA-4iisA:
20.32
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.
4A7B_A_HAEA1273_1
(COLLAGENASE 3)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 6 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.40A 4a7bA-4a3wA:
7.4		 4a7bA-4a3wA:
20.57
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.
4AN2_A_EUIA1382_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 LEU A 281
ASP A 336
LYS A 338
ASN A 341
ASP A 354
GLY A 356
 None
None
FLC  A1504 (-2.8A)
None
TAK  A1507 (-3.5A)
None
 1.33A 4an2A-4c02A:
22.5		 4an2A-4c02A:
26.18
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.
4AN2_A_EUIA1382_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 LYS A 235
ASP A 336
LYS A 338
ASN A 341
ASP A 354
 TAK  A1507 ( 4.5A)
None
FLC  A1504 (-2.8A)
None
TAK  A1507 (-3.5A)
 0.65A 4an2A-4c02A:
22.5		 4an2A-4c02A:
26.18
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.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 12 HIS A 260
GLY A 323
HIS A 232
PRO A 156
HIS A 180
 None
FLC  A 424 (-3.2A)
FLC  A 424 (-4.8A)
None
FLC  A 424 (-4.0A)
 1.21A 4bz6C-3d6nA:
undetectable		 4bz6C-3d6nA:
22.65
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.
4C1F_A_X8ZA300_1
(BETA-LACTAMASE IMP-1)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 11 HIS A 180
ASP A 153
HIS A 232
ASN A 278
HIS A  63
 FLC  A 424 (-4.0A)
ZN  A 423 ( 2.4A)
FLC  A 424 (-4.8A)
FLC  A 424 (-4.8A)
ZN  A 423 ( 3.4A)
 1.27A 4c1fA-3d6nA:
undetectable
4c1fB-3d6nA:
undetectable		 4c1fA-3d6nA:
21.84
4c1fB-3d6nA:
21.84
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.
4C8B_A_0LIA1000_1
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		7 / 12 ALA A 233
LYS A 235
LEU A 263
THR A 283
HIS A 334
LEU A 343
ALA A 353
 TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
TAK  A1507 (-4.7A)
TAK  A1507 ( 4.2A)
 0.52A 4c8bA-4c02A:
24.2		 4c8bA-4c02A:
27.91
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.
4C8B_B_0LIB1000_1
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		8 / 12 ALA A 233
LYS A 235
ILE A 262
LEU A 263
THR A 283
HIS A 334
LEU A 343
ALA A 353
 TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
None
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
TAK  A1507 (-4.7A)
TAK  A1507 ( 4.2A)
 0.69A 4c8bB-4c02A:
24.2		 4c8bB-4c02A:
27.91
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.
4CAN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.08A 4canA-4lmvA:
undetectable
4canB-4lmvA:
undetectable		 4canA-4lmvA:
21.00
4canB-4lmvA:
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.
4CAP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 4capA-4lmvA:
undetectable
4capB-4lmvA:
undetectable		 4capA-4lmvA:
21.00
4capB-4lmvA:
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.
4CTR_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.06A 4ctrA-4lmvA:
undetectable
4ctrB-4lmvA:
undetectable		 4ctrA-4lmvA:
21.00
4ctrB-4lmvA:
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.
4CTU_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 4ctuA-4lmvA:
undetectable
4ctuB-4lmvA:
undetectable		 4ctuA-4lmvA:
21.00
4ctuB-4lmvA:
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.
4CTW_A_H4BA1718_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 4ctwA-4lmvA:
undetectable
4ctwB-4lmvA:
undetectable		 4ctwA-4lmvA:
21.00
4ctwB-4lmvA:
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.
4D1N_C_H4BC760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.15A 4d1nC-4lmvA:
undetectable
4d1nD-4lmvA:
undetectable		 4d1nC-4lmvA:
21.09
4d1nD-4lmvA:
21.09
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.
4D2Y_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 4d2yA-4lmvA:
undetectable
4d2yB-4lmvA:
undetectable		 4d2yA-4lmvA:
21.00
4d2yB-4lmvA:
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.
4D2Y_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 4d2yA-4lmvA:
undetectable
4d2yB-4lmvA:
undetectable		 4d2yA-4lmvA:
21.00
4d2yB-4lmvA:
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.
4D30_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 4d30A-4lmvA:
undetectable
4d30B-4lmvA:
undetectable		 4d30A-4lmvA:
21.00
4d30B-4lmvA:
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.
4D3B_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 4d3bA-4lmvA:
undetectable
4d3bB-4lmvA:
undetectable		 4d3bA-4lmvA:
21.00
4d3bB-4lmvA:
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.
4D9H_A_ADNA301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
GLU A 232
MET A 233
GLU A 234
VAL A 257
 FLC  A 301 (-3.0A)
None
None
FLC  A 301 (-2.8A)
None
 0.90A 4d9hA-5cyfA:
24.4		 4d9hA-5cyfA:
26.32
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.
4DA7_A_AC2A301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 10 ARG A 121
ALA A 194
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
None
None
None
FLC  A 301 (-2.8A)
 0.36A 4da7A-5cyfA:
24.3		 4da7A-5cyfA:
26.32
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.
4DAN_A_2FAA301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 11 ARG A 121
GLU A 232
MET A 233
GLU A 234
VAL A 257
 FLC  A 301 (-3.0A)
None
None
FLC  A 301 (-2.8A)
None
 0.95A 4danA-5cyfA:
23.9		 4danA-5cyfA:
26.32
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.
4DAN_B_2FAB301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		5 / 12 ARG A 121
GLU A 232
MET A 233
GLU A 234
VAL A 257
 FLC  A 301 (-3.0A)
None
None
FLC  A 301 (-2.8A)
None
 0.95A 4danA-5cyfA:
23.9
4danB-5cyfA:
23.8		 4danA-5cyfA:
26.32
4danB-5cyfA:
26.32
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)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		5 / 12 ARG A 644
GLY A 641
ALA A 642
SER A 166
GLY A 180
 FLC  A 756 (-4.3A)
None
FLC  A 756 (-3.0A)
FLC  A 756 (-2.6A)
None
 0.91A 4e1gB-1b0kA:
0.0		 4e1gB-1b0kA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E1V_A_URFA1301_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.43A 4e1vA-5cyfA:
25.1		 4e1vA-5cyfA:
26.26
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.
4E1V_C_URFC1301_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.46A 4e1vC-5cyfA:
24.7		 4e1vC-5cyfA:
26.26
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.
4E1V_D_URFD1301_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.50A 4e1vD-5cyfA:
24.8		 4e1vD-5cyfA:
26.26
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.
4E1V_E_URFE1301_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.46A 4e1vE-5cyfA:
25.3		 4e1vE-5cyfA:
26.26
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.
4E1V_G_URFG1301_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.56A 4e1vG-5cyfA:
24.1		 4e1vG-5cyfA:
26.26
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.
4E1V_H_URFH1301_1
(URIDINE
PHOSPHORYLASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 8 THR A 124
ARG A 203
MET A 233
VAL A 257
 FLC  A 301 (-3.7A)
None
None
None
 0.52A 4e1vH-5cyfA:
24.8		 4e1vH-5cyfA:
26.26
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.
4EOH_A_TEPA402_1
(PYRIDOXAL KINASE)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		4 / 5 SER A 123
THR A 129
VAL A 105
ASP A 161
 FLC  A 203 ( 4.5A)
FLC  A 203 (-3.2A)
None
FE  A 202 ( 2.5A)
 0.96A 4eohA-4n6wA:
undetectable		 4eohA-4n6wA:
21.57
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.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 12 GLY A  42
GLY A  43
SER A 111
PHE A 236
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
None
FLC  A 402 (-3.7A)
 0.86A 4ey6A-5yhpA:
13.0		 4ey6A-5yhpA:
20.63
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.
4EY6_B_GNTB605_1
(ACETYLCHOLINESTERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 12 GLY A  42
GLY A  43
SER A 111
PHE A 236
HIS A 297
 FLC  A 402 ( 3.8A)
FLC  A 402 (-3.4A)
FLC  A 402 (-2.5A)
None
FLC  A 402 (-3.7A)
 0.86A 4ey6B-5yhpA:
11.3		 4ey6B-5yhpA:
20.63
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.
4FVZ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.15A 4fvzA-4lmvA:
undetectable
4fvzB-4lmvA:
undetectable		 4fvzA-4lmvA:
21.00
4fvzB-4lmvA:
21.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4G19_B_ACTB301_0
(GLUTATHIONE
TRANSFERASE GTE1)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 5 ASN A  24
TYR A  46
TRP A 122
ARG A 154
 None
FLC  A 300 (-3.7A)
None
FLC  A 300 (-3.1A)
 0.88A 4g19B-4lmvA:
40.7		 4g19B-4lmvA:
73.91
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.
4H9M_A_HAEA929_1
(UREASE)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		4 / 5 HIS A  61
HIS A 180
HIS A 232
ASP A 305
 ZN  A 423 (-3.5A)
FLC  A 424 (-4.0A)
FLC  A 424 (-4.8A)
FLC  A 424 ( 2.7A)
 0.45A 4h9mA-3d6nA:
24.3		 4h9mA-3d6nA:
20.50
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.
4H9M_A_HAEA929_1
(UREASE)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		5 / 5 HIS A  58
HIS A  62
HIS A  80
HIS A 104
ASP A 161
 FE  A 202 (-3.3A)
FLC  A 203 (-4.0A)
FE  A 201 ( 3.4A)
FE  A 201 ( 3.4A)
FE  A 202 ( 2.5A)
 0.93A 4h9mA-4n6wA:
undetectable		 4h9mA-4n6wA:
14.20
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.
4HDL_A_DXCA75_0
(PPCA)		 4a1f REPLICATIVE DNA
HELICASE
(Helicobacter
pylori) 		4 / 8 ILE A 384
LYS A 209
ILE A 440
PHE A 387
 None
FLC  A1474 (-3.2A)
None
None
 0.91A 4hdlA-4a1fA:
undetectable		 4hdlA-4a1fA:
11.18
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.
4I13_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Streptococcus
pneumoniae) 		3 / 3 ASP A 326
ARG A  92
THR A 297
 None
FLC  A1419 ( 4.0A)
None
 0.74A 4i13A-3zh4A:
undetectable		 4i13A-3zh4A:
15.99
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.
4IB4_A_ERMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 4blp PACKAGING ENZYME P4
(Pseudomonas
phage
phi13) 		5 / 12 VAL A 282
VAL A 277
ALA A 157
LEU A 218
VAL A 219
 None
None
FLC  A1304 ( 4.0A)
None
None
 1.25A 4ib4A-4blpA:
undetectable		 4ib4A-4blpA:
22.57
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.
4J4V_C_SVRC301_1
(NUCLEOCAPSID PROTEIN)		 3b4y PROBABLE
F420-DEPENDENT
GLUCOSE-6-PHOSPHATE
DEHYDROGENASE FGD1
(Mycobacterium
tuberculosis) 		4 / 8 GLY A 177
ARG A 283
MET A 208
PHE A 192
 F42  A 338 (-3.4A)
FLC  A 337 (-2.8A)
None
None
 0.99A 4j4vC-3b4yA:
undetectable		 4j4vC-3b4yA:
24.16
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.
4JSF_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 4jsfA-4lmvA:
undetectable
4jsfB-4lmvA:
undetectable		 4jsfA-4lmvA:
21.00
4jsfB-4lmvA:
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.
4KCM_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 4kcmA-4lmvA:
undetectable
4kcmB-4lmvA:
undetectable		 4kcmA-4lmvA:
21.00
4kcmB-4lmvA:
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.
4LG1_C_SAMC301_0
(PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21D)		 4jxr ACETYLTRANSFERASE
(Sinorhizobium
meliloti) 		5 / 12 ALA A  58
GLY A  98
GLY A 100
LEU A 133
ALA A   3
 None
FLC  A 201 ( 4.4A)
FLC  A 201 (-3.5A)
FLC  A 201 (-4.3A)
None
 1.16A 4lg1C-4jxrA:
undetectable		 4lg1C-4jxrA:
23.08
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.
4MBS_B_MRVB1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 3blw ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT 1
(Saccharomyces
cerevisiae) 		4 / 5 THR A 179
LEU A 233
THR A 241
MET A 238
 None
None
FLC  A1001 (-2.6A)
None
 1.49A 4mbsB-3blwA:
undetectable		 4mbsB-3blwA:
21.21
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.
4N49_A_SAMA601_0
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 187
GLY A 191
THR A 265
ASN A 186
ILE A 267
 None
None
None
FLC  A 502 (-2.6A)
None
 0.97A 4n49A-2p4qA:
3.1		 4n49A-2p4qA:
22.12
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.
4NJH_A_SAMA302_0
(7-CARBOXY-7-DEAZAGUA
NINE SYNTHASE)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		5 / 12 THR A 234
GLU A 235
ASN A 231
LYS A 275
ASP A 218
 FLC  A 302 (-4.0A)
None
None
None
None
 1.49A 4njhA-4to8A:
4.7		 4njhA-4to8A:
21.68
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.
4NJH_B_SAMB302_0
(7-CARBOXY-7-DEAZAGUA
NINE SYNTHASE)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		5 / 12 THR A 234
GLU A 235
ASN A 231
LYS A 275
ASP A 218
 FLC  A 302 (-4.0A)
None
None
None
None
 1.49A 4njhB-4to8A:
3.2		 4njhB-4to8A:
21.68
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.
4NJI_A_SAMA302_0
(7-CARBOXY-7-DEAZAGUA
NINE SYNTHASE)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		5 / 12 THR A 234
GLU A 235
ASN A 231
LYS A 275
ASP A 218
 FLC  A 302 (-4.0A)
None
None
None
None
 1.50A 4njiA-4to8A:
4.7		 4njiA-4to8A:
21.68
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.
4NJI_B_SAMB302_0
(7-CARBOXY-7-DEAZAGUA
NINE SYNTHASE)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		5 / 12 THR A 234
GLU A 235
ASN A 231
LYS A 275
ASP A 218
 FLC  A 302 (-4.0A)
None
None
None
None
 1.49A 4njiB-4to8A:
2.3		 4njiB-4to8A:
21.68
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.
4NJJ_A_SAMA302_0
(7-CARBOXY-7-DEAZAGUA
NINE SYNTHASE)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		5 / 12 THR A 234
GLU A 235
ASN A 231
LYS A 275
ASP A 218
 FLC  A 302 (-4.0A)
None
None
None
None
 1.50A 4njjA-4to8A:
4.8		 4njjA-4to8A:
21.68
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.
4NJJ_B_SAMB302_0
(7-CARBOXY-7-DEAZAGUA
NINE SYNTHASE)		 4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II
(Staphylococcus
aureus) 		5 / 12 THR A 234
GLU A 235
ASN A 231
LYS A 275
ASP A 218
 FLC  A 302 (-4.0A)
None
None
None
None
 1.48A 4njjB-4to8A:
3.4		 4njjB-4to8A:
21.68
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.
4NJV_A_RITA500_1
(PROTEASE)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 101
ALA A 102
GLY A 200
ILE A  97
ILE A 172
 FLC  A 300 (-3.3A)
None
None
None
None
 1.05A 4njvA-4x84A:
undetectable		 4njvA-4x84A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKV_B_AERB601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Streptococcus
pneumoniae) 		4 / 5 ARG A 234
ASP A 306
GLU A 236
VAL A 378
 None
FLC  A1419 (-3.0A)
None
None
 1.37A 4nkvB-3zh4A:
undetectable		 4nkvB-3zh4A:
21.55
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.
4O0S_A_ADNA500_1
(AURORA KINASE A)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		8 / 11 GLY A 215
VAL A 222
ALA A 233
LYS A 235
LEU A 263
ASN A 341
LEU A 343
ASP A 354
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.5A)
 0.67A 4o0sA-4c02A:
24.9		 4o0sA-4c02A:
25.29
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.
4O0U_A_ADNA501_1
(AURORA KINASE A)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		4 / 6 ALA A 233
LYS A 235
LEU A 263
LEU A 343
 TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-4.7A)
 0.79A 4o0uA-4c02A:
8.0		 4o0uA-4c02A:
25.00
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.
4O0U_A_ADNA501_1
(AURORA KINASE A)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		4 / 6 VAL A 222
ALA A 233
LEU A 263
LEU A 343
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-4.7A)
 0.42A 4o0uA-4c02A:
8.0		 4o0uA-4c02A:
25.00
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.
4P3Q_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Streptococcus
pneumoniae) 		4 / 5 ASP A 326
ARG A 398
ARG A  92
THR A 297
 None
FLC  A1419 (-2.9A)
FLC  A1419 ( 4.0A)
None
 1.27A 4p3qA-3zh4A:
undetectable		 4p3qA-3zh4A:
15.99
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.
4P3R_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Streptococcus
pneumoniae) 		3 / 3 ASP A 326
ARG A  92
THR A 297
 None
FLC  A1419 ( 4.0A)
None
 0.74A 4p3rA-3zh4A:
undetectable		 4p3rA-3zh4A:
15.99
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.
4PFJ_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3uto TWITCHIN
(Caenorhabditis
elegans) 		4 / 7 GLU A 477
THR A 301
HIS A 275
LEU A 265
 FLC  A 573 ( 4.7A)
None
None
None
 1.02A 4pfjA-3utoA:
undetectable		 4pfjA-3utoA:
18.81
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.
4PM5_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 149
LYS A 239
THR A 240
GLY A 241
SER A 242
GLY A 243
 FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
FLC  A 301 (-2.8A)
None
 0.59A 4pm5A-5ctmA:
18.7		 4pm5A-5ctmA:
22.76
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.
4PM9_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		5 / 12 SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.37A 4pm9A-5ctmA:
18.9		 4pm9A-5ctmA:
22.22
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.
4PQA_A_X8ZA401_1
(SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		6 / 11 GLU A 268
GLU A 267
GLY A 274
GLY A 273
ILE A 233
HIS A 230
 FLC  A 501 ( 3.0A)
None
None
None
None
ZN  A 500 ( 3.3A)
 1.38A 4pqaA-1zb7A:
undetectable		 4pqaA-1zb7A:
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.
4QB9_D_PARD500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 2q7b ACETYLTRANSFERASE,
GNAT FAMILY
(Streptococcus
agalactiae) 		4 / 8 SER A 110
ASP A  74
ASP A  73
TYR A 147
 None
None
None
FLC  A 164 (-4.7A)
 1.26A 4qb9D-2q7bA:
10.6		 4qb9D-2q7bA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QI9_C_MTXC201_1
(DIHYDROFOLATE
REDUCTASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 11 ALA A  87
ASP A  82
SER A  71
ILE A 231
ARG A 230
 None
None
None
None
FLC  A 401 (-3.6A)
 1.16A 4qi9C-5yhpA:
undetectable		 4qi9C-5yhpA:
17.88
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.
4R21_B_STRB601_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		5 / 9 VAL B 160
GLY B 120
ALA B 119
THR B  48
ILE B 285
 None
None
None
FLC  B 292 (-4.1A)
None
 0.97A 4r21B-3d6nB:
undetectable		 4r21B-3d6nB:
20.83
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.
4RP8_C_ASCC501_1
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 1p0z SENSOR KINASE CITA
(Klebsiella
pneumoniae) 		3 / 3 SER A 105
TYR A  56
ASP A  83
 None
FLC  A1632 (-3.8A)
OMO  A1631 (-3.9A)
 0.83A 4rp8C-1p0zA:
0.0		 4rp8C-1p0zA:
12.82
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.
4RV6_A_RPBA1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		5 / 11 GLN A 176
GLY A 204
TYR A 520
SER A 207
GLU A 535
 FLC  A 743 (-3.8A)
None
None
None
None
 1.38A 4rv6A-1po0A:
undetectable		 4rv6A-1po0A:
18.45
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.
4RV6_B_RPBB1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		5 / 11 GLN A 176
GLY A 204
TYR A 520
SER A 207
GLU A 535
 FLC  A 743 (-3.8A)
None
None
None
None
 1.38A 4rv6B-1po0A:
undetectable		 4rv6B-1po0A:
18.45
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.
4RZV_A_032A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 ALA A 233
LYS A 235
LEU A 263
THR A 283
SER A 290
 TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
 0.74A 4rzvA-4c02A:
7.3		 4rzvA-4c02A:
29.36
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.
4RZV_B_032B801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
SER A 290
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
 0.70A 4rzvB-4c02A:
24.6		 4rzvB-4c02A:
29.36
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.
4UBP_C_HAEC800_1
(PROTEIN (UREASE
(CHAIN C)))		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 6 HIS A  61
HIS A  63
HIS A 180
HIS A 232
ASP A 305
 ZN  A 423 (-3.5A)
ZN  A 423 ( 3.4A)
FLC  A 424 (-4.0A)
FLC  A 424 (-4.8A)
FLC  A 424 ( 2.7A)
 0.43A 4ubpC-3d6nA:
23.3		 4ubpC-3d6nA:
24.87
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.
4UBP_C_HAEC800_1
(PROTEIN (UREASE
(CHAIN C)))		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		5 / 6 HIS A  58
HIS A  62
HIS A  80
HIS A 104
ASP A 161
 FE  A 202 (-3.3A)
FLC  A 203 (-4.0A)
FE  A 201 ( 3.4A)
FE  A 201 ( 3.4A)
FE  A 202 ( 2.5A)
 0.90A 4ubpC-4n6wA:
undetectable		 4ubpC-4n6wA:
16.25
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.
4UCH_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.14A 4uchA-4lmvA:
undetectable
4uchB-4lmvA:
undetectable		 4uchA-4lmvA:
21.09
4uchB-4lmvA:
21.09
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.
4UCK_A_SAMA2409_1
(RNA-DIRECTED RNA
POLYMERASE L)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		3 / 3 SER A 643
ASP A  67
ASP A 185
 FLC  A 756 (-2.8A)
None
None
 0.74A 4uckA-1b0kA:
undetectable		 4uckA-1b0kA:
20.45
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.
4UH3_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 4uh3A-4lmvA:
undetectable
4uh3B-4lmvA:
undetectable		 4uh3A-4lmvA:
21.00
4uh3B-4lmvA:
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.
4UH5_A_H4BA760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.14A 4uh5A-4lmvA:
undetectable
4uh5B-4lmvA:
undetectable		 4uh5A-4lmvA:
21.09
4uh5B-4lmvA:
21.09
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.
4UH6_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 4uh6A-4lmvA:
undetectable
4uh6B-4lmvA:
undetectable		 4uh6A-4lmvA:
21.09
4uh6B-4lmvA:
21.09
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.
4UPP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 4uppA-4lmvA:
undetectable
4uppB-4lmvA:
undetectable		 4uppA-4lmvA:
21.00
4uppB-4lmvA:
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.
4V3U_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 4v3uA-4lmvA:
undetectable
4v3uB-4lmvA:
undetectable		 4v3uA-4lmvA:
21.09
4v3uB-4lmvA:
21.09
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.
4V3U_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 4v3uA-4lmvA:
undetectable
4v3uB-4lmvA:
undetectable		 4v3uA-4lmvA:
21.09
4v3uB-4lmvA:
21.09
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.
4V3U_C_H4BC760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.15A 4v3uC-4lmvA:
undetectable
4v3uD-4lmvA:
undetectable		 4v3uC-4lmvA:
21.09
4v3uD-4lmvA:
21.09
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.
4V3U_D_H4BD760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 4v3uC-4lmvA:
undetectable
4v3uD-4lmvA:
undetectable		 4v3uC-4lmvA:
21.09
4v3uD-4lmvA:
21.09
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.
4V3W_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 4v3wA-4lmvA:
undetectable
4v3wB-4lmvA:
undetectable		 4v3wA-4lmvA:
21.00
4v3wB-4lmvA:
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.
4V3X_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 4v3xA-4lmvA:
undetectable
4v3xB-4lmvA:
undetectable		 4v3xA-4lmvA:
21.00
4v3xB-4lmvA:
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.
4V3Z_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.14A 4v3zA-4lmvA:
undetectable
4v3zB-4lmvA:
undetectable		 4v3zA-4lmvA:
21.00
4v3zB-4lmvA:
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.
4V3Z_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 4v3zA-4lmvA:
undetectable
4v3zB-4lmvA:
undetectable		 4v3zA-4lmvA:
21.00
4v3zB-4lmvA:
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.
4XQE_A_AG2A506_1
(HOMOSPERMIDINE
SYNTHASE)		 5h5b THYMIDYLATE KINASE
(Aquifex
aeolicus) 		4 / 6 ARG B 145
ARG B  47
ARG B  90
ASP B   9
 FLC  B 201 (-3.0A)
None
None
FLC  B 201 (-4.6A)
 1.12A 4xqeA-5h5bB:
2.2		 4xqeA-5h5bB:
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.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 5h5b THYMIDYLATE KINASE
(Aquifex
aeolicus) 		4 / 8 ARG B 145
ARG B  47
ARG B  90
ASP B   9
 FLC  B 201 (-3.0A)
None
None
FLC  B 201 (-4.6A)
 1.09A 4xqgA-5h5bB:
undetectable		 4xqgA-5h5bB:
16.84
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.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)		 5h5b THYMIDYLATE KINASE
(Aquifex
aeolicus) 		4 / 8 ARG B 145
ARG B  47
ARG B  90
ASP B   9
 FLC  B 201 (-3.0A)
None
None
FLC  B 201 (-4.6A)
 1.09A 4xqgB-5h5bB:
undetectable		 4xqgB-5h5bB:
16.84
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.
4XUD_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		5 / 12 VAL A 271
GLU A 232
GLY A  43
ILE A 231
SER A  71
 None
None
FLC  A 402 (-3.4A)
None
None
 1.43A 4xudA-5yhpA:
2.7		 4xudA-5yhpA:
20.56
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.
4XV2_A_P06A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.41A 4xv2A-4c02A:
24.3		 4xv2A-4c02A:
28.74
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.
4YDQ_A_HFGA802_1
(PROLINE--TRNA LIGASE)		 5cyf PUTATIVE URIDINE
PHOSPHORYLASE
(Schistosoma
mansoni) 		4 / 4 THR A 193
GLU A 232
THR A  98
HIS A  91
 None
None
None
FLC  A 301 (-4.3A)
 1.35A 4ydqA-5cyfA:
2.6		 4ydqA-5cyfA:
20.28
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.
4YMG_B_SAMB1001_1
(PUTATIVE
SAM-DEPENDENT
O-METHYLTRANFERASE)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		3 / 3 SER A 174
GLU A 268
GLU A 357
 None
FLC  A 501 ( 3.0A)
None
 0.75A 4ymgB-1zb7A:
undetectable		 4ymgB-1zb7A:
20.62
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.
4Z3O_F_MFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT
B,PARE30-PARC55
FUSED TOPO IV FROM
S. PNEUMONIAE
E-SITE DNA)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 5 ARG A 235
ARG A 302
GLY A 336
GLU A 338
 FLC  A 509 (-2.8A)
None
None
None
 1.16A 4z3oA-5hvfA:
3.8
4z3oB-5hvfA:
4.3		 4z3oA-5hvfA:
20.11
4z3oB-5hvfA:
20.11
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.
4ZE1_A_X2NA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3n9t PNPC
(Pseudomonas
putida) 		5 / 12 GLY A 106
PHE A 285
LEU A 219
HIS A 220
PHE A 236
 FLC  A 293 ( 4.3A)
None
None
FE  A 292 ( 3.1A)
None
 1.28A 4ze1A-3n9tA:
undetectable		 4ze1A-3n9tA:
21.81
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_SORB1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 5htk 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 2
(Homo
sapiens) 		4 / 7 ARG A 136
PHE A  90
ARG A  78
ILE A 101
 None
None
FLC  A 601 (-3.9A)
None
 1.40A 5a06B-5htkA:
undetectable		 5a06B-5htkA:
20.96
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.
5ADB_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 5adbA-4lmvA:
undetectable
5adbB-4lmvA:
undetectable		 5adbA-4lmvA:
21.00
5adbB-4lmvA:
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.
5ADC_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.11A 5adcA-4lmvA:
undetectable
5adcB-4lmvA:
undetectable		 5adcA-4lmvA:
21.00
5adcB-4lmvA:
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.
5ADD_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 5addA-4lmvA:
undetectable
5addB-4lmvA:
undetectable		 5addA-4lmvA:
21.00
5addB-4lmvA:
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.
5AGN_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.14A 5agnA-4lmvA:
undetectable
5agnB-4lmvA:
undetectable		 5agnA-4lmvA:
21.00
5agnB-4lmvA:
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.
5AMK_A_EF2A151_1
(CEREBLON ISOFORM 4)		 3som METHYLMALONIC
ACIDURIA AND
HOMOCYSTINURIA TYPE
C PROTEIN
(Homo
sapiens) 		4 / 8 PRO A  56
PHE A 223
PHE A 154
TYR A 205
 None
FLC  A 501 (-3.9A)
None
None
 1.17A 5amkA-3somA:
undetectable		 5amkA-3somA:
19.83
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.
5AMK_A_EF2A151_1
(CEREBLON ISOFORM 4)		 4tx8 PROBABLE CHITINASE A
(Chromobacterium
violaceum) 		4 / 8 ASN A  94
PRO A  95
PHE A  92
TRP A 374
 None
None
None
FLC  A 505 (-3.0A)
 1.44A 5amkA-4tx8A:
undetectable		 5amkA-4tx8A:
15.08
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.
5BTA_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 7 ARG A 235
ARG A 302
GLY A 336
GLU A 338
 FLC  A 509 (-2.8A)
None
None
None
 0.93A 5btaA-5hvfA:
3.4
5btaC-5hvfA:
2.9
5btaD-5hvfA:
2.9		 5btaA-5hvfA:
20.35
5btaC-5hvfA:
20.35
5btaD-5hvfA:
19.55
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.
5BTA_H_MFXH101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 6 ARG A 302
GLY A 336
GLU A 338
ARG A 235
 None
None
None
FLC  A 509 (-2.8A)
 0.91A 5btaA-5hvfA:
3.4
5btaB-5hvfA:
3.1
5btaC-5hvfA:
undetectable		 5btaA-5hvfA:
20.35
5btaB-5hvfA:
19.55
5btaC-5hvfA:
20.35
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.
5BTC_G_CPFG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 6 ARG A 235
ARG A 302
GLY A 336
GLU A 338
 FLC  A 509 (-2.8A)
None
None
None
 0.94A 5btcA-5hvfA:
3.1
5btcC-5hvfA:
3.4
5btcD-5hvfA:
2.8		 5btcA-5hvfA:
20.35
5btcC-5hvfA:
20.35
5btcD-5hvfA:
19.55
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.
5BTC_G_CPFG102_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 6 ARG A 302
GLY A 336
GLU A 338
ARG A 235
 None
None
None
FLC  A 509 (-2.8A)
 0.91A 5btcA-5hvfA:
3.1
5btcB-5hvfA:
2.0
5btcC-5hvfA:
3.4		 5btcA-5hvfA:
20.35
5btcB-5hvfA:
19.55
5btcC-5hvfA:
20.35
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.
5BTF_F_GFNF101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 7 ARG A 302
GLY A 336
GLU A 338
ARG A 235
 None
None
None
FLC  A 509 (-2.8A)
 0.92A 5btfA-5hvfA:
3.4
5btfB-5hvfA:
3.9
5btfC-5hvfA:
3.3		 5btfA-5hvfA:
20.35
5btfB-5hvfA:
19.55
5btfC-5hvfA:
20.35
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.
5BTG_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 6 ARG A 302
GLY A 336
GLU A 338
ARG A 235
 None
None
None
FLC  A 509 (-2.8A)
 0.85A 5btgA-5hvfA:
3.5
5btgB-5hvfA:
2.8
5btgC-5hvfA:
3.4		 5btgA-5hvfA:
19.77
5btgB-5hvfA:
19.55
5btgC-5hvfA:
19.77
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.
5C0O_F_SAMF301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 200
GLY A  99
GLY A 100
ALA A 203
LEU A 130
 None
FLC  A 300 (-3.8A)
FLC  A 300 (-3.5A)
None
None
 0.77A 5c0oF-4x84A:
3.1		 5c0oF-4x84A:
undetectable
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.
5CDQ_E_MFXE2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3mcf DIPHOSPHOINOSITOL
POLYPHOSPHATE
PHOSPHOHYDROLASE
3-ALPHA
(Homo
sapiens) 		4 / 5 SER A  39
GLY A  51
GLU A  53
ARG A 115
 FLC  A   0 (-3.0A)
None
None
FLC  A   0 (-3.1A)
 1.04A 5cdqA-3mcfA:
undetectable
5cdqB-3mcfA:
undetectable
5cdqC-3mcfA:
undetectable		 5cdqA-3mcfA:
14.14
5cdqB-3mcfA:
22.80
5cdqC-3mcfA:
14.14
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.
5CDQ_E_MFXE2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 5 ARG A 302
GLY A 336
GLU A 338
ARG A 235
 None
None
None
FLC  A 509 (-2.8A)
 1.12A 5cdqA-5hvfA:
undetectable
5cdqB-5hvfA:
3.7
5cdqC-5hvfA:
undetectable		 5cdqA-5hvfA:
22.50
5cdqB-5hvfA:
18.50
5cdqC-5hvfA:
22.50
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.
5CDQ_V_MFXV2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		4 / 5 ARG A 302
GLY A 336
GLU A 338
ARG A 235
 None
None
None
FLC  A 509 (-2.8A)
 1.16A 5cdqR-5hvfA:
undetectable
5cdqS-5hvfA:
undetectable
5cdqT-5hvfA:
undetectable		 5cdqR-5hvfA:
22.50
5cdqS-5hvfA:
18.50
5cdqT-5hvfA:
22.50
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.
5CSW_A_P06A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 PHE A 237
VAL A 222
ALA A 233
LEU A 263
THR A 283
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.85A 5cswA-4c02A:
24.3		 5cswA-4c02A:
29.36
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.
5CSW_A_P06A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.41A 5cswA-4c02A:
24.3		 5cswA-4c02A:
29.36
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.
5CSW_B_P06B801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 PHE A 237
VAL A 222
ALA A 233
LEU A 263
THR A 283
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.84A 5cswB-4c02A:
24.3		 5cswB-4c02A:
29.36
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.
5CSW_B_P06B801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.51A 5cswB-4c02A:
24.3		 5cswB-4c02A:
29.36
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.
5DB5_A_CYSA503_0
(CYSTEINE DESULFURASE)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 ALA A 573
HIS A 101
ARG A 644
ARG A 580
 None
FLC  A 756 ( 3.8A)
FLC  A 756 (-4.3A)
FLC  A 756 (-3.3A)
 1.20A 5db5A-1b0kA:
undetectable
5db5B-1b0kA:
undetectable		 5db5A-1b0kA:
20.08
5db5B-1b0kA:
20.08
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.
5DB5_A_CYSA503_0
(CYSTEINE DESULFURASE)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 ALA A 642
ARG A 452
HIS A 646
THR A  75
 FLC  A 756 (-3.0A)
FLC  A 756 (-3.0A)
None
FLC  A 756 ( 4.4A)
 1.26A 5db5A-1b0kA:
undetectable
5db5B-1b0kA:
undetectable		 5db5A-1b0kA:
20.08
5db5B-1b0kA:
20.08
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.
5DXB_A_ESTA1000_1
(ESTROGEN RECEPTOR)		 5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3
(Arabidopsis
thaliana) 		5 / 10 ALA A 694
GLU A 697
LEU A 654
ARG A 145
GLY A 647
 None
None
None
None
FLC  A1002 (-3.3A)
 1.30A 5dxbA-5fdnA:
2.9		 5dxbA-5fdnA:
14.15
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.
5E5K_B_017B201_2
(HIV-1 PROTEASE)		 5wxu 11S GLOBULIN
(Wrightia
tinctoria) 		5 / 12 LEU A 162
GLY A 111
ILE A 112
ILE A 295
ILE A 160
 None
None
None
FLC  A 503 (-3.9A)
None
 0.86A 5e5kB-5wxuA:
undetectable		 5e5kB-5wxuA:
20.62
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.
5EDL_A_VIBA201_1
(PUTATIVE
HMP/THIAMINE
PERMEASE PROTEIN
YKOE)		 2q7b ACETYLTRANSFERASE,
GNAT FAMILY
(Streptococcus
agalactiae) 		5 / 12 TYR A  47
VAL A  17
ILE A  20
GLN A  37
SER A  66
 None
None
None
FLC  A 164 (-4.4A)
None
 1.43A 5edlA-2q7bA:
0.0		 5edlA-2q7bA:
19.61
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.
5EEU_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 5eeuA-1zb7A:
undetectable
5eeuB-1zb7A:
undetectable		 5eeuA-1zb7A:
9.28
5eeuB-1zb7A:
9.28
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.
5EEU_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.20A 5eeuD-1zb7A:
undetectable
5eeuE-1zb7A:
undetectable		 5eeuD-1zb7A:
9.28
5eeuE-1zb7A:
9.28
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.
5EEU_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 5eeuE-1zb7A:
undetectable
5eeuF-1zb7A:
undetectable		 5eeuE-1zb7A:
9.28
5eeuF-1zb7A:
9.28
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.
5EEU_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eeuG-1zb7A:
undetectable
5eeuH-1zb7A:
undetectable		 5eeuG-1zb7A:
9.28
5eeuH-1zb7A:
9.28
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.
5EEU_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.25A 5eeuA-1zb7A:
undetectable
5eeuK-1zb7A:
undetectable		 5eeuA-1zb7A:
9.28
5eeuK-1zb7A:
9.28
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.
5EEU_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5eeuN-1zb7A:
undetectable
5eeuO-1zb7A:
undetectable		 5eeuN-1zb7A:
9.28
5eeuO-1zb7A:
9.28
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.
5EEU_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eeuP-1zb7A:
undetectable
5eeuQ-1zb7A:
undetectable		 5eeuP-1zb7A:
9.28
5eeuQ-1zb7A:
9.28
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.
5EEU_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eeuR-1zb7A:
undetectable
5eeuS-1zb7A:
undetectable		 5eeuR-1zb7A:
9.28
5eeuS-1zb7A:
9.28
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.
5EEU_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eeuS-1zb7A:
undetectable
5eeuT-1zb7A:
undetectable		 5eeuS-1zb7A:
9.28
5eeuT-1zb7A:
9.28
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.
5EEU_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eeuT-1zb7A:
undetectable
5eeuU-1zb7A:
undetectable		 5eeuT-1zb7A:
9.28
5eeuU-1zb7A:
9.28
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.
5EEU_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eeuU-1zb7A:
undetectable
5eeuV-1zb7A:
undetectable		 5eeuU-1zb7A:
9.28
5eeuV-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.20A 5eevD-1zb7A:
undetectable
5eevE-1zb7A:
undetectable		 5eevD-1zb7A:
9.28
5eevE-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5eevE-1zb7A:
undetectable
5eevF-1zb7A:
undetectable		 5eevE-1zb7A:
9.28
5eevF-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eevG-1zb7A:
undetectable
5eevH-1zb7A:
undetectable		 5eevG-1zb7A:
9.28
5eevH-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.25A 5eevA-1zb7A:
undetectable
5eevK-1zb7A:
undetectable		 5eevA-1zb7A:
9.28
5eevK-1zb7A:
9.28
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_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 SER A 643
HIS A 147
HIS A 167
THR A 168
 FLC  A 756 (-2.8A)
None
O  A1100 ( 3.9A)
None
 0.84A 5eevL-1b0kA:
undetectable
5eevV-1b0kA:
undetectable		 5eevL-1b0kA:
8.16
5eevV-1b0kA:
8.16
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5eevN-1zb7A:
undetectable
5eevO-1zb7A:
undetectable		 5eevN-1zb7A:
9.28
5eevO-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eevP-1zb7A:
undetectable
5eevQ-1zb7A:
undetectable		 5eevP-1zb7A:
9.28
5eevQ-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5eevR-1zb7A:
undetectable
5eevS-1zb7A:
undetectable		 5eevR-1zb7A:
9.28
5eevS-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eevS-1zb7A:
undetectable
5eevT-1zb7A:
undetectable		 5eevS-1zb7A:
9.28
5eevT-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eevT-1zb7A:
undetectable
5eevU-1zb7A:
undetectable		 5eevT-1zb7A:
9.28
5eevU-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eevU-1zb7A:
undetectable
5eevV-1zb7A:
undetectable		 5eevU-1zb7A:
9.28
5eevV-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.20A 5eewD-1zb7A:
undetectable
5eewE-1zb7A:
undetectable		 5eewD-1zb7A:
9.28
5eewE-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5eewE-1zb7A:
undetectable
5eewF-1zb7A:
undetectable		 5eewE-1zb7A:
9.28
5eewF-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eewG-1zb7A:
undetectable
5eewH-1zb7A:
undetectable		 5eewG-1zb7A:
9.28
5eewH-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5eewA-1zb7A:
undetectable
5eewK-1zb7A:
undetectable		 5eewA-1zb7A:
9.28
5eewK-1zb7A:
9.28
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_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 SER A 643
HIS A 147
HIS A 167
THR A 168
 FLC  A 756 (-2.8A)
None
O  A1100 ( 3.9A)
None
 0.84A 5eewL-1b0kA:
0.0
5eewV-1b0kA:
undetectable		 5eewL-1b0kA:
8.16
5eewV-1b0kA:
8.16
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5eewN-1zb7A:
undetectable
5eewO-1zb7A:
undetectable		 5eewN-1zb7A:
9.28
5eewO-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eewP-1zb7A:
undetectable
5eewQ-1zb7A:
undetectable		 5eewP-1zb7A:
9.28
5eewQ-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5eewR-1zb7A:
undetectable
5eewS-1zb7A:
undetectable		 5eewR-1zb7A:
9.28
5eewS-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eewS-1zb7A:
undetectable
5eewT-1zb7A:
undetectable		 5eewS-1zb7A:
9.28
5eewT-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eewT-1zb7A:
undetectable
5eewU-1zb7A:
undetectable		 5eewT-1zb7A:
9.28
5eewU-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eewU-1zb7A:
undetectable
5eewV-1zb7A:
undetectable		 5eewU-1zb7A:
9.28
5eewV-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5eexD-1zb7A:
undetectable
5eexE-1zb7A:
undetectable		 5eexD-1zb7A:
9.28
5eexE-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5eexE-1zb7A:
undetectable
5eexF-1zb7A:
undetectable		 5eexE-1zb7A:
9.28
5eexF-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eexG-1zb7A:
undetectable
5eexH-1zb7A:
undetectable		 5eexG-1zb7A:
9.28
5eexH-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 5eexI-1zb7A:
undetectable
5eexJ-1zb7A:
undetectable		 5eexI-1zb7A:
9.28
5eexJ-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5eexA-1zb7A:
undetectable
5eexK-1zb7A:
undetectable		 5eexA-1zb7A:
9.28
5eexK-1zb7A:
9.28
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5eexN-1zb7A:
undetectable
5eexO-1zb7A:
undetectable		 5eexN-1zb7A:
9.28
5eexO-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eexP-1zb7A:
undetectable
5eexQ-1zb7A:
undetectable		 5eexP-1zb7A:
9.28
5eexQ-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5eexQ-1zb7A:
undetectable
5eexR-1zb7A:
undetectable		 5eexQ-1zb7A:
9.28
5eexR-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5eexR-1zb7A:
undetectable
5eexS-1zb7A:
undetectable		 5eexR-1zb7A:
9.28
5eexS-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eexS-1zb7A:
undetectable
5eexT-1zb7A:
undetectable		 5eexS-1zb7A:
9.28
5eexT-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eexT-1zb7A:
undetectable
5eexU-1zb7A:
undetectable		 5eexT-1zb7A:
9.28
5eexU-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eexU-1zb7A:
undetectable
5eexV-1zb7A:
undetectable		 5eexU-1zb7A:
9.28
5eexV-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5eeyD-1zb7A:
undetectable
5eeyE-1zb7A:
undetectable		 5eeyD-1zb7A:
9.28
5eeyE-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eeyE-1zb7A:
undetectable
5eeyF-1zb7A:
undetectable		 5eeyE-1zb7A:
9.28
5eeyF-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eeyG-1zb7A:
undetectable
5eeyH-1zb7A:
undetectable		 5eeyG-1zb7A:
9.28
5eeyH-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 5eeyI-1zb7A:
undetectable
5eeyJ-1zb7A:
undetectable		 5eeyI-1zb7A:
9.28
5eeyJ-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5eeyA-1zb7A:
undetectable
5eeyK-1zb7A:
undetectable		 5eeyA-1zb7A:
9.28
5eeyK-1zb7A:
9.28
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5eeyN-1zb7A:
undetectable
5eeyO-1zb7A:
undetectable		 5eeyN-1zb7A:
9.28
5eeyO-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eeyP-1zb7A:
undetectable
5eeyQ-1zb7A:
undetectable		 5eeyP-1zb7A:
9.28
5eeyQ-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5eeyQ-1zb7A:
undetectable
5eeyR-1zb7A:
undetectable		 5eeyQ-1zb7A:
9.28
5eeyR-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5eeyR-1zb7A:
undetectable
5eeyS-1zb7A:
undetectable		 5eeyR-1zb7A:
9.28
5eeyS-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5eeyS-1zb7A:
undetectable
5eeyT-1zb7A:
undetectable		 5eeyS-1zb7A:
9.28
5eeyT-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eeyT-1zb7A:
undetectable
5eeyU-1zb7A:
undetectable		 5eeyT-1zb7A:
9.28
5eeyU-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eeyU-1zb7A:
undetectable
5eeyV-1zb7A:
undetectable		 5eeyU-1zb7A:
9.28
5eeyV-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5eezD-1zb7A:
undetectable
5eezE-1zb7A:
undetectable		 5eezD-1zb7A:
9.28
5eezE-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eezE-1zb7A:
undetectable
5eezF-1zb7A:
undetectable		 5eezE-1zb7A:
9.28
5eezF-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5eezG-1zb7A:
undetectable
5eezH-1zb7A:
undetectable		 5eezG-1zb7A:
9.28
5eezH-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.24A 5eezI-1zb7A:
undetectable
5eezJ-1zb7A:
undetectable		 5eezI-1zb7A:
9.28
5eezJ-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5eezA-1zb7A:
undetectable
5eezK-1zb7A:
undetectable		 5eezA-1zb7A:
9.28
5eezK-1zb7A:
9.28
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_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 SER A 643
HIS A 147
HIS A 167
THR A 168
 FLC  A 756 (-2.8A)
None
O  A1100 ( 3.9A)
None
 0.84A 5eezL-1b0kA:
undetectable
5eezV-1b0kA:
undetectable		 5eezL-1b0kA:
8.16
5eezV-1b0kA:
8.16
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5eezN-1zb7A:
undetectable
5eezO-1zb7A:
undetectable		 5eezN-1zb7A:
9.28
5eezO-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eezP-1zb7A:
undetectable
5eezQ-1zb7A:
undetectable		 5eezP-1zb7A:
9.28
5eezQ-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5eezQ-1zb7A:
undetectable
5eezR-1zb7A:
undetectable		 5eezQ-1zb7A:
9.28
5eezR-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5eezR-1zb7A:
undetectable
5eezS-1zb7A:
undetectable		 5eezR-1zb7A:
9.28
5eezS-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5eezS-1zb7A:
undetectable
5eezT-1zb7A:
undetectable		 5eezS-1zb7A:
9.28
5eezT-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5eezT-1zb7A:
undetectable
5eezU-1zb7A:
undetectable		 5eezT-1zb7A:
9.28
5eezU-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5eezU-1zb7A:
undetectable
5eezV-1zb7A:
undetectable		 5eezU-1zb7A:
9.28
5eezV-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5ef0D-1zb7A:
undetectable
5ef0E-1zb7A:
undetectable		 5ef0D-1zb7A:
9.28
5ef0E-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5ef0E-1zb7A:
undetectable
5ef0F-1zb7A:
undetectable		 5ef0E-1zb7A:
9.28
5ef0F-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.21A 5ef0G-1zb7A:
undetectable
5ef0H-1zb7A:
undetectable		 5ef0G-1zb7A:
9.28
5ef0H-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5ef0I-1zb7A:
undetectable
5ef0J-1zb7A:
undetectable		 5ef0I-1zb7A:
9.28
5ef0J-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5ef0A-1zb7A:
undetectable
5ef0K-1zb7A:
undetectable		 5ef0A-1zb7A:
9.28
5ef0K-1zb7A:
9.28
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5ef0N-1zb7A:
undetectable
5ef0O-1zb7A:
undetectable		 5ef0N-1zb7A:
9.28
5ef0O-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef0P-1zb7A:
undetectable
5ef0Q-1zb7A:
undetectable		 5ef0P-1zb7A:
9.28
5ef0Q-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef0Q-1zb7A:
undetectable
5ef0R-1zb7A:
undetectable		 5ef0Q-1zb7A:
9.28
5ef0R-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5ef0R-1zb7A:
undetectable
5ef0S-1zb7A:
undetectable		 5ef0R-1zb7A:
9.28
5ef0S-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5ef0S-1zb7A:
undetectable
5ef0T-1zb7A:
undetectable		 5ef0S-1zb7A:
9.28
5ef0T-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5ef0T-1zb7A:
undetectable
5ef0U-1zb7A:
undetectable		 5ef0T-1zb7A:
9.28
5ef0U-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5ef0U-1zb7A:
undetectable
5ef0V-1zb7A:
undetectable		 5ef0U-1zb7A:
9.28
5ef0V-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5ef1D-1zb7A:
undetectable
5ef1E-1zb7A:
undetectable		 5ef1D-1zb7A:
9.28
5ef1E-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5ef1E-1zb7A:
undetectable
5ef1F-1zb7A:
undetectable		 5ef1E-1zb7A:
9.28
5ef1F-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.21A 5ef1G-1zb7A:
undetectable
5ef1H-1zb7A:
undetectable		 5ef1G-1zb7A:
9.28
5ef1H-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5ef1I-1zb7A:
undetectable
5ef1J-1zb7A:
undetectable		 5ef1I-1zb7A:
9.28
5ef1J-1zb7A:
9.28
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_J_TRPJ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.26A 5ef1J-1zb7A:
undetectable
5ef1K-1zb7A:
undetectable		 5ef1J-1zb7A:
9.28
5ef1K-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5ef1A-1zb7A:
undetectable
5ef1K-1zb7A:
undetectable		 5ef1A-1zb7A:
9.28
5ef1K-1zb7A:
9.28
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_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 SER A 643
HIS A 147
HIS A 167
THR A 168
 FLC  A 756 (-2.8A)
None
O  A1100 ( 3.9A)
None
 0.84A 5ef1L-1b0kA:
undetectable
5ef1V-1b0kA:
undetectable		 5ef1L-1b0kA:
8.16
5ef1V-1b0kA:
8.16
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5ef1N-1zb7A:
undetectable
5ef1O-1zb7A:
undetectable		 5ef1N-1zb7A:
9.28
5ef1O-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef1P-1zb7A:
undetectable
5ef1Q-1zb7A:
undetectable		 5ef1P-1zb7A:
9.28
5ef1Q-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef1Q-1zb7A:
undetectable
5ef1R-1zb7A:
undetectable		 5ef1Q-1zb7A:
9.28
5ef1R-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5ef1R-1zb7A:
undetectable
5ef1S-1zb7A:
undetectable		 5ef1R-1zb7A:
9.28
5ef1S-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5ef1S-1zb7A:
undetectable
5ef1T-1zb7A:
undetectable		 5ef1S-1zb7A:
9.28
5ef1T-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.23A 5ef1T-1zb7A:
undetectable
5ef1U-1zb7A:
undetectable		 5ef1T-1zb7A:
9.28
5ef1U-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5ef1U-1zb7A:
undetectable
5ef1V-1zb7A:
undetectable		 5ef1U-1zb7A:
9.28
5ef1V-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5ef2D-1zb7A:
undetectable
5ef2E-1zb7A:
undetectable		 5ef2D-1zb7A:
9.28
5ef2E-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5ef2E-1zb7A:
undetectable
5ef2F-1zb7A:
undetectable		 5ef2E-1zb7A:
9.28
5ef2F-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.21A 5ef2G-1zb7A:
undetectable
5ef2H-1zb7A:
undetectable		 5ef2G-1zb7A:
9.28
5ef2H-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5ef2I-1zb7A:
undetectable
5ef2J-1zb7A:
undetectable		 5ef2I-1zb7A:
9.28
5ef2J-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5ef2A-1zb7A:
undetectable
5ef2K-1zb7A:
undetectable		 5ef2A-1zb7A:
9.28
5ef2K-1zb7A:
9.28
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_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 SER A 643
HIS A 147
HIS A 167
THR A 168
 FLC  A 756 (-2.8A)
None
O  A1100 ( 3.9A)
None
 0.84A 5ef2L-1b0kA:
undetectable
5ef2V-1b0kA:
undetectable		 5ef2L-1b0kA:
8.16
5ef2V-1b0kA:
8.16
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5ef2N-1zb7A:
undetectable
5ef2O-1zb7A:
undetectable		 5ef2N-1zb7A:
9.28
5ef2O-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef2P-1zb7A:
undetectable
5ef2Q-1zb7A:
undetectable		 5ef2P-1zb7A:
9.28
5ef2Q-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef2Q-1zb7A:
undetectable
5ef2R-1zb7A:
undetectable		 5ef2Q-1zb7A:
9.28
5ef2R-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5ef2R-1zb7A:
undetectable
5ef2S-1zb7A:
undetectable		 5ef2R-1zb7A:
9.28
5ef2S-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5ef2S-1zb7A:
undetectable
5ef2T-1zb7A:
undetectable		 5ef2S-1zb7A:
9.28
5ef2T-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5ef2T-1zb7A:
undetectable
5ef2U-1zb7A:
undetectable		 5ef2T-1zb7A:
9.28
5ef2U-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5ef2U-1zb7A:
undetectable
5ef2V-1zb7A:
undetectable		 5ef2U-1zb7A:
9.28
5ef2V-1zb7A:
9.28
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_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.19A 5ef3D-1zb7A:
undetectable
5ef3E-1zb7A:
undetectable		 5ef3D-1zb7A:
9.28
5ef3E-1zb7A:
9.28
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_E_TRPE101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.22A 5ef3E-1zb7A:
undetectable
5ef3F-1zb7A:
undetectable		 5ef3E-1zb7A:
9.28
5ef3F-1zb7A:
9.28
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_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.21A 5ef3G-1zb7A:
undetectable
5ef3H-1zb7A:
undetectable		 5ef3G-1zb7A:
9.28
5ef3H-1zb7A:
9.28
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_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 11 THR A 271
GLY A 238
HIS A 237
THR A 172
ILE A 183
 ZN  A 500 ( 4.4A)
None
None
FLC  A 501 (-4.7A)
None
 1.23A 5ef3I-1zb7A:
undetectable
5ef3J-1zb7A:
undetectable		 5ef3I-1zb7A:
9.28
5ef3J-1zb7A:
9.28
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_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.24A 5ef3A-1zb7A:
undetectable
5ef3K-1zb7A:
undetectable		 5ef3A-1zb7A:
9.28
5ef3K-1zb7A:
9.28
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_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1b0k PROTEIN (ACONITASE)
(Sus
scrofa) 		4 / 8 SER A 643
HIS A 147
HIS A 167
THR A 168
 FLC  A 756 (-2.8A)
None
O  A1100 ( 3.9A)
None
 0.84A 5ef3L-1b0kA:
0.0
5ef3V-1b0kA:
0.0		 5ef3L-1b0kA:
8.16
5ef3V-1b0kA:
8.16
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_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5ef3N-1zb7A:
undetectable
5ef3O-1zb7A:
undetectable		 5ef3N-1zb7A:
9.28
5ef3O-1zb7A:
9.28
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_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.19A 5ef3P-1zb7A:
undetectable
5ef3Q-1zb7A:
undetectable		 5ef3P-1zb7A:
9.28
5ef3Q-1zb7A:
9.28
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_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 9 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.20A 5ef3Q-1zb7A:
undetectable
5ef3R-1zb7A:
undetectable		 5ef3Q-1zb7A:
9.28
5ef3R-1zb7A:
9.28
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_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.21A 5ef3R-1zb7A:
undetectable
5ef3S-1zb7A:
undetectable		 5ef3R-1zb7A:
9.28
5ef3S-1zb7A:
9.28
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_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.17A 5ef3S-1zb7A:
undetectable
5ef3T-1zb7A:
undetectable		 5ef3S-1zb7A:
9.28
5ef3T-1zb7A:
9.28
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_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.22A 5ef3T-1zb7A:
undetectable
5ef3U-1zb7A:
undetectable		 5ef3T-1zb7A:
9.28
5ef3U-1zb7A:
9.28
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_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 1zb7 NEUROTOXIN
(Clostridium
botulinum) 		5 / 10 GLY A 238
HIS A 237
THR A 172
ILE A 183
THR A 271
 None
None
FLC  A 501 (-4.7A)
None
ZN  A 500 ( 4.4A)
 1.18A 5ef3U-1zb7A:
undetectable
5ef3V-1zb7A:
undetectable		 5ef3U-1zb7A:
9.28
5ef3V-1zb7A:
9.28
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.
5ESL_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4uzy FLAGELLAR ASSOCIATED
PROTEIN
INTRAFLAGELLAR
TRANSPORT PROTEIN
IFT52
(Chlamydomonas
reinhardtii) 		4 / 5 ALA A 410
PRO A 416
GLY A 325
LEU B 343
 None
FLC  A1647 (-3.5A)
None
None
 0.92A 5eslA-4uzyA:
undetectable		 5eslA-4uzyA:
20.81
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.
5FSA_B_X2NB590_1
(CYP51 VARIANT1)		 2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 129
PHE A 394
TYR A 379
PHE A 371
HIS A 185
 FLC  A 502 ( 4.5A)
None
None
None
FLC  A 502 (-4.5A)
 1.11A 5fsaB-2p4qA:
undetectable		 5fsaB-2p4qA:
21.85
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.
5FSE_C_HQEC1583_1
(UREASE SUBUNIT ALPHA)		 3fky GLUTAMINE SYNTHETASE
(Saccharomyces
cerevisiae) 		4 / 5 ILE A 339
GLN A 132
CYH A 249
GLU A 133
 None
None
None
FLC  A 371 (-3.2A)
 1.27A 5fseC-3fkyA:
0.0		 5fseC-3fkyA:
20.56
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.
5FUQ_A_ACTA1278_0
(NAD(P)H
DEHYDROGENASE
[QUINONE] 1)		 5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE
(Glaciozyma
antarctica) 		4 / 5 HIS A 297
SER A 111
GLN A 265
ILE A 136
 FLC  A 402 (-3.7A)
FLC  A 402 (-2.5A)
None
None
 1.43A 5fuqA-5yhpA:
2.0
5fuqB-5yhpA:
undetectable		 5fuqA-5yhpA:
20.60
5fuqB-5yhpA:
20.60
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.
5FVQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 5fvqA-4lmvA:
undetectable
5fvqB-4lmvA:
undetectable		 5fvqA-4lmvA:
21.00
5fvqB-4lmvA:
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.
5FVR_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 5fvrA-4lmvA:
undetectable
5fvrB-4lmvA:
undetectable		 5fvrA-4lmvA:
21.00
5fvrB-4lmvA:
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.
5FVS_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 5fvsA-4lmvA:
undetectable
5fvsB-4lmvA:
undetectable		 5fvsA-4lmvA:
21.00
5fvsB-4lmvA:
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.
5FVT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 5fvtA-4lmvA:
undetectable
5fvtB-4lmvA:
undetectable		 5fvtA-4lmvA:
21.00
5fvtB-4lmvA:
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.
5FVT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 5fvtA-4lmvA:
undetectable
5fvtB-4lmvA:
undetectable		 5fvtA-4lmvA:
21.00
5fvtB-4lmvA:
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.
5FVU_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 5fvuA-4lmvA:
undetectable
5fvuB-4lmvA:
undetectable		 5fvuA-4lmvA:
21.09
5fvuB-4lmvA:
21.09
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.
5FVV_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.15A 5fvvA-4lmvA:
undetectable
5fvvB-4lmvA:
undetectable		 5fvvA-4lmvA:
21.09
5fvvB-4lmvA:
21.09
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.
5FVW_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 5fvwA-4lmvA:
undetectable
5fvwB-4lmvA:
undetectable		 5fvwA-4lmvA:
21.09
5fvwB-4lmvA:
21.09
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.
5FVX_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 5fvxA-4lmvA:
undetectable
5fvxB-4lmvA:
undetectable		 5fvxA-4lmvA:
21.09
5fvxB-4lmvA:
21.09
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.
5G0N_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 5g0nA-4lmvA:
undetectable
5g0nB-4lmvA:
undetectable		 5g0nA-4lmvA:
21.00
5g0nB-4lmvA:
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.
5G0N_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 5g0nA-4lmvA:
undetectable
5g0nB-4lmvA:
undetectable		 5g0nA-4lmvA:
21.00
5g0nB-4lmvA:
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.
5H2U_A_1N1A501_1
(PROTEIN-TYROSINE
KINASE 6)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 VAL A 222
ALA A 233
LEU A 263
THR A 283
GLY A 289
LEU A 343
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
TAK  A1507 (-3.5A)
TAK  A1507 (-4.7A)
 0.71A 5h2uA-4c02A:
24.8		 5h2uA-4c02A:
28.32
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.
5H2U_B_1N1B501_1
(PROTEIN-TYROSINE
KINASE 6)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		7 / 12 VAL A 222
ALA A 233
LEU A 263
THR A 283
GLY A 289
LEU A 343
ASP A 354
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
TAK  A1507 (-3.5A)
TAK  A1507 (-4.7A)
TAK  A1507 (-3.5A)
 0.80A 5h2uB-4c02A:
25.1		 5h2uB-4c02A:
28.32
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.
5H8T_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Streptococcus
pneumoniae) 		5 / 12 LEU A 371
ALA A 375
ILE A 282
ILE A 235
LEU A 268
 FLC  A1419 (-4.0A)
None
None
None
None
 1.10A 5h8tA-3zh4A:
undetectable		 5h8tA-3zh4A:
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.
5HBS_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 3zh4 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Streptococcus
pneumoniae) 		5 / 12 LEU A 371
ALA A 375
ILE A 282
ILE A 235
LEU A 268
 FLC  A1419 (-4.0A)
None
None
None
None
 1.15A 5hbsA-3zh4A:
undetectable		 5hbsA-3zh4A:
12.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI2_A_BAXA801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 ALA A 233
LYS A 235
LEU A 263
THR A 283
LEU A 319
HIS A 334
 TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
None
None
 0.67A 5hi2A-4c02A:
24.9		 5hi2A-4c02A:
30.12
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.
5HIE_A_P06A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 PHE A 237
VAL A 222
ALA A 233
LEU A 263
THR A 283
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.77A 5hieA-4c02A:
24.3		 5hieA-4c02A:
28.74
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.
5HIE_A_P06A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.37A 5hieA-4c02A:
24.3		 5hieA-4c02A:
28.74
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.
5HIE_B_P06B801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 PHE A 237
VAL A 222
ALA A 233
LEU A 263
THR A 283
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.78A 5hieB-4c02A:
24.2		 5hieB-4c02A:
28.74
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.
5HIE_B_P06B801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.37A 5hieB-4c02A:
24.2		 5hieB-4c02A:
28.74
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.
5HIE_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2p2w CITRATE SYNTHASE
(Thermotoga
maritima) 		5 / 7 ILE A 295
GLY A 249
LEU A 267
PHE A 277
ASP A 300
 None
FLC  A 402 ( 3.9A)
None
None
FLC  A 401 ( 3.0A)
 1.41A 5hieB-2p2wA:
undetectable		 5hieB-2p2wA:
20.76
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.
5HIE_C_P06C801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 GLY A 215
PHE A 237
VAL A 222
ALA A 233
LEU A 263
THR A 283
 None
None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.79A 5hieC-4c02A:
5.3		 5hieC-4c02A:
28.74
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.
5HIE_C_P06C801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		6 / 12 GLY A 215
VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.47A 5hieC-4c02A:
5.3		 5hieC-4c02A:
28.74
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.
5HIE_D_P06D801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 PHE A 237
VAL A 222
ALA A 233
LEU A 263
THR A 283
 None
TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.77A 5hieD-4c02A:
24.3		 5hieD-4c02A:
28.74
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.
5HIE_D_P06D801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		5 / 12 VAL A 222
ALA A 233
LYS A 235
LEU A 263
THR A 283
 TAK  A1507 (-4.7A)
TAK  A1507 (-3.3A)
TAK  A1507 ( 4.5A)
FLC  A1503 ( 4.5A)
TAK  A1507 (-3.6A)
 0.36A 5hieD-4c02A:
24.3		 5hieD-4c02A:
28.74
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.
5HWA_A_GCSA301_1
(CHITOSANASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		4 / 8 ASP A 407
GLY A 185
LEU A 216
ASN A 220
 None
FLC  A 501 (-3.5A)
None
None
 0.76A 5hwaA-5x9rA:
undetectable		 5hwaA-5x9rA:
19.50
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.
5I3C_A_AC2A301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3mcf DIPHOSPHOINOSITOL
POLYPHOSPHATE
PHOSPHOHYDROLASE
3-ALPHA
(Homo
sapiens) 		5 / 9 ARG A 115
SER A  38
ALA A  21
VAL A  47
GLU A  69
 FLC  A   0 (-3.1A)
FLC  A   0 (-3.2A)
None
None
FLC  A   0 ( 4.7A)
 1.20A 5i3cA-3mcfA:
undetectable		 5i3cA-3mcfA:
18.78
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.
5IWU_A_ERYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 5htk 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 2
(Homo
sapiens) 		4 / 6 GLY A  75
ASP A 189
ILE A 194
TYR A 197
 FLC  A 601 (-3.0A)
None
None
GOL  A 606 ( 3.4A)
 0.84A 5iwuA-5htkA:
undetectable		 5iwuA-5htkA:
19.52
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.
5KPC_A_SAMA401_1
(PAVINE
N-METHYLTRANSFERASE)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		4 / 5 SER A  77
ASN A  95
GLN A  69
ASP A 153
 None
FLC  A 424 (-3.6A)
None
ZN  A 423 ( 2.4A)
 1.42A 5kpcA-3d6nA:
undetectable		 5kpcA-3d6nA:
20.56
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.
5M50_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		5 / 12 VAL A 410
ASP A 407
GLU A 409
GLY A 185
LEU A 216
 None
None
None
FLC  A 501 (-3.5A)
None
 1.50A 5m50B-5x9rA:
undetectable		 5m50B-5x9rA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M5C_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 3ie1 RIBONUCLEASE
TTHA0252
(Thermus
thermophilus) 		5 / 10 VAL A 399
LEU A 163
ALA A 185
GLY A 410
LEU A 413
 None
None
None
FLC  A 451 ( 4.3A)
None
 1.23A 5m5cE-3ie1A:
undetectable		 5m5cE-3ie1A:
23.83
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.
5N4T_A_BEZA507_0
(BETA-LACTAMASE VIM-2)		 1po0 IRON(III) DICITRATE
TRANSPORT PROTEIN
FECA PRECURSOR
(Escherichia
coli) 		3 / 3 THR A 138
HIS A 141
ASN A 135
 FLC  A 742 (-2.7A)
None
None
 1.00A 5n4tA-1po0A:
0.0		 5n4tA-1po0A:
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.
5N5J_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 4 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.29A 5n5jA-4a3wA:
8.1		 5n5jA-4a3wA:
26.14
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.
5N5K_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 4a3w ARCHAEMETZINCIN
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 117
GLU A 118
HIS A 121
HIS A 127
 ZN  A1159 ( 3.2A)
FLC  A1161 (-2.9A)
ZN  A1159 ( 3.3A)
ZN  A1159 ( 3.2A)
 0.31A 5n5kA-4a3wA:
8.2		 5n5kA-4a3wA:
26.44
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.
5NCD_D_ACTD301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE
(Candida
albicans) 		4 / 4 ASP A 257
HIS A 338
HIS A 413
HIS A 290
 FLC  A 501 (-3.8A)
None
FLC  A 501 (-4.0A)
FLC  A 501 (-3.8A)
 1.43A 5ncdD-5jpeA:
undetectable		 5ncdD-5jpeA:
21.36
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.
5UNT_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 5untA-4lmvA:
undetectable
5untB-4lmvA:
undetectable		 5untA-4lmvA:
21.00
5untB-4lmvA:
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.
5UNT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 5untA-4lmvA:
undetectable
5untB-4lmvA:
undetectable		 5untA-4lmvA:
21.00
5untB-4lmvA:
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.
5UNW_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 5unwA-4lmvA:
undetectable
5unwB-4lmvA:
undetectable		 5unwA-4lmvA:
21.00
5unwB-4lmvA:
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.
5UO5_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 5uo5A-4lmvA:
undetectable
5uo5B-4lmvA:
undetectable		 5uo5A-4lmvA:
21.09
5uo5B-4lmvA:
21.09
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.
5UO7_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 8 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 5uo7A-4lmvA:
undetectable
5uo7B-4lmvA:
undetectable		 5uo7A-4lmvA:
21.09
5uo7B-4lmvA:
21.09
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.
5UUN_A_ACTA312_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		3 / 3 ILE A 324
VAL A 277
PRO A 279
 None
FLC  A 424 ( 3.8A)
None
 0.65A 5uunA-3d6nA:
undetectable		 5uunA-3d6nA:
22.14
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.
5V4V_A_NCAA402_0
(NADPH DEHYDROGENASE
3)		 3n9t PNPC
(Pseudomonas
putida) 		4 / 8 HIS A 218
TYR A 194
PHE A 108
PRO A 107
 FE  A 292 ( 3.2A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FLC  A 293 (-3.5A)
 1.28A 5v4vA-3n9tA:
undetectable		 5v4vA-3n9tA:
21.23
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.
5V4V_B_NCAB402_0
(NADPH DEHYDROGENASE
3)		 3n9t PNPC
(Pseudomonas
putida) 		4 / 8 HIS A 218
TYR A 194
PHE A 108
PRO A 107
 FE  A 292 ( 3.2A)
FLC  A 293 ( 4.0A)
FLC  A 293 (-4.3A)
FLC  A 293 (-3.5A)
 1.26A 5v4vB-3n9tA:
undetectable		 5v4vB-3n9tA:
21.23
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.
5VLM_B_CVIB301_1
(REGULATORY PROTEIN
TETR)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		4 / 8 GLY A 200
ARG A 161
ASP A 174
ASP A  88
 None
None
None
FLC  A 300 (-2.8A)
 0.96A 5vlmB-4x84A:
undetectable		 5vlmB-4x84A:
21.16
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.
5VLM_F_CVIF301_1
(REGULATORY PROTEIN
TETR)		 4x84 RIBOSE-5-PHOSPHATE
ISOMERASE A
(Pseudomonas
aeruginosa) 		4 / 8 ILE A 172
ARG A 161
VAL A 175
ASP A  88
 None
None
None
FLC  A 300 (-2.8A)
 1.00A 5vlmF-4x84A:
undetectable		 5vlmF-4x84A:
21.16
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.
5VUI_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 5vuiA-4lmvA:
undetectable
5vuiB-4lmvA:
undetectable		 5vuiA-4lmvA:
21.00
5vuiB-4lmvA:
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.
5VUJ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.04A 5vujA-4lmvA:
undetectable
5vujB-4lmvA:
undetectable		 5vujA-4lmvA:
21.00
5vujB-4lmvA:
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.
5VUL_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.07A 5vulA-4lmvA:
undetectable
5vulB-4lmvA:
undetectable		 5vulA-4lmvA:
21.00
5vulB-4lmvA:
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.
5VUM_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.07A 5vumA-4lmvA:
undetectable
5vumB-4lmvA:
undetectable		 5vumA-4lmvA:
21.00
5vumB-4lmvA:
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.
5VUN_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 5vunA-4lmvA:
undetectable
5vunB-4lmvA:
undetectable		 5vunA-4lmvA:
21.00
5vunB-4lmvA:
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.
5VUO_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 5vuoA-4lmvA:
undetectable
5vuoB-4lmvA:
undetectable		 5vuoA-4lmvA:
21.00
5vuoB-4lmvA:
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.
5VUP_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 5vupA-4lmvA:
undetectable
5vupB-4lmvA:
undetectable		 5vupA-4lmvA:
21.00
5vupB-4lmvA:
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.
5VUQ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.07A 5vuqA-4lmvA:
undetectable
5vuqB-4lmvA:
undetectable		 5vuqA-4lmvA:
21.00
5vuqB-4lmvA:
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.
5VUT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.09A 5vutA-4lmvA:
undetectable
5vutB-4lmvA:
undetectable		 5vutA-4lmvA:
21.00
5vutB-4lmvA:
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.
5VUV_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 5vuvA-4lmvA:
undetectable
5vuvB-4lmvA:
undetectable		 5vuvA-4lmvA:
21.09
5vuvB-4lmvA:
21.09
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.
5VUW_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 5vuwA-4lmvA:
undetectable
5vuwB-4lmvA:
undetectable		 5vuwA-4lmvA:
21.09
5vuwB-4lmvA:
21.09
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.
5VUX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 5vuxA-4lmvA:
undetectable
5vuxB-4lmvA:
undetectable		 5vuxA-4lmvA:
21.09
5vuxB-4lmvA:
21.09
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.
5VUY_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.06A 5vuyA-4lmvA:
undetectable
5vuyB-4lmvA:
undetectable		 5vuyA-4lmvA:
21.09
5vuyB-4lmvA:
21.09
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.
5VV0_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 5vv0A-4lmvA:
undetectable
5vv0B-4lmvA:
undetectable		 5vv0A-4lmvA:
21.09
5vv0B-4lmvA:
21.09
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.
5VV1_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 6 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 5vv1A-4lmvA:
undetectable
5vv1B-4lmvA:
undetectable		 5vv1A-4lmvA:
21.09
5vv1B-4lmvA:
21.09
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.
5VV2_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 5vv2A-4lmvA:
undetectable
5vv2B-4lmvA:
undetectable		 5vv2A-4lmvA:
21.09
5vv2B-4lmvA:
21.09
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.
5VV3_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 5vv3A-4lmvA:
undetectable
5vv3B-4lmvA:
undetectable		 5vv3A-4lmvA:
21.09
5vv3B-4lmvA:
21.09
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.
5WGQ_A_ESTA601_1
(ESTROGEN RECEPTOR)		 5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3
(Arabidopsis
thaliana) 		5 / 9 ALA A 694
GLU A 697
LEU A 654
ARG A 145
GLY A 647
 None
None
None
None
FLC  A1002 (-3.3A)
 1.34A 5wgqA-5fdnA:
3.7		 5wgqA-5fdnA:
6.81
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.
5WM2_A_ACTA605_0
(SALICYLATE-AMP
LIGASE)		 5x9r CITRATE-SODIUM
SYMPORTER
(Klebsiella
pneumoniae) 		3 / 3 THR A 349
THR A 217
ARG A 402
 None
None
FLC  A 501 (-3.7A)
 1.04A 5wm2A-5x9rA:
undetectable		 5wm2A-5x9rA:
21.64
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.
5XIP_C_HFGC1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)		 5zi9 CYTOKININ RIBOSIDE
5'-MONOPHOSPHATE
PHOSPHORIBOHYDROLASE
(Streptomyces
coelicolor) 		5 / 12 GLU A 117
THR A  83
GLU A  89
THR A 179
GLY A 176
 None
None
None
FLC  A 502 ( 3.8A)
FLC  A 502 (-3.4A)
 1.26A 5xipC-5zi9A:
3.3		 5xipC-5zi9A:
undetectable
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.
5Y7P_C_CHDC401_0
(BILE SALT HYDROLASE)		 4c02 ACTIVIN RECEPTOR
TYPE-1
(Homo
sapiens) 		4 / 8 LEU A 337
ILE A 262
LEU A 489
ALA A 488
 None
None
FLC  A1505 ( 4.0A)
FLC  A1506 (-3.6A)
 0.69A 5y7pC-4c02A:
undetectable		 5y7pC-4c02A:
22.55
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.
5Y9Y_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 3blw ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT 1
(Saccharomyces
cerevisiae) 		3 / 3 ARG A 274
PHE A 136
ARG A 129
 FLC  A1001 (-3.4A)
FLC  A1001 (-4.5A)
FLC  A1001 (-3.4A)
 1.11A 5y9yA-3blwA:
undetectable		 5y9yA-3blwA:
20.32
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.
5YW0_A_ACTA409_0
(UNCHARACTERIZED
PROTEIN KDOO)		 3som METHYLMALONIC
ACIDURIA AND
HOMOCYSTINURIA TYPE
C PROTEIN
(Homo
sapiens) 		3 / 3 ASP A  77
PHE A 223
ARG A 161
 None
FLC  A 501 (-3.9A)
FLC  A 501 (-2.6A)
 0.82A 5yw0A-3somA:
undetectable		 5yw0A-3somA:
22.16
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.
5ZRD_A_CUA607_0
(TYROSINASE)		 5fq0 KDGF
(Halomonas
sp.) 		3 / 3 HIS B  48
HIS B  89
HIS B  50
 FLC  B1114 ( 3.3A)
NI  B1113 ( 3.3A)
NI  B1113 ( 3.3A)
 0.42A 5zrdA-5fq0B:
undetectable		 5zrdA-5fq0B:
11.62
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.
6AUR_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.12A 6aurA-4lmvA:
undetectable
6aurB-4lmvA:
undetectable		 6aurA-4lmvA:
15.00
6aurB-4lmvA:
15.00
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.
6AUS_B_H4BB803_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.12A 6ausA-4lmvA:
undetectable
6ausB-4lmvA:
undetectable		 6ausA-4lmvA:
15.00
6ausB-4lmvA:
15.00
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.
6AUT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.13A 6autA-4lmvA:
undetectable
6autB-4lmvA:
undetectable		 6autA-4lmvA:
15.00
6autB-4lmvA:
15.00
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.
6AUX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 PHE A   7
GLU A  42
ARG A  29
VAL A  73
 None
None
None
FLC  A 300 (-4.1A)
 1.10A 6auxA-4lmvA:
undetectable
6auxB-4lmvA:
undetectable		 6auxA-4lmvA:
15.00
6auxB-4lmvA:
15.00
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.
6AUY_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.09A 6auyA-4lmvA:
undetectable
6auyB-4lmvA:
undetectable		 6auyA-4lmvA:
14.69
6auyB-4lmvA:
14.69
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.
6AUZ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 6auzA-4lmvA:
undetectable
6auzB-4lmvA:
undetectable		 6auzA-4lmvA:
14.69
6auzB-4lmvA:
14.69
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.
6AV1_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.04A 6av1A-4lmvA:
undetectable
6av1B-4lmvA:
undetectable		 6av1A-4lmvA:
14.69
6av1B-4lmvA:
14.69
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.
6AV2_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 6av2A-4lmvA:
undetectable
6av2B-4lmvA:
undetectable		 6av2A-4lmvA:
14.69
6av2B-4lmvA:
14.69
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.
6AV3_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.11A 6av3A-4lmvA:
undetectable
6av3B-4lmvA:
undetectable		 6av3A-4lmvA:
14.69
6av3B-4lmvA:
14.69
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.
6AV4_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4lmv GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 7 ARG A  29
VAL A  73
PHE A   7
GLU A  42
 None
FLC  A 300 (-4.1A)
None
None
 1.10A 6av4A-4lmvA:
undetectable
6av4B-4lmvA:
undetectable		 6av4A-4lmvA:
14.69
6av4B-4lmvA:
14.69
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.
6B5Y_B_9F2B400_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.66A 6b5yB-5ctmA:
18.0		 6b5yB-5ctmA:
13.45
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.
6B5Y_D_9F2D400_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.71A 6b5yD-5ctmA:
18.0		 6b5yD-5ctmA:
13.45
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.
6B68_B_9F2B301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.55A 6b68B-5ctmA:
18.0		 6b68B-5ctmA:
13.45
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.
6B68_D_9F2D400_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		5 / 12 SER A 101
SER A 149
LYS A 239
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.2A)
None
 0.61A 6b68D-5ctmA:
17.4		 6b68D-5ctmA:
13.45
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.
6B69_B_9F2B301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.60A 6b69A-5ctmA:
17.9
6b69B-5ctmA:
17.3		 6b69A-5ctmA:
13.45
6b69B-5ctmA:
13.45
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.
6B69_D_9F2D301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.61A 6b69D-5ctmA:
17.9		 6b69D-5ctmA:
13.45
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.
6B6A_B_9F2B301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.59A 6b6aB-5ctmA:
18.0		 6b6aB-5ctmA:
13.45
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.
6B6A_D_9F2D301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.59A 6b6aD-5ctmA:
17.8		 6b6aD-5ctmA:
13.45
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.
6B6C_A_9F2A301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.69A 6b6cA-5ctmA:
17.8		 6b6cA-5ctmA:
13.45
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.
6B6D_A_9F2A302_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.46A 6b6dA-5ctmA:
17.7		 6b6dA-5ctmA:
13.45
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.
6B6E_A_9F2A302_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		6 / 12 SER A 101
SER A 149
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.67A 6b6eA-5ctmA:
18.0		 6b6eA-5ctmA:
13.45
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.
6B6F_A_9F2A301_1
(BETA-LACTAMASE)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		5 / 12 SER A 101
LYS A 239
THR A 240
GLY A 241
GLY A 243
 KCX  A 104 (-2.2A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.8A)
FLC  A 301 (-3.2A)
None
 0.43A 6b6fA-5ctmA:
17.6		 6b6fA-5ctmA:
13.45
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 3d6n ASPARTATE
CARBAMOYLTRANSFERASE
(Aquifex
aeolicus) 		4 / 7 SER B  45
HIS B 126
GLY B 120
ARG B 282
 FLC  B 292 ( 4.5A)
FLC  B 292 (-4.0A)
None
None
 1.04A 6btxA-3d6nB:
undetectable		 6btxA-3d6nB:
22.47
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.
6C79_A_CE3A301_1
(BETA-LACTAMASE
TOHO-1)		 5ctm BETA-LACTAMASE
(Bacillus
pumilus) 		5 / 12 SER A 149
LYS A 239
GLY A 241
SER A 242
GLY A 243
 FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.2A)
FLC  A 301 (-2.8A)
None
 0.67A 6c79A-5ctmA:
18.9		 6c79A-5ctmA:
14.77
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		4 / 5 HIS A  34
ASP A 161
HIS A  58
ARG A 158
 FE  A 202 ( 3.3A)
FE  A 202 ( 2.5A)
FE  A 202 (-3.3A)
FLC  A 203 (-3.0A)
 1.50A 6dchA-4n6wA:
undetectable		 6dchA-4n6wA:
21.45
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 4n6w PREDICTED HD
PHOSPHOHYDROLASE
PHNZ
(uncultured
bacterium
HF130_AEPn_1) 		4 / 5 THR A 129
HIS A  80
ASP A  59
HIS A 104
 FLC  A 203 (-3.2A)
FE  A 201 ( 3.4A)
FE  A 202 (-2.6A)
FE  A 201 ( 3.4A)
 0.94A 6dchA-4n6wA:
undetectable		 6dchA-4n6wA:
21.45
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.
6EXI_C_ADNC502_0
(ADENOSYLHOMOCYSTEINA
SE)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 12 THR A 124
ASP A 305
HIS A 180
ASN A  95
HIS A  63
 None
FLC  A 424 ( 2.7A)
FLC  A 424 (-4.0A)
FLC  A 424 (-3.6A)
ZN  A 423 ( 3.4A)
 1.27A 6exiC-3d6nA:
undetectable		 6exiC-3d6nA:
15.70
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.
6EXI_D_ADND502_0
(ADENOSYLHOMOCYSTEINA
SE)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 12 THR A 124
ASP A 305
HIS A 180
ASN A  95
HIS A  63
 None
FLC  A 424 ( 2.7A)
FLC  A 424 (-4.0A)
FLC  A 424 (-3.6A)
ZN  A 423 ( 3.4A)
 1.22A 6exiD-3d6nA:
undetectable		 6exiD-3d6nA:
15.70
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.
6GNG_B_QPSB601_1
(-)		 3d6n DIHYDROOROTASE
(Aquifex
aeolicus) 		5 / 12 THR A  96
THR A 126
HIS A 306
PRO A 176
GLY A 323
 None
None
None
None
FLC  A 424 (-3.2A)
 1.30A 6gngB-3d6nA:
undetectable		 6gngB-3d6nA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HIS_A_TKTA508_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 3A)		 5z7h LYSR FAMILY
TRANSCRIPTIONAL
REGULATOR
(Staphylococcus
aureus) 		4 / 8 ASP A 185
ILE A 187
ARG A 256
TYR A 204
 None
None
FLC  A 301 (-3.6A)
None
 1.25A 6hisA-5z7hA:
undetectable
6hisB-5z7hA:
undetectable		 6hisA-5z7hA:
22.99
6hisB-5z7hA:
22.99
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.
6HIS_B_TKTB508_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 3A)		 5z7h LYSR FAMILY
TRANSCRIPTIONAL
REGULATOR
(Staphylococcus
aureus) 		4 / 8 ASP A 185
ILE A 187
ARG A 256
TYR A 204
 None
None
FLC  A 301 (-3.6A)
None
 1.25A 6hisB-5z7hA:
undetectable
6hisC-5z7hA:
undetectable		 6hisB-5z7hA:
22.99
6hisC-5z7hA:
22.99
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.
6HIS_D_TKTD501_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 3A)		 5z7h LYSR FAMILY
TRANSCRIPTIONAL
REGULATOR
(Staphylococcus
aureus) 		4 / 8 ASP A 185
ILE A 187
ARG A 256
TYR A 204
 None
None
FLC  A 301 (-3.6A)
None
 1.25A 6hisD-5z7hA:
undetectable
6hisE-5z7hA:
undetectable		 6hisD-5z7hA:
22.99
6hisE-5z7hA:
22.99
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.
6HLP_A_GAWA1501_0
(SUBSTANCE-P
RECEPTOR,SUBSTANCE-P
RECEPTOR)		 5ltg AUTOPHAGY-RELATED
PROTEIN 18
(Ogataea
angusta) 		5 / 12 ILE A 270
THR A 239
ILE A 247
HIS A 221
PRO A 179
 None
None
None
FLC  A 602 (-3.8A)
None
 1.07A 6hlpA-5ltgA:
undetectable		 6hlpA-5ltgA:
22.70
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.
6MN4_A_AM2A301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 5aga DNA POLYMERASE THETA
(Homo
sapiens) 		4 / 8 HIS A 365
ARG A 438
HIS A 338
GLU A 383
 FLC  A1893 ( 4.5A)
FLC  A1893 ( 4.9A)
None
None
 1.18A 6mn4A-5agaA:
undetectable		 6mn4A-5agaA:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_B_AM2B301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 5aga DNA POLYMERASE THETA
(Homo
sapiens) 		4 / 8 HIS A 365
ARG A 438
HIS A 338
GLU A 383
 FLC  A1893 ( 4.5A)
FLC  A1893 ( 4.9A)
None
None
 1.24A 6mn4B-5agaA:
undetectable		 6mn4B-5agaA:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_F_AM2F301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 5z7h LYSR FAMILY
TRANSCRIPTIONAL
REGULATOR
(Staphylococcus
aureus) 		4 / 7 ARG A 256
HIS A 162
ASP A 185
GLU A 130
 FLC  A 301 (-3.6A)
None
None
FLC  A 301 (-3.6A)
 1.29A 6mn4F-5z7hA:
undetectable		 6mn4F-5z7hA:
undetectable
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.
6QGB_D_BEZD701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 5hvf CARBOXYPEPTIDASE B2
(Homo
sapiens) 		5 / 10 GLY A 347
SER A 286
ALA A 343
ARG A 235
HIS A 288
 None
None
FLC  A 509 (-3.2A)
FLC  A 509 (-2.8A)
ZN  A 508 (-3.1A)
 1.47A 6qgbD-5hvfA:
3.0		 6qgbD-5hvfA:
19.97