SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '144'


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.
1A4L_B_DCFB853_2
(ADENOSINE DEAMINASE)		 2y77 3-DEHYDROQUINATE
DEHYDRATASE
(Mycobacterium
tuberculosis) 		4 / 5 LEU A  13
SER A 115
LEU A 117
GLY A  77
 CB8  A1144 (-4.5A)
None
None
CB8  A1144 (-3.4A)
 1.14A 1a4lB-2y77A:
undetectable		 1a4lB-2y77A:
16.52
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.
1C9S_C_TRPC81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 1c9sB-4bv6A:
undetectable
1c9sC-4bv6A:
undetectable		 1c9sB-4bv6A:
9.71
1c9sC-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C9S_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.31A 1c9sG-4bv6A:
undetectable
1c9sH-4bv6A:
undetectable		 1c9sG-4bv6A:
9.71
1c9sH-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C9S_J_TRPJ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 1c9sI-5fulA:
undetectable
1c9sJ-5fulA:
undetectable		 1c9sI-5fulA:
10.25
1c9sJ-5fulA:
10.25
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.
1C9S_L_TRPL81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.30A 1c9sL-4a0sA:
undetectable
1c9sM-4a0sA:
undetectable		 1c9sL-4a0sA:
10.76
1c9sM-4a0sA:
10.76
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.
1C9S_M_TRPM81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.30A 1c9sM-4a0sA:
undetectable
1c9sN-4a0sA:
undetectable		 1c9sM-4a0sA:
10.76
1c9sN-4a0sA:
10.76
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.
1C9S_R_TRPR81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 1c9sR-4a0sA:
undetectable
1c9sS-4a0sA:
undetectable		 1c9sR-4a0sA:
10.76
1c9sS-4a0sA:
10.76
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.
1C9S_S_TRPS81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 1c9sS-4a0sA:
undetectable
1c9sT-4a0sA:
undetectable		 1c9sS-4a0sA:
10.76
1c9sT-4a0sA:
10.76
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.
1C9S_T_TRPT81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 7 GLY A 161
HIS A 187
THR A 188
SER A 182
 None
None
None
SAH  A1446 ( 4.4A)
 0.83A 1c9sT-5fulA:
undetectable
1c9sU-5fulA:
undetectable		 1c9sT-5fulA:
10.25
1c9sU-5fulA:
10.25
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.
1C9S_U_TRPU81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 GLY A 161
HIS A 187
THR A 188
SER A 182
 None
None
None
SAH  A1446 ( 4.4A)
 0.81A 1c9sU-5fulA:
undetectable
1c9sV-5fulA:
undetectable		 1c9sU-5fulA:
10.25
1c9sV-5fulA:
10.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1CTR_A_TFPA153_1
(CALMODULIN)		 4gow CALMODULIN
(Homo
sapiens) 		6 / 9 ILE D 100
GLU D 123
GLU D 127
ALA D 128
VAL D 136
MET D 144
 ILE  D 100 ( 0.7A)
GLU  D 123 ( 0.6A)
GLU  D 127 ( 0.6A)
ALA  D 128 ( 0.0A)
VAL  D 136 ( 0.6A)
MET  D 144 ( 0.0A)
 1.27A 1ctrA-4gowD:
17.2		 1ctrA-4gowD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1CTR_A_TFPA153_1
(CALMODULIN)		 4gow CALMODULIN
(Homo
sapiens) 		6 / 9 ILE D 100
LEU D 105
GLU D 127
ALA D 128
VAL D 136
MET D 144
 ILE  D 100 ( 0.7A)
LEU  D 105 ( 0.6A)
GLU  D 127 ( 0.6A)
ALA  D 128 ( 0.0A)
VAL  D 136 ( 0.6A)
MET  D 144 ( 0.0A)
 1.00A 1ctrA-4gowD:
17.2		 1ctrA-4gowD:
100.00
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.
1DDR_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		5 / 12 ALA A 218
THR A 121
SER A 124
ILE A 125
LEU A 136
 DLL  A1441 ( 3.7A)
None
None
None
None
 0.88A 1ddrA-2y4oA:
undetectable		 1ddrA-2y4oA:
16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		6 / 12 TYR A 667
ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 BGC  A2144 (-4.5A)
None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.80A 1dedB-2ya1A:
22.3		 1dedB-2ya1A:
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.
1DHF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 ILE A 150
ALA A 148
ILE A 301
PRO A 300
LEU A 305
 PG4  A1443 ( 4.1A)
None
None
None
None
 1.12A 1dhfA-2veoA:
undetectable		 1dhfA-2veoA:
17.65
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.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 ILE A 150
ALA A 148
ILE A 301
PRO A 300
LEU A 305
 PG4  A1443 ( 4.1A)
None
None
None
None
 1.11A 1dlsA-2veoA:
undetectable		 1dlsA-2veoA:
17.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DTL_A_BEPA204_1
(CARDIAC TROPONIN C)		 4gow CALMODULIN
(Homo
sapiens) 		6 / 11 ILE D 100
LEU D 105
MET D 109
LEU D 112
MET D 124
MET D 144
 ILE  D 100 ( 0.7A)
LEU  D 105 ( 0.6A)
MET  D 109 ( 0.0A)
LEU  D 112 ( 0.6A)
MET  D 124 ( 0.0A)
MET  D 144 ( 0.0A)
 0.96A 1dtlA-4gowD:
12.2		 1dtlA-4gowD:
53.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DTL_A_BEPA204_1
(CARDIAC TROPONIN C)		 4gow CALMODULIN
(Homo
sapiens) 		6 / 11 PHE D  92
ILE D 100
LEU D 105
LEU D 112
MET D 124
MET D 144
 PHE  D  92 ( 1.3A)
ILE  D 100 ( 0.7A)
LEU  D 105 ( 0.6A)
LEU  D 112 ( 0.6A)
MET  D 124 ( 0.0A)
MET  D 144 ( 0.0A)
 0.79A 1dtlA-4gowD:
12.2		 1dtlA-4gowD:
53.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		12 / 12 ALA A 156
TYR A 158
TYR A 184
ASP A 186
SER A 187
GLN A 188
GLU A 225
ASP A 227
GLU A 230
THR A 259
ARG A 264
ASP A 382
 None
None
None
None
None
None
None
None
None
PEG  A1445 (-3.5A)
PEG  A1445 (-3.3A)
None
 0.48A 1dy4A-2yokA:
69.7		 1dy4A-2yokA:
82.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		12 / 12 ALA A 143
TYR A 145
TYR A 171
ASP A 173
SER A 174
GLN A 175
GLU A 212
ASP A 214
GLU A 217
THR A 246
ARG A 251
ASP A 376
 None
None
None
None
None
U63  A1443 (-4.4A)
None
None
U63  A1443 ( 4.3A)
U63  A1443 (-4.0A)
U63  A1443 (-3.0A)
U63  A1443 ( 4.9A)
 0.34A 1dy4A-4v20A:
65.2		 1dy4A-4v20A:
64.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)		 5w0a GLUCANASE
(Trichoderma
harzianum) 		8 / 12 ALA A 144
TYR A 146
TYR A 170
ASP A 172
GLN A 174
GLU A 196
ASP A 198
GLU A 201
 ALA  A 144 ( 0.0A)
TYR  A 146 ( 1.3A)
TYR  A 170 ( 1.3A)
ASP  A 172 ( 0.5A)
GLN  A 174 ( 0.5A)
GLU  A 196 ( 0.6A)
ASP  A 198 (-0.6A)
GLU  A 201 (-0.5A)
 0.36A 1dy4A-5w0aA:
48.5		 1dy4A-5w0aA:
11.70
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.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)		 5w0a GLUCANASE
(Trichoderma
harzianum) 		6 / 12 ALA A 144
TYR A 146
TYR A 170
ASP A 198
GLU A 201
ASP A 322
 ALA  A 144 ( 0.0A)
TYR  A 146 ( 1.3A)
TYR  A 170 ( 1.3A)
ASP  A 198 (-0.6A)
GLU  A 201 (-0.5A)
ASP  A 322 ( 0.6A)
 0.76A 1dy4A-5w0aA:
48.5		 1dy4A-5w0aA:
11.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DY4_A_SNPA437_2
(EXOGLUCANASE 1)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 5 HIS A 228
TRP A 374
ALA A 379
TRP A 383
 U63  A1443 (-4.2A)
None
U63  A1443 ( 4.9A)
U63  A1443 (-3.6A)
 0.35A 1dy4A-4v20A:
65.2		 1dy4A-4v20A:
64.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DZ8_A_CAMA503_0
(CYTOCHROME P450-CAM)		 4b3v E1 ENVELOPE
GLYCOPROTEIN
(Rubella
virus) 		5 / 9 PHE A 102
TYR A 109
THR A  55
GLY A  94
VAL A 138
 None
None
PEG  A1449 ( 4.2A)
PEG  A1449 ( 3.4A)
CA  A1451 ( 4.6A)
 1.29A 1dz8A-4b3vA:
undetectable		 1dz8A-4b3vA:
21.12
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.
1DZ8_B_CAMB502_0
(CYTOCHROME P450-CAM)		 4b3v E1 ENVELOPE
GLYCOPROTEIN
(Rubella
virus) 		5 / 9 PHE A 102
TYR A 109
THR A  55
GLY A  94
VAL A 138
 None
None
PEG  A1449 ( 4.2A)
PEG  A1449 ( 3.4A)
CA  A1451 ( 4.6A)
 1.25A 1dz8B-4b3vA:
undetectable		 1dz8B-4b3vA:
21.12
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.
1DZ9_B_CAMB502_0
(CYTOCHROME P450-CAM)		 4b3v E1 ENVELOPE
GLYCOPROTEIN
(Rubella
virus) 		5 / 9 PHE A 102
TYR A 109
THR A  55
GLY A  94
VAL A 138
 None
None
PEG  A1449 ( 4.2A)
PEG  A1449 ( 3.4A)
CA  A1451 ( 4.6A)
 1.26A 1dz9B-4b3vA:
undetectable		 1dz9B-4b3vA:
21.12
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.
1DZM_A_BZMA600_0
(ODORANT-BINDING
PROTEIN)		 4jbe GAMMA-GLUTAMYL
PHOSPHATE REDUCTASE
(Saccharomonospor
a
viridis) 		4 / 8 ILE A 205
ASN A 144
GLY A 122
LEU A 148
 ILE  A 205 ( 0.7A)
ASN  A 144 ( 0.6A)
GLY  A 122 ( 0.0A)
LEU  A 148 ( 0.5A)
 0.98A 1dzmA-4jbeA:
undetectable		 1dzmA-4jbeA:
13.71
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.
1E06_B_IPBB600_0
(ODORANT-BINDING
PROTEIN)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		4 / 4 ILE A 295
MET A 236
VAL A 151
GLY A 175
 None
None
A2G  A1446 (-4.9A)
None
 1.35A 1e06B-2ixbA:
undetectable		 1e06B-2ixbA:
18.69
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.
1E7B_B_HLTB4003_1
(SERUM ALBUMIN)		 5crc SDEA
(Legionella
pneumophila) 		4 / 6 VAL A 144
GLY A 145
ALA A 129
LEU A 133
 VAL  A 144 ( 0.6A)
GLY  A 145 ( 0.0A)
ALA  A 129 ( 0.0A)
LEU  A 133 ( 0.6A)
 0.78A 1e7bB-5crcA:
undetectable		 1e7bB-5crcA:
13.60
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.
1E7C_A_HLTA4007_1
(SERUM ALBUMIN)		 2qvs CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-ALPHA REGULATORY
SUBUNIT
(Mus
musculus) 		4 / 8 ASN B 240
ASP B 140
LEU B 144
LEU B 139
 ASN  B 240 ( 0.6A)
ASP  B 140 ( 0.5A)
LEU  B 144 ( 0.6A)
LEU  B 139 ( 0.6A)
 1.00A 1e7cA-2qvsB:
undetectable		 1e7cA-2qvsB:
18.57
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.
1EIZ_A_SAMA301_0
(FTSJ)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 12 GLY A 372
GLY A 224
GLY A 226
LEU A 368
PHE A 348
 None
None
None
SFE  A1447 (-4.9A)
None
 0.94A 1eizA-2ykyA:
2.5		 1eizA-2ykyA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EJ0_A_SAMA301_0
(FTSJ)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 12 GLY A 372
GLY A 224
GLY A 226
LEU A 368
PHE A 348
 None
None
None
SFE  A1447 (-4.9A)
None
 0.92A 1ej0A-2ykyA:
2.7		 1ej0A-2ykyA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQB_A_GLYA1292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		4 / 8 SER A 402
LYS A 412
TYR A  61
PHE A  34
 None
PO4  A1442 (-3.2A)
PO4  A1442 (-4.5A)
None
 1.05A 1eqbA-5g4iA:
20.2
1eqbB-5g4iA:
20.6		 1eqbA-5g4iA:
24.15
1eqbB-5g4iA:
24.15
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.
1EQB_B_GLYB2292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		4 / 8 TYR A  61
PHE A  34
SER A 402
LYS A 412
 PO4  A1442 (-4.5A)
None
None
PO4  A1442 (-3.2A)
 1.06A 1eqbA-5g4iA:
20.2
1eqbB-5g4iA:
20.6		 1eqbA-5g4iA:
24.15
1eqbB-5g4iA:
24.15
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.
1EQB_C_GLYC3292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		4 / 8 SER A 402
LYS A 412
TYR A  61
PHE A  34
 None
PO4  A1442 (-3.2A)
PO4  A1442 (-4.5A)
None
 1.05A 1eqbC-5g4iA:
21.0
1eqbD-5g4iA:
20.8		 1eqbC-5g4iA:
24.15
1eqbD-5g4iA:
24.15
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.
1EQB_D_GLYD4292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		4 / 8 TYR A  61
PHE A  34
SER A 402
LYS A 412
 PO4  A1442 (-4.5A)
None
None
PO4  A1442 (-3.2A)
 1.06A 1eqbC-5g4iA:
21.0
1eqbD-5g4iA:
20.8		 1eqbC-5g4iA:
24.15
1eqbD-5g4iA:
24.15
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.
1FOH_A_IPHA802_0
(PHENOL HYDROXYLASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.26A 1fohA-5jb36:
undetectable		 1fohA-5jb36:
10.54
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.
1FOH_B_IPHB802_0
(PHENOL HYDROXYLASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.31A 1fohB-5jb36:
undetectable		 1fohB-5jb36:
10.54
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.
1FOH_C_IPHC802_0
(PHENOL HYDROXYLASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.33A 1fohC-5jb36:
undetectable		 1fohC-5jb36:
10.54
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.
1FOH_D_IPHD802_0
(PHENOL HYDROXYLASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.31A 1fohD-5jb36:
undetectable		 1fohD-5jb36:
10.54
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.
1FSL_A_NIOA145_1
(LEGHEMOGLOBIN A)		 1dly HEMOGLOBIN
(Chlamydomonas
moewusii) 		5 / 8 PHE A  19
TYR A  20
ILE A  23
PHE A  33
VAL A  83
 None
CYN  A 122 (-4.3A)
None
HEM  A 144 ( 4.4A)
HEM  A 144 (-4.3A)
 0.94A 1fslA-1dlyA:
8.2		 1fslA-1dlyA:
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.
1FSL_B_NIOB145_1
(LEGHEMOGLOBIN A)		 1dly HEMOGLOBIN
(Chlamydomonas
moewusii) 		4 / 8 PHE A  19
TYR A  20
ILE A  23
VAL A  83
 None
CYN  A 122 (-4.3A)
None
HEM  A 144 (-4.3A)
 0.58A 1fslB-1dlyA:
8.6		 1fslB-1dlyA:
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.
1GMK_D_DVAD8_0
(GRAMICIDIN A)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		3 / 3 TRP A 144
VAL A 200
TRP A 203
 GOL  A1449 (-4.2A)
None
GOL  A1449 (-4.3A)
 1.26A 1gmkC-2wnwA:
undetectable
1gmkD-2wnwA:
undetectable		 1gmkC-2wnwA:
3.04
1gmkD-2wnwA:
3.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GSF_A_EAAA223_1
(GLUTATHIONE
TRANSFERASE A1-1)		 1igw ISOCITRATE LYASE
(Escherichia
coli) 		4 / 8 TYR A 112
GLY A  92
VAL A 183
PHE A 162
 None
PYR  A1444 (-3.7A)
None
None
 1.20A 1gsfA-1igwA:
0.0		 1gsfA-1igwA:
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.
1GSF_B_EAAB223_1
(GLUTATHIONE
TRANSFERASE A1-1)		 1igw ISOCITRATE LYASE
(Escherichia
coli) 		4 / 8 TYR A 112
GLY A  92
VAL A 183
PHE A 162
 None
PYR  A1444 (-3.7A)
None
None
 1.21A 1gsfB-1igwA:
0.0		 1gsfB-1igwA:
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.
1GSF_D_EAAD223_1
(GLUTATHIONE
TRANSFERASE A1-1)		 1igw ISOCITRATE LYASE
(Escherichia
coli) 		4 / 8 TYR A 112
GLY A  92
VAL A 183
PHE A 162
 None
PYR  A1444 (-3.7A)
None
None
 1.20A 1gsfD-1igwA:
0.0		 1gsfD-1igwA:
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.
1GTF_B_TRPB81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 1gtfA-4a0sA:
undetectable
1gtfB-4a0sA:
undetectable		 1gtfA-4a0sA:
10.76
1gtfB-4a0sA:
10.76
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.
1GTF_D_TRPD81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 1gtfC-4bv6A:
undetectable
1gtfD-4bv6A:
undetectable		 1gtfC-4bv6A:
9.71
1gtfD-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.29A 1gtfG-4bv6A:
undetectable
1gtfH-4bv6A:
undetectable		 1gtfG-4bv6A:
9.71
1gtfH-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_I_TRPI81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.30A 1gtfH-4bv6A:
undetectable
1gtfI-4bv6A:
undetectable		 1gtfH-4bv6A:
9.71
1gtfI-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_L_TRPL81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 7 GLY A 161
HIS A 187
THR A 188
SER A 182
 None
None
None
SAH  A1446 ( 4.4A)
 0.78A 1gtfL-5fulA:
undetectable
1gtfM-5fulA:
undetectable		 1gtfL-5fulA:
10.25
1gtfM-5fulA:
10.25
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.
1GTF_M_TRPM81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.30A 1gtfM-4a0sA:
undetectable
1gtfN-4a0sA:
undetectable		 1gtfM-4a0sA:
10.76
1gtfN-4a0sA:
10.76
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.
1GTF_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 8 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 1gtfN-4a0sA:
undetectable
1gtfO-4a0sA:
undetectable		 1gtfN-4a0sA:
10.76
1gtfO-4a0sA:
10.76
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.
1GTF_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 GLY A 161
HIS A 187
THR A 188
SER A 182
 None
None
None
SAH  A1446 ( 4.4A)
 0.79A 1gtfN-5fulA:
undetectable
1gtfO-5fulA:
undetectable		 1gtfN-5fulA:
10.25
1gtfO-5fulA:
10.25
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.
1GTF_O_TRPO81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 1gtfO-4a0sA:
undetectable
1gtfP-4a0sA:
undetectable		 1gtfO-4a0sA:
10.76
1gtfP-4a0sA:
10.76
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.
1GTF_P_TRPP81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 1gtfP-4a0sA:
undetectable
1gtfQ-4a0sA:
undetectable		 1gtfP-4a0sA:
10.76
1gtfQ-4a0sA:
10.76
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.
1GTF_T_TRPT81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.28A 1gtfT-4a0sA:
undetectable
1gtfU-4a0sA:
undetectable		 1gtfT-4a0sA:
10.76
1gtfU-4a0sA:
10.76
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.
1GTF_U_TRPU81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.30A 1gtfU-4a0sA:
undetectable
1gtfV-4a0sA:
undetectable		 1gtfU-4a0sA:
10.76
1gtfV-4a0sA:
10.76
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.
1GTF_U_TRPU81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 GLY A 462
HIS A 457
ALA A 259
HIS A 455
ARG A 172
 None
None
FAD  A1449 (-4.9A)
None
FAD  A1449 (-3.9A)
 1.26A 1gtfU-4bv6A:
undetectable
1gtfV-4bv6A:
undetectable		 1gtfU-4bv6A:
9.71
1gtfV-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_V_TRPV81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 1gtfL-4a0sA:
undetectable
1gtfV-4a0sA:
undetectable		 1gtfL-4a0sA:
10.76
1gtfV-4a0sA:
10.76
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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 5 THR A   5
LEU A  73
GLY A  75
TYR A 167
 ACT  A1444 (-3.9A)
PCA  A   1 ( 4.5A)
None
None
 1.26A 1gtiF-4v20A:
undetectable		 1gtiF-4v20A:
17.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTN_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.23A 1gtnG-4a0sA:
undetectable
1gtnH-4a0sA:
undetectable		 1gtnG-4a0sA:
10.76
1gtnH-4a0sA:
10.76
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.
1GTN_L_TRPL81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 1gtnL-4a0sA:
undetectable
1gtnM-4a0sA:
undetectable		 1gtnL-4a0sA:
10.76
1gtnM-4a0sA:
10.76
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.
1GTN_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 1gtnN-4a0sA:
undetectable
1gtnO-4a0sA:
undetectable		 1gtnN-4a0sA:
10.76
1gtnO-4a0sA:
10.76
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.
1GTN_O_TRPO81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 1gtnO-4a0sA:
undetectable
1gtnP-4a0sA:
undetectable		 1gtnO-4a0sA:
10.76
1gtnP-4a0sA:
10.76
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.
1GTN_Q_TRPQ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 1gtnQ-4a0sA:
undetectable
1gtnR-4a0sA:
undetectable		 1gtnQ-4a0sA:
10.76
1gtnR-4a0sA:
10.76
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.
1GTN_R_TRPR81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.34A 1gtnR-4a0sA:
undetectable
1gtnS-4a0sA:
undetectable		 1gtnR-4a0sA:
10.76
1gtnS-4a0sA:
10.76
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.
1GTN_S_TRPS81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 1gtnS-4a0sA:
undetectable
1gtnT-4a0sA:
undetectable		 1gtnS-4a0sA:
10.76
1gtnT-4a0sA:
10.76
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.
1GXS_A_BEZA601_0
(P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		4 / 7 GLY A 204
ASP A 221
SER A 195
HIS A  62
 None
ZN  A1446 (-2.2A)
None
ZN  A1446 (-3.3A)
 1.00A 1gxsA-1yloA:
3.3
1gxsB-1yloA:
undetectable		 1gxsA-1yloA:
21.27
1gxsB-1yloA:
19.82
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.
1GXS_A_BEZA601_0
(P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		4 / 7 GLY A 205
ASP A 221
SER A 195
HIS A  62
 None
ZN  A1446 (-2.2A)
None
ZN  A1446 (-3.3A)
 0.71A 1gxsA-1yloA:
3.3
1gxsB-1yloA:
undetectable		 1gxsA-1yloA:
21.27
1gxsB-1yloA:
19.82
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.
1HA2_A_SWFA3001_1
(SERUM ALBUMIN)		 1spg HEMOGLOBIN
(Leiostomus
xanthurus) 		5 / 11 ALA A 137
LEU A 138
LEU A 134
ILE A  64
ALA A  67
 None
HEM  A 144 ( 4.9A)
None
CMO  A 145 ( 4.0A)
HEM  A 144 (-3.4A)
 0.98A 1ha2A-1spgA:
undetectable		 1ha2A-1spgA:
14.78
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))		 3kv0 HET-C2
(Podospora
anserina) 		4 / 6 HIS A 147
LEU A 143
PHE A 155
VAL A 151
 None
MLY  A 144 ( 4.3A)
None
MLY  A 152 ( 3.2A)
 1.00A 1ibgH-3kv0A:
undetectable		 1ibgH-3kv0A:
17.17
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.
1IEP_A_STIA201_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		4 / 6 VAL A 196
VAL A 188
ILE A 211
ARG A 268
 None
None
None
GOL  A1441 ( 4.1A)
 1.14A 1iepA-2w38A:
undetectable		 1iepA-2w38A:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J36_A_LPRA801_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		5 / 12 HIS A 230
GLU A 231
HIS A 234
GLU A 268
TYR A 373
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
ZN  A1440 (-2.1A)
None
 0.85A 1j36A-3zuqA:
5.2		 1j36A-3zuqA:
20.13
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.
1J36_B_LPRB802_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		5 / 12 HIS A 230
GLU A 231
HIS A 234
GLU A 268
TYR A 373
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
ZN  A1440 (-2.1A)
None
 0.85A 1j36B-3zuqA:
5.2		 1j36B-3zuqA:
20.13
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.
1J37_A_X8ZA801_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		5 / 11 HIS A 230
GLU A 231
HIS A 234
GLU A 268
TYR A 373
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
ZN  A1440 (-2.1A)
None
 0.81A 1j37A-3zuqA:
5.1		 1j37A-3zuqA:
20.13
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.
1J37_B_X8ZB802_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		5 / 11 HIS A 230
GLU A 231
HIS A 234
GLU A 268
TYR A 373
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
ZN  A1440 (-2.1A)
None
 0.82A 1j37B-3zuqA:
5.1		 1j37B-3zuqA:
20.13
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.
1KIA_B_SAMB1293_0
(GLYCINE
N-METHYLTRANSFERASE)		 1igw ISOCITRATE LYASE
(Escherichia
coli) 		5 / 12 VAL A 120
ALA A 182
MET A 175
GLY A  92
TYR A 112
 None
None
None
PYR  A1444 (-3.7A)
None
 1.15A 1kiaB-1igwA:
undetectable		 1kiaB-1igwA:
21.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1LH6_A_NIOA155_1
(LEGHEMOGLOBIN A
(NICOTINATE MET))		 1fsl LEGHEMOGLOBIN A
(Glycine
max) 		5 / 7 PHE A  29
PHE A  44
PHE A  46
HIS A  61
HIS A  92
 NIO  A 145 ( 4.9A)
HEM  A 144 ( 3.8A)
NIO  A 145 (-4.8A)
HEM  A 144 ( 3.6A)
HEM  A 144 (-3.4A)
 0.89A 1lh6A-1fslA:
19.4		 1lh6A-1fslA:
55.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1LXF_C_BEPC92_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 4gow CALMODULIN
(Homo
sapiens) 		7 / 12 LEU D 105
MET D 109
MET D 124
ILE D 125
VAL D 136
MET D 144
MET D 145
 LEU  D 105 ( 0.6A)
MET  D 109 ( 0.0A)
MET  D 124 ( 0.0A)
ILE  D 125 ( 0.4A)
VAL  D 136 ( 0.6A)
MET  D 144 ( 0.0A)
MET  D 145 ( 0.0A)
 1.31A 1lxfC-4gowD:
9.8		 1lxfC-4gowD:
67.50
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.
1MIC_A_DVAA6_0
(GRAMICIDIN A)		 1spg HEMOGLOBIN
(Leiostomus
xanthurus) 		3 / 3 ALA A  62
VAL A  57
TRP A  46
 None
None
HEM  A 144 (-4.2A)
 0.89A 1micA-1spgA:
undetectable
1micB-1spgA:
undetectable		 1micA-1spgA:
7.63
1micB-1spgA:
7.63
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.
1MRL_B_DOLB301_1
(STREPTOGRAMIN A
ACETYLTRANSFERASE)		 4ags THIOL-DEPENDENT
REDUCTASE 1
(Leishmania
infantum) 		5 / 12 ILE A 301
PRO A 281
LEU A 234
VAL A 391
TYR A 436
 None
GSH  A1449 (-4.4A)
None
None
None
 1.43A 1mrlB-4agsA:
undetectable
1mrlC-4agsA:
undetectable		 1mrlB-4agsA:
16.67
1mrlC-4agsA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MXD_A_ACRA735_1
(ALPHA AMYLASE)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		7 / 12 TYR A 667
HIS A 715
ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 BGC  A2144 (-4.5A)
BGC  A2144 (-4.2A)
None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.58A 1mxdA-2ya1A:
19.0		 1mxdA-2ya1A:
18.88
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.
1N2X_B_SAMB402_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		5 / 12 GLY A  28
GLY A  26
GLY A  25
ASP A  30
GLY A 362
 None
EDO  A1448 (-3.2A)
EDO  A1448 ( 4.9A)
None
None
 0.77A 1n2xB-4a35A:
undetectable		 1n2xB-4a35A:
21.15
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.
1NBI_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 THR A 381
ALA A 421
GLY A 262
HIS A 195
TYR A 229
 MN  A1441 ( 3.5A)
None
None
None
None
 1.26A 1nbiC-2bwsA:
undetectable		 1nbiC-2bwsA:
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.
1NBI_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 12 GLY A 159
THR A 160
ALA A 181
SER A 182
MET A 184
 SAH  A1446 ( 3.9A)
None
SAH  A1446 (-3.7A)
SAH  A1446 ( 4.4A)
None
 1.30A 1nbiC-5fulA:
6.9		 1nbiC-5fulA:
22.48
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.
1NBI_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 THR A 381
ALA A 421
GLY A 262
HIS A 195
TYR A 229
 MN  A1441 ( 3.5A)
None
None
None
None
 1.26A 1nbiD-2bwsA:
undetectable		 1nbiD-2bwsA:
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.
1NBI_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 12 GLY A 159
THR A 160
ALA A 181
SER A 182
MET A 184
 SAH  A1446 ( 3.9A)
None
SAH  A1446 (-3.7A)
SAH  A1446 ( 4.4A)
None
 1.26A 1nbiD-5fulA:
5.4		 1nbiD-5fulA:
22.48
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.
1OE1_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		3 / 3 ASP A 101
HIS A 135
HIS A  49
 FE  A 556 (-2.8A)
PO4  A1444 (-3.8A)
MN  A 555 ( 3.4A)
 0.61A 1oe1A-2xmoA:
undetectable		 1oe1A-2xmoA:
21.70
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.
1OE3_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		3 / 3 ASP A 101
HIS A 135
HIS A  49
 FE  A 556 (-2.8A)
PO4  A1444 (-3.8A)
MN  A 555 ( 3.4A)
 0.60A 1oe3A-2xmoA:
undetectable		 1oe3A-2xmoA:
21.70
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.
1PN0_A_IPHA6012_0
(PHENOL
2-MONOOXYGENASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.30A 1pn0A-5jb36:
undetectable		 1pn0A-5jb36:
11.13
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.
1PN0_B_IPHB6022_0
(PHENOL
2-MONOOXYGENASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.30A 1pn0B-5jb36:
undetectable		 1pn0B-5jb36:
11.13
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.
1PN0_C_IPHC6032_0
(PHENOL
2-MONOOXYGENASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.34A 1pn0C-5jb36:
undetectable		 1pn0C-5jb36:
11.13
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.
1PN0_D_IPHD6042_0
(PHENOL
2-MONOOXYGENASE)		 5jb3 TRANSLATION
INITIATION FACTOR 1A
(Pyrococcus
abyssi) 		5 / 10 ASP 6  65
GLY 6  64
MET 6  37
VAL 6  28
ILE 6  61
 None
None
A  21448 ( 4.0A)
None
A  21448 ( 3.4A)
 1.34A 1pn0D-5jb36:
undetectable		 1pn0D-5jb36:
11.13
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.
1Q23_B_FUAB703_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		3 / 3 VAL A  45
ALA A 194
HIS A  62
 None
None
ZN  A1446 (-3.3A)
 0.76A 1q23C-1yloA:
undetectable		 1q23C-1yloA:
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.
1Q23_C_FUAC701_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1b0b HEMOGLOBIN
(Phacoides
pectinatus) 		5 / 12 PHE A  92
PHE A  29
LEU A  32
VAL A 112
VAL A  39
 HEM  A 144 (-4.4A)
CYN  A 145 (-4.4A)
None
None
HEM  A 144 ( 3.6A)
 1.15A 1q23C-1b0bA:
undetectable		 1q23C-1b0bA:
23.44
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.
1Q23_E_FUAE706_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4cn8 PROXIMAL THREAD
MATRIX PROTEIN 1
(Mytilus
galloprovinciali
s) 		5 / 10 THR A 195
PHE A  87
LEU A  83
VAL A  80
VAL A 236
 EDO  A1448 (-3.9A)
None
None
None
None
 1.45A 1q23E-4cn8A:
undetectable		 1q23E-4cn8A:
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.
1Q23_K_FUAK712_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4cn8 PROXIMAL THREAD
MATRIX PROTEIN 1
(Mytilus
galloprovinciali
s) 		5 / 10 THR A 195
PHE A  87
LEU A  83
VAL A  80
VAL A 236
 EDO  A1448 (-3.9A)
None
None
None
None
 1.47A 1q23K-4cn8A:
undetectable		 1q23K-4cn8A:
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.
1Q23_L_FUAL710_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1b0b HEMOGLOBIN
(Phacoides
pectinatus) 		5 / 11 PHE A  92
PHE A  29
LEU A  32
VAL A 112
VAL A  39
 HEM  A 144 (-4.4A)
CYN  A 145 (-4.4A)
None
None
HEM  A 144 ( 3.6A)
 1.20A 1q23L-1b0bA:
undetectable		 1q23L-1b0bA:
23.44
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.
1QAB_E_RTLE1_0
(PROTEIN (RETINOL
BINDING PROTEIN))		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		5 / 11 PHE A  32
LEU A  98
MET A  77
LEU A  66
HIS A  81
 FMT  A1129 ( 4.9A)
None
HEM  A 144 (-3.5A)
None
HEM  A 144 ( 3.2A)
 1.41A 1qabE-5ab8A:
undetectable		 1qabE-5ab8A:
20.44
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.
1R15_C_NCAC339_0
(ADP-RIBOSYL CYCLASE)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		3 / 3 GLU A 646
ASN A 482
TRP A 481
 144  A 813 (-3.5A)
144  A 813 ( 4.9A)
144  A 813 (-3.9A)
 1.07A 1r15C-3qdeA:
undetectable		 1r15C-3qdeA:
15.89
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.
1R15_D_NCAD349_0
(ADP-RIBOSYL CYCLASE)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		3 / 3 GLU A 646
ASN A 482
TRP A 481
 144  A 813 (-3.5A)
144  A 813 ( 4.9A)
144  A 813 (-3.9A)
 1.10A 1r15D-3qdeA:
undetectable		 1r15D-3qdeA:
15.89
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.
1R15_E_NCAE359_0
(ADP-RIBOSYL CYCLASE)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		3 / 3 GLU A 646
ASN A 482
TRP A 481
 144  A 813 (-3.5A)
144  A 813 ( 4.9A)
144  A 813 (-3.9A)
 1.09A 1r15E-3qdeA:
undetectable		 1r15E-3qdeA:
15.89
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.
1R15_F_NCAF369_0
(ADP-RIBOSYL CYCLASE)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		3 / 3 GLU A 646
ASN A 482
TRP A 481
 144  A 813 (-3.5A)
144  A 813 ( 4.9A)
144  A 813 (-3.9A)
 1.07A 1r15F-3qdeA:
undetectable		 1r15F-3qdeA:
15.89
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.
1RG7_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		5 / 12 ALA A 218
THR A 121
SER A 124
ILE A 125
LEU A 136
 DLL  A1441 ( 3.7A)
None
None
None
None
 0.90A 1rg7A-2y4oA:
undetectable		 1rg7A-2y4oA:
17.43
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.
1RL8_A_RITA9001_1
(PROTEASE RETROPEPSIN)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.82A 1rl8A-2bwsA:
undetectable		 1rl8A-2bwsA:
13.91
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.
1RL8_A_RITA9001_2
(PROTEASE RETROPEPSIN)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.83A 1rl8B-2bwsA:
undetectable		 1rl8B-2bwsA:
13.91
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.
1T69_A_SHHA379_1
(HISTONE DEACETYLASE
8)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		5 / 12 ASP A 249
HIS A 308
GLY A 281
PHE A 278
ASP A 166
 None
ZN  A1447 (-3.2A)
None
None
ZN  A1446 ( 2.3A)
 1.43A 1t69A-1yloA:
undetectable		 1t69A-1yloA:
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.
1TV8_A_SAMA1501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 7 TYR A 435
GLU A 351
THR A  16
VAL A  73
 None
IDE  A1446 (-2.5A)
None
None
 1.19A 1tv8A-2j7cA:
7.3		 1tv8A-2j7cA:
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.
1U70_A_MTXA187_2
(DIHYDROFOLATE
REDUCTASE)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 4 SER A 235
ILE A 238
VAL A 252
THR A 318
 None
None
NAP  A1447 (-3.8A)
None
 1.20A 1u70A-4a0sA:
2.2		 1u70A-4a0sA:
17.68
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.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 HIS A 206
ASP A 360
HIS A 211
SER A 308
PHE A 200
 FE  A1441 ( 3.2A)
FE  A1441 ( 2.0A)
FE  A1441 (-3.3A)
None
EDO  A1442 (-3.7A)
 1.28A 1uobA-2bmoA:
undetectable		 1uobA-2bmoA:
22.08
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.
1USQ_A_CLMA1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.81A 1usqA-2y4oA:
undetectable		 1usqA-2y4oA:
16.18
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.
1USQ_B_CLMB1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.80A 1usqB-2y4oA:
undetectable		 1usqB-2y4oA:
16.18
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.
1USQ_C_CLMC1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.81A 1usqC-2y4oA:
undetectable		 1usqC-2y4oA:
16.18
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.
1USQ_D_CLMD1142_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.82A 1usqD-2y4oA:
undetectable		 1usqD-2y4oA:
16.18
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.
1USQ_E_CLME1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.82A 1usqE-2y4oA:
undetectable		 1usqE-2y4oA:
16.18
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.
1USQ_F_CLMF1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.82A 1usqF-2y4oA:
undetectable		 1usqF-2y4oA:
16.18
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.
1UTD_I_TRPI81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 GLY A 161
HIS A 187
THR A 188
SER A 182
 None
None
None
SAH  A1446 ( 4.4A)
 0.77A 1utdI-5fulA:
undetectable
1utdJ-5fulA:
undetectable		 1utdI-5fulA:
10.25
1utdJ-5fulA:
10.25
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.
1UTD_M_TRPM81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 1utdM-4a0sA:
undetectable
1utdN-4a0sA:
undetectable		 1utdM-4a0sA:
10.76
1utdN-4a0sA:
10.76
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.
1UTD_M_TRPM81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 GLY A 462
HIS A 457
ALA A 259
HIS A 455
ARG A 172
 None
None
FAD  A1449 (-4.9A)
None
FAD  A1449 (-3.9A)
 1.30A 1utdM-4bv6A:
undetectable
1utdN-4bv6A:
undetectable		 1utdM-4bv6A:
9.71
1utdN-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTD_N_TRPN81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.28A 1utdN-4a0sA:
undetectable
1utdO-4a0sA:
undetectable		 1utdN-4a0sA:
10.76
1utdO-4a0sA:
10.76
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.
1UTD_R_TRPR81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.30A 1utdR-4a0sA:
undetectable
1utdS-4a0sA:
undetectable		 1utdR-4a0sA:
10.76
1utdS-4a0sA:
10.76
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.
1V55_P_CHDP4525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 7 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.09A 1v55C-1h4pA:
undetectable
1v55N-1h4pA:
0.0
1v55P-1h4pA:
undetectable		 1v55C-1h4pA:
18.60
1v55N-1h4pA:
21.08
1v55P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_A_CRNA401_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.91A 1v7zA-3zuqA:
undetectable		 1v7zA-3zuqA:
14.32
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.
1V7Z_B_CRNB3401_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.92A 1v7zB-3zuqA:
undetectable		 1v7zB-3zuqA:
14.32
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.
1V7Z_C_CRNC4401_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.92A 1v7zC-3zuqA:
undetectable		 1v7zC-3zuqA:
14.32
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.
1VID_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		4 / 5 SER A 208
GLU A 156
TYR A  69
SER A 217
 CA  A1447 (-4.7A)
None
None
None
 1.29A 1vidA-2xfgA:
undetectable		 1vidA-2xfgA:
18.70
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.
1VQ1_B_SAMB301_0
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		5 / 12 ILE A 289
GLY A 290
GLY A 120
SER A 121
PRO A 282
 None
None
PLP  A1441 (-3.8A)
PLP  A1441 (-2.5A)
None
 0.95A 1vq1B-5g4iA:
2.3		 1vq1B-5g4iA:
22.82
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.
1WMQ_B_HISB1001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 1ouu HEMOGLOBIN I
(Oncorhynchus
mykiss) 		4 / 6 ILE A  63
GLY A  60
ALA A  26
HIS A  59
 CMO  A 144 (-4.7A)
None
None
CMO  A 144 ( 3.5A)
 1.00A 1wmqB-1ouuA:
1.1		 1wmqB-1ouuA:
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.
1WRL_E_TFPE210_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE
(Thermotoga
maritima) 		5 / 9 MET A 337
GLU A 350
SER A 319
GLU A 314
ALA A 169
 None
None
ADP  A1441 ( 4.0A)
None
None
 1.29A 1wrlE-3zl8A:
undetectable
1wrlF-3zl8A:
undetectable		 1wrlE-3zl8A:
12.73
1wrlF-3zl8A:
12.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1WRL_F_TFPF209_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 4gow CALMODULIN
(Homo
sapiens) 		5 / 10 LEU D  18
GLU D 120
MET D 124
MET D 144
MET D 145
 LEU  D  18 ( 0.6A)
GLU  D 120 ( 0.6A)
MET  D 124 ( 0.0A)
MET  D 144 ( 0.0A)
MET  D 145 ( 0.0A)
 1.03A 1wrlE-4gowD:
11.4
1wrlF-4gowD:
11.3		 1wrlE-4gowD:
67.09
1wrlF-4gowD:
67.09
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.
1WRQ_A_HISA2001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 1ouu HEMOGLOBIN I
(Oncorhynchus
mykiss) 		4 / 6 ILE A  63
GLY A  60
ALA A  26
HIS A  59
 CMO  A 144 (-4.7A)
None
None
CMO  A 144 ( 3.5A)
 0.97A 1wrqA-1ouuA:
1.1		 1wrqA-1ouuA:
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.
1WRQ_B_HISB1001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 1ouu HEMOGLOBIN I
(Oncorhynchus
mykiss) 		4 / 6 ILE A  63
GLY A  60
ALA A  26
HIS A  59
 CMO  A 144 (-4.7A)
None
None
CMO  A 144 ( 3.5A)
 0.97A 1wrqB-1ouuA:
1.1		 1wrqB-1ouuA:
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.
1YA3_A_STRA1001_2
(MINERALOCORTICOID
RECEPTOR)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 4 LEU A 293
LEU A 175
SER A 176
LEU A 311
 None
FAD  A1449 ( 4.7A)
FAD  A1449 (-3.6A)
FAD  A1449 ( 4.7A)
 1.13A 1ya3A-4bv6A:
undetectable		 1ya3A-4bv6A:
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.
1YAJ_D_BEZD2385_0
(CES1 PROTEIN)		 1wsv AMINOMETHYLTRANSFERA
SE
(Homo
sapiens) 		4 / 5 LEU A 144
LEU A  57
LEU A 102
LEU A 125
 LEU  A 144 ( 0.6A)
LEU  A  57 ( 0.6A)
LEU  A 102 (-0.6A)
LEU  A 125 ( 0.6A)
 1.10A 1yajD-1wsvA:
undetectable		 1yajD-1wsvA:
22.68
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.
2A3A_A_TEPA1434_1
(CHITINASE)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		3 / 3 TRP A 260
THR A 152
TYR A 199
 None
CA  A1447 ( 4.7A)
None
 1.18A 2a3aA-2xfgA:
undetectable		 2a3aA-2xfgA:
21.22
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.
2A3A_B_TEPB2434_1
(CHITINASE)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		3 / 3 TRP A 260
THR A 152
TYR A 199
 None
CA  A1447 ( 4.7A)
None
 1.20A 2a3aB-2xfgA:
undetectable		 2a3aB-2xfgA:
21.22
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.
2A3B_A_CFFA1434_1
(CHITINASE)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		3 / 3 TRP A 260
THR A 152
TYR A 199
 None
CA  A1447 ( 4.7A)
None
 1.23A 2a3bA-2xfgA:
undetectable		 2a3bA-2xfgA:
21.22
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.
2AQU_B_DR7B300_1
(HIV-1 PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 10 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.91A 2aquA-2bwsA:
undetectable		 2aquA-2bwsA:
13.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVD_B_SAMB601_1
(CATECHOL-O-METHYLTRA
NSFERASE)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		3 / 3 SER A 170
GLU A 198
ASP A 249
 None
ZN  A1446 ( 4.6A)
None
 0.73A 2avdB-1yloA:
undetectable		 2avdB-1yloA:
19.71
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)])		 4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		12 / 12 PRO A  43
LYS A  47
THR A  48
ASN A  69
GLY A  71
ARG A  75
PHE A  87
ARG A  98
ALA A 125
THR A 126
ARG A 189
TYR A 193
 PO4  A1447 (-4.7A)
PO4  A1447 (-2.8A)
PO4  A1447 (-3.8A)
None
None
None
None
None
None
None
None
None
 0.39A 2axnA-4d4lA:
55.6		 2axnA-4d4lA:
100.00
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)])		 5ajz 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		12 / 12 PRO A  43
LYS A  47
THR A  48
ASN A  69
GLY A  71
ARG A  75
PHE A  87
ARG A  98
ALA A 125
THR A 126
ARG A 189
TYR A 193
 PO4  A1448 (-4.5A)
PO4  A1448 (-2.7A)
PO4  A1448 (-3.9A)
None
None
None
None
None
None
None
None
None
 0.37A 2axnA-5ajzA:
55.8		 2axnA-5ajzA:
100.00
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 12 ALA A 163
LEU A 201
SER A  72
SER A  73
ILE A  74
 CO8  A1446 ( 3.7A)
CO8  A1446 ( 4.2A)
None
None
None
 1.13A 2bl9A-4a0sA:
undetectable		 2bl9A-4a0sA:
17.63
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.
2C6N_B_LPRB705_1
(ANGIOTENSIN-CONVERTI
NG ENZYME, SOMATIC
ISOFORM)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		5 / 12 HIS A 230
GLU A 231
HIS A 234
GLU A 268
TYR A 373
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
ZN  A1440 (-2.1A)
None
 0.90A 2c6nB-3zuqA:
undetectable		 2c6nB-3zuqA:
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.
2CL5_B_SAMB1217_1
(CATECHOL
O-METHYLTRANSFERASE)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		4 / 6 SER A 208
GLU A 156
TYR A  69
SER A 217
 CA  A1447 (-4.7A)
None
None
None
 1.23A 2cl5B-2xfgA:
undetectable		 2cl5B-2xfgA:
18.70
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.
2CML_C_ZMRC3478_1
(NEURAMINIDASE)		 1fw3 OUTER MEMBRANE
PHOSPHOLIPASE A
(Escherichia
coli) 		4 / 8 SER A 248
ASP A 251
ASN A 113
GLN A  94
 None
None
S1H  A 144 ( 4.2A)
None
 1.11A 2cmlC-1fw3A:
undetectable		 2cmlC-1fw3A:
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.
2DDW_A_PXLA1003_1
(PYRIDOXINE KINASE)		 1yad REGULATORY PROTEIN
TENI
(Bacillus
subtilis) 		4 / 8 VAL A  76
VAL A  65
PRO A  79
ASP A  66
 None
None
144  A 300 ( 3.3A)
None
 0.89A 2ddwA-1yadA:
undetectable		 2ddwA-1yadA:
21.65
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.
2DYS_C_CHDC310_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 3rbs MYOMESIN-1
(Homo
sapiens) 		4 / 7 LEU A1320
GLN A1319
PHE A1318
LEU A1269
 None
None
None
NO3  A1449 ( 4.0A)
 1.00A 2dysC-3rbsA:
undetectable
2dysJ-3rbsA:
undetectable		 2dysC-3rbsA:
18.39
2dysJ-3rbsA:
15.10
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.
2EJ3_A_GBNA2414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 GLY A 140
THR A 141
ALA A 142
ALA A 143
 FAD  A1449 (-3.4A)
FAD  A1449 (-4.2A)
FAD  A1449 (-3.3A)
None
 0.45A 2ej3A-4bv6A:
undetectable		 2ej3A-4bv6A:
23.52
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.
2EJ3_A_GBNA2414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 GLY A 261
GLY A 140
THR A 141
ALA A 142
 FAD  A1449 (-3.4A)
FAD  A1449 (-3.4A)
FAD  A1449 (-4.2A)
FAD  A1449 (-3.3A)
 0.59A 2ej3A-4bv6A:
undetectable		 2ej3A-4bv6A:
23.52
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.
2F9W_A_PAUA6001_0
(PANTOTHENATE KINASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 11 TYR A 183
GLY A 185
ASP A  95
ILE A 336
THR A 221
 None
PG4  A1443 ( 4.3A)
PG4  A1443 (-3.1A)
None
PG4  A1443 (-4.1A)
 1.14A 2f9wA-2veoA:
undetectable
2f9wB-2veoA:
undetectable		 2f9wA-2veoA:
21.68
2f9wB-2veoA:
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.
2FB2_A_SAMA501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 8 TYR A 435
GLU A 351
THR A  16
VAL A  73
 None
IDE  A1446 (-2.5A)
None
None
 1.16A 2fb2A-2j7cA:
2.5		 2fb2A-2j7cA:
20.78
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.
2FB2_B_SAMB501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 7 TYR A 435
GLU A 351
THR A  16
VAL A  73
 None
IDE  A1446 (-2.5A)
None
None
 1.16A 2fb2B-2j7cA:
3.6		 2fb2B-2j7cA:
20.78
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.
2FUM_D_MIXD3539_2
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		3 / 3 VAL A 212
VAL A  57
ASP A 167
 None
None
ZN  A1446 ( 4.5A)
 0.72A 2fumD-1yloA:
undetectable		 2fumD-1yloA:
24.00
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.
2FXE_A_DR7A102_1
(POL PROTEIN)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.84A 2fxeA-2bwsA:
undetectable		 2fxeA-2bwsA:
13.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FXE_A_DR7A102_2
(POL PROTEIN)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 11 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.87A 2fxeB-2bwsA:
undetectable		 2fxeB-2bwsA:
13.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2GJ5_A_VD3A163_1
(BETA-LACTOGLOBULIN)		 3aq7 GROUP 1 TRUNCATED
HEMOGLOBIN
(Tetrahymena
pyriformis) 		5 / 12 VAL A  28
ILE A  86
ILE A  87
ILE A 111
ALA A 107
 None
HEM  A 144 (-4.3A)
None
HEM  A 144 (-4.3A)
None
 1.16A 2gj5A-3aq7A:
undetectable		 2gj5A-3aq7A:
21.60
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.
2J0D_A_ERYA1498_0
(CYTOCHROME P450 3A4)		 1v4u HEMOGLOBIN ALPHA
CHAIN
(Thunnus
thynnus) 		5 / 12 SER A 104
ILE A 107
PHE A 130
ALA A 132
ALA A 139
 HEM  A 144 ( 4.9A)
None
None
None
None
 1.12A 2j0dA-1v4uA:
undetectable		 2j0dA-1v4uA:
15.26
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.
2J2P_F_SC2F1291_1
(FICOLIN-2)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		4 / 6 LEU A 805
ASP A 710
ASP A 778
GLU A 592
 None
None
BGC  A2144 (-2.8A)
None
 0.95A 2j2pE-2ya1A:
undetectable
2j2pF-2ya1A:
undetectable		 2j2pE-2ya1A:
11.54
2j2pF-2ya1A:
11.54
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.
2JKJ_A_CLMA1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.77A 2jkjA-2y4oA:
undetectable		 2jkjA-2y4oA:
16.18
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.
2JKJ_B_CLMB1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.76A 2jkjB-2y4oA:
undetectable		 2jkjB-2y4oA:
16.18
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.
2JKJ_C_CLMC1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.77A 2jkjC-2y4oA:
undetectable		 2jkjC-2y4oA:
16.18
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.
2JKJ_E_CLME1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.77A 2jkjE-2y4oA:
undetectable		 2jkjE-2y4oA:
16.18
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.
2JKL_A_CLMA1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.78A 2jklA-2y4oA:
undetectable		 2jklA-2y4oA:
16.18
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.
2JKL_B_CLMB1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 6 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.77A 2jklB-2y4oA:
undetectable		 2jklB-2y4oA:
16.18
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.
2JKL_C_CLMC1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.78A 2jklC-2y4oA:
undetectable		 2jklC-2y4oA:
16.18
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.
2JKL_D_CLMD1145_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.80A 2jklD-2y4oA:
undetectable		 2jklD-2y4oA:
16.18
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.
2JKL_E_CLME1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.78A 2jklE-2y4oA:
undetectable		 2jklE-2y4oA:
16.18
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.
2JKL_F_CLMF1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 GLY A 248
PRO A 249
ILE A 240
GLY A 242
 DLL  A1441 ( 4.4A)
DLL  A1441 ( 4.0A)
DLL  A1441 (-4.7A)
DLL  A1441 (-4.1A)
 0.79A 2jklF-2y4oA:
undetectable		 2jklF-2y4oA:
16.18
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.
2LH6_A_NIOA155_1
(LEGHEMOGLOBIN A
(NICOTINATE MET))		 5jja SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
56 KDA REGULATORY
SUBUNIT GAMMA
ISOFORM
(Homo
sapiens) 		4 / 5 PHE A 144
PHE A 150
PHE A 193
VAL A  96
 PHE  A 144 ( 1.3A)
PHE  A 150 ( 1.3A)
PHE  A 193 ( 1.3A)
VAL  A  96 ( 0.6A)
 1.16A 2lh6A-5jjaA:
undetectable		 2lh6A-5jjaA:
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.
2NMY_A_ROCA401_1
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.79A 2nmyA-2bwsA:
undetectable		 2nmyA-2bwsA:
13.19
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.
2OA1_B_ADNB2005_1
(TRYPTOPHAN
HALOGENASE)		 3cbt PHOSPHATASE SC4828
(Streptomyces
coelicolor) 		4 / 7 GLY A 144
GLY A 143
VAL A  61
LEU A  59
 GLY  A 144 ( 0.0A)
GLY  A 143 ( 0.0A)
VAL  A  61 ( 0.6A)
LEU  A  59 ( 0.6A)
 0.78A 2oa1B-3cbtA:
undetectable		 2oa1B-3cbtA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OCU_A_TYLA3001_1
(LACTOTRANSFERRIN)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		3 / 3 LEU A 324
TYR A 241
GLY A 217
 None
DLL  A1441 (-4.8A)
DLL  A1441 ( 3.8A)
 0.61A 2ocuA-2y4oA:
undetectable		 2ocuA-2y4oA:
22.05
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.
2PH9_A_GNTA301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		4 / 7 TYR A 333
TYR A 408
TYR A 356
ILE A 323
 F6P  A1448 (-4.8A)
None
None
None
 1.19A 2ph9A-4d4lA:
undetectable
2ph9B-4d4lA:
undetectable		 2ph9A-4d4lA:
18.67
2ph9B-4d4lA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QE6_B_SAMB400_0
(UNCHARACTERIZED
PROTEIN TFU_2867)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		5 / 12 ALA A 121
GLY A  57
ASP A  17
VAL A  18
ARG A  19
 None
None
None
None
EDO  A1447 (-4.0A)
 0.96A 2qe6B-4a35A:
undetectable		 2qe6B-4a35A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QMM_B_SAMB301_0
(UPF0217 PROTEIN
AF_1056)		 1spg HEMOGLOBIN
(Leiostomus
xanthurus) 		6 / 11 LEU A  82
GLU A 140
SER A  86
LEU A 138
SER A 139
LEU A 136
 None
None
None
HEM  A 144 ( 4.9A)
None
None
 1.16A 2qmmA-1spgA:
undetectable
2qmmB-1spgA:
undetectable		 2qmmA-1spgA:
26.44
2qmmB-1spgA:
26.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V3D_A_NBVA1503_1
(GLUCOSYLCERAMIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		9 / 12 ASP A  94
TRP A 144
ASN A 195
GLU A 196
HIS A 268
TYR A 270
GLU A 294
TRP A 331
ASN A 346
 GOL  A1449 (-2.7A)
GOL  A1449 (-4.2A)
GOL  A1449 (-3.5A)
GOL  A1449 (-3.7A)
GOL  A1449 ( 4.8A)
None
GOL  A1449 (-2.3A)
GOL  A1449 (-4.1A)
GOL  A1449 (-4.4A)
 0.38A 2v3dA-2wnwA:
49.3		 2v3dA-2wnwA:
32.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V3D_A_NBVA1503_1
(GLUCOSYLCERAMIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		6 / 12 ASP A  94
TRP A 144
ASN A 195
GLU A 294
TRP A 331
ASN A 342
 GOL  A1449 (-2.7A)
GOL  A1449 (-4.2A)
GOL  A1449 (-3.5A)
GOL  A1449 (-2.3A)
GOL  A1449 (-4.1A)
None
 1.25A 2v3dA-2wnwA:
49.3		 2v3dA-2wnwA:
32.16
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.
2V3D_B_NBVB1504_1
(GLUCOSYLCERAMIDASE)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		5 / 11 ASN A 165
GLU A 166
TYR A 295
GLU A 351
TRP A 398
 IDE  A1446 (-3.1A)
IDE  A1446 (-2.5A)
IDE  A1446 (-3.5A)
IDE  A1446 (-2.5A)
IDE  A1446 (-3.6A)
 0.84A 2v3dB-2j7cA:
16.6		 2v3dB-2j7cA:
23.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V3D_B_NBVB1504_1
(GLUCOSYLCERAMIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		8 / 11 ASP A  94
TRP A 144
ASN A 195
GLU A 196
TYR A 270
GLU A 294
TRP A 331
ASN A 346
 GOL  A1449 (-2.7A)
GOL  A1449 (-4.2A)
GOL  A1449 (-3.5A)
GOL  A1449 (-3.7A)
None
GOL  A1449 (-2.3A)
GOL  A1449 (-4.1A)
GOL  A1449 (-4.4A)
 0.36A 2v3dB-2wnwA:
49.2		 2v3dB-2wnwA:
32.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V3D_B_NBVB1504_1
(GLUCOSYLCERAMIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		6 / 11 ASP A  94
TRP A 144
ASN A 195
GLU A 294
TRP A 331
ASN A 342
 GOL  A1449 (-2.7A)
GOL  A1449 (-4.2A)
GOL  A1449 (-3.5A)
GOL  A1449 (-2.3A)
GOL  A1449 (-4.1A)
None
 1.21A 2v3dB-2wnwA:
49.2		 2v3dB-2wnwA:
32.16
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.
2V41_G_BEZG1222_0
(PEROXIREDOXIN 6.)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		4 / 8 THR A 420
VAL A 423
GLU A 406
ARG A 274
 None
None
MN  A1442 ( 2.4A)
None
 1.11A 2v41G-2bwsA:
undetectable
2v41H-2bwsA:
undetectable		 2v41G-2bwsA:
19.23
2v41H-2bwsA:
19.23
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.
2V57_A_PRLA1188_0
(TETR FAMILY
TRANSCRIPTIONAL
REPRESSOR LFRR)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		4 / 8 SER A 511
ILE A 514
ASP A 415
ARG A 360
 None
None
None
144  A 813 ( 4.8A)
 0.80A 2v57A-3qdeA:
undetectable		 2v57A-3qdeA:
13.23
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.
2V57_C_PRLC1187_0
(TETR FAMILY
TRANSCRIPTIONAL
REPRESSOR LFRR)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		4 / 8 SER A 511
ILE A 514
ASP A 415
ARG A 360
 None
None
None
144  A 813 ( 4.8A)
 0.79A 2v57C-3qdeA:
undetectable		 2v57C-3qdeA:
13.23
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.
2VDY_A_HCYA1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 SER A 429
THR A  26
PHE A  52
SER A  83
PHE A  29
 REA  A1445 ( 4.3A)
None
None
None
REA  A1445 (-4.6A)
 1.29A 2vdyA-2ve3A:
undetectable		 2vdyA-2ve3A:
22.58
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.
2VDY_B_HCYB1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 SER A 429
THR A  26
PHE A  52
SER A  83
PHE A  29
 REA  A1445 ( 4.3A)
None
None
None
REA  A1445 (-4.6A)
 1.08A 2vdyB-2ve3A:
undetectable		 2vdyB-2ve3A:
22.58
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.
2VQY_A_PARA1201_2
(AAC(6')-IB)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		3 / 3 TRP A 203
GLN A 194
TRP A 269
 GOL  A1449 (-4.3A)
None
None
 1.18A 2vqyA-2wnwA:
undetectable		 2vqyA-2wnwA:
20.61
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.
2W3B_A_FOLA401_0
(DIHYDROFOLATE
REDUCTASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 ILE A 150
ALA A 148
ILE A 301
PRO A 300
LEU A 305
 PG4  A1443 ( 4.1A)
None
None
None
None
 1.11A 2w3bA-2veoA:
undetectable		 2w3bA-2veoA:
17.65
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.
2W3B_B_FOLB401_0
(DIHYDROFOLATE
REDUCTASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 ILE A 150
ALA A 148
ILE A 301
PRO A 300
LEU A 305
 PG4  A1443 ( 4.1A)
None
None
None
None
 1.08A 2w3bB-2veoA:
undetectable		 2w3bB-2veoA:
17.65
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.
2W3M_A_FOLA1188_0
(DIHYDROFOLATE
REDUCTASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 ILE A 150
ALA A 148
ILE A 301
PRO A 300
LEU A 305
 PG4  A1443 ( 4.1A)
None
None
None
None
 1.05A 2w3mA-2veoA:
undetectable		 2w3mA-2veoA:
17.65
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.
2W9S_E_TOPE1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 3wd7 TYPE III POLYKETIDE
SYNTHASES ACRIDONE
SYNTHASE
(Citrus
x
microcarpa) 		4 / 8 ILE A 223
ALA A 110
LEU A 144
ILE A 124
 ILE  A 223 ( 0.7A)
ALA  A 110 ( 0.0A)
LEU  A 144 ( 0.5A)
ILE  A 124 ( 0.7A)
 0.73A 2w9sE-3wd7A:
undetectable		 2w9sE-3wd7A:
15.75
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.
2WA2_A_SAMA1248_0
(NON-STRUCTURAL
PROTEIN 5)		 2gqw FERREDOXIN REDUCTASE
(Pseudomonas
sp.
KKS102) 		5 / 12 GLY A 298
GLY A  14
GLY A  16
SER A  21
THR A  81
 None
FAD  A1449 (-3.2A)
FAD  A1449 (-3.5A)
None
FAD  A1449 ( 4.3A)
 0.83A 2wa2A-2gqwA:
2.1		 2wa2A-2gqwA:
22.20
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.
2WQ5_A_MIYA1120_1
(PHOSPHOLIPASE A2,
ACIDIC)		 1spg HEMOGLOBIN
(Leiostomus
xanthurus) 		4 / 7 LEU A 134
ALA A  67
GLY A  69
PHE A 130
 None
HEM  A 144 (-3.4A)
None
None
 0.75A 2wq5A-1spgA:
undetectable		 2wq5A-1spgA:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X45_C_HSMC1161_1
(ALLERGEN ARG R 1)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 5 VAL A 140
TYR A 137
VAL A 221
ASP A 155
 None
None
None
SAH  A1446 ( 4.5A)
 1.32A 2x45C-5fulA:
undetectable		 2x45C-5fulA:
13.68
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.
2XXG_A_CUA1338_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		3 / 3 ASP A 101
HIS A 135
HIS A  49
 FE  A 556 (-2.8A)
PO4  A1444 (-3.8A)
MN  A 555 ( 3.4A)
 0.61A 2xxgA-2xmoA:
undetectable		 2xxgA-2xmoA:
21.70
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.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		3 / 3 ASP A 101
HIS A 135
HIS A  49
 FE  A 556 (-2.8A)
PO4  A1444 (-3.8A)
MN  A 555 ( 3.4A)
 0.61A 2xxgC-2xmoA:
undetectable		 2xxgC-2xmoA:
21.70
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.
2XZ5_D_ACHD1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		4 / 8 GLN A 258
ASP A 261
TYR A 268
SER A 210
 None
CA  A1447 (-4.4A)
None
CA  A1447 (-2.5A)
 1.18A 2xz5C-2xfgA:
undetectable
2xz5D-2xfgA:
undetectable		 2xz5C-2xfgA:
19.48
2xz5D-2xfgA:
19.48
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.
2Y69_N_CHDN1517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.12A 2y69C-1h4pA:
undetectable
2y69N-1h4pA:
0.5
2y69P-1h4pA:
undetectable		 2y69C-1h4pA:
18.60
2y69N-1h4pA:
21.08
2y69P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZZN_B_SAMB402_0
(UNCHARACTERIZED
PROTEIN MJ0883)		 2p5d UPF0310 PROTEIN
MJECL36
(Methanocaldococc
us
jannaschii) 		5 / 12 PHE A 102
TYR A  60
PHE A 108
ILE A 144
ASP A 140
 PHE  A 102 ( 1.3A)
TYR  A  60 ( 1.3A)
PHE  A 108 ( 1.3A)
ILE  A 144 ( 0.7A)
ASP  A 140 ( 0.6A)
 1.33A 2zznB-2p5dA:
undetectable		 2zznB-2p5dA:
20.18
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.
3A50_B_VD3B2001_1
(VITAMIN D
HYDROXYLASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 11 ILE A 315
LEU A 263
MET A 401
LEU A 269
PRO A 430
 None
None
HEM  A1444 ( 4.3A)
None
None
 1.18A 3a50B-2ve3A:
32.7		 3a50B-2ve3A:
25.32
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.
3A6J_A_CRNA303_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.91A 3a6jA-3zuqA:
undetectable		 3a6jA-3zuqA:
14.22
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.
3A6J_B_CRNB304_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 7 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.88A 3a6jB-3zuqA:
undetectable		 3a6jB-3zuqA:
14.22
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.
3A6J_C_CRNC305_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.89A 3a6jC-3zuqA:
undetectable		 3a6jC-3zuqA:
14.22
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.
3A6J_E_CRNE306_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.92A 3a6jE-3zuqA:
undetectable		 3a6jE-3zuqA:
14.22
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.
3A6J_F_CRNF307_1
(CREATININE
AMIDOHYDROLASE)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		4 / 8 GLU A 268
HIS A 230
HIS A 234
GLU A 231
 ZN  A1440 (-2.1A)
ZN  A1440 (-3.3A)
ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
 0.89A 3a6jF-3zuqA:
undetectable		 3a6jF-3zuqA:
14.22
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.
3ABL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.11A 3ablA-1h4pA:
0.3
3ablC-1h4pA:
undetectable
3ablP-1h4pA:
undetectable		 3ablA-1h4pA:
21.08
3ablC-1h4pA:
18.60
3ablP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABL_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.10A 3ablC-1h4pA:
undetectable
3ablN-1h4pA:
0.2
3ablP-1h4pA:
undetectable		 3ablC-1h4pA:
18.60
3ablN-1h4pA:
21.08
3ablP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.04A 3abmA-1h4pA:
0.3
3abmC-1h4pA:
undetectable
3abmP-1h4pA:
undetectable		 3abmA-1h4pA:
21.08
3abmC-1h4pA:
18.60
3abmP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG4_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 2f22 BH3987
(Bacillus
halodurans) 		3 / 3 HIS A  42
HIS A 114
HIS A 118
 NI  A 144 (-3.3A)
NI  A 144 (-3.2A)
NI  A 144 (-3.2A)
 0.75A 3ag4A-2f22A:
undetectable		 3ag4A-2f22A:
12.50
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.
3AIC_A_ACRA5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.66A 3aicA-2ya1A:
8.2		 3aicA-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.65A 3aicB-2ya1A:
3.6		 3aicB-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		6 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
TYR A 667
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
BGC  A2144 (-4.5A)
 0.62A 3aicC-2ya1A:
6.1		 3aicC-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.73A 3aicD-2ya1A:
8.2		 3aicD-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
ARG A 842
HIS A 894
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
GLC  A2149 (-2.8A)
None
 0.74A 3aicE-2ya1A:
8.2		 3aicE-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.66A 3aicE-2ya1A:
8.2		 3aicE-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.66A 3aicF-2ya1A:
8.2		 3aicF-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.66A 3aicG-2ya1A:
8.2		 3aicG-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_H_ACRH5044_1
(GLUCOSYLTRANSFERASE-
SI)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.71A 3aicH-2ya1A:
8.2		 3aicH-2ya1A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOC_C_ERYC3402_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE
(Thermotoga
maritima) 		3 / 3 THR A 183
SER A  90
LYS A  93
 None
None
ADP  A1441 (-2.8A)
 1.11A 3aocC-3zl8A:
undetectable		 3aocC-3zl8A:
19.57
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.
3AOD_A_MIYA2001_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		4 / 8 PHE A 384
GLY A 385
ASN A  65
ILE A 346
 HEM  A1444 (-4.5A)
HEM  A1444 (-4.0A)
None
None
 0.93A 3aodA-2ve3A:
2.8		 3aodA-2ve3A:
17.74
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.
3ASN_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.10A 3asnC-1h4pA:
undetectable
3asnN-1h4pA:
0.5
3asnP-1h4pA:
undetectable		 3asnC-1h4pA:
18.60
3asnN-1h4pA:
21.08
3asnP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASO_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.09A 3asoA-1h4pA:
undetectable
3asoC-1h4pA:
undetectable
3asoP-1h4pA:
undetectable		 3asoA-1h4pA:
21.08
3asoC-1h4pA:
18.60
3asoP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASO_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.13A 3asoC-1h4pA:
undetectable
3asoN-1h4pA:
0.5
3asoP-1h4pA:
undetectable		 3asoC-1h4pA:
18.60
3asoN-1h4pA:
21.08
3asoP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B2R_A_VDNA1_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 1b0b HEMOGLOBIN
(Phacoides
pectinatus) 		5 / 12 ALA A 108
VAL A  39
PHE A  43
MET A  30
PHE A  28
 None
HEM  A 144 ( 3.6A)
HEM  A 144 ( 3.8A)
None
None
 1.09A 3b2rA-1b0bA:
undetectable		 3b2rA-1b0bA:
19.08
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.
3BSZ_E_RTLE177_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		5 / 11 LEU A 122
ALA A  64
ALA A  65
VAL A 126
GLN A  58
 None
ACT  A1130 ( 4.0A)
ACT  A1130 ( 4.0A)
None
HEM  A 144 ( 3.1A)
 1.27A 3bszE-5ab8A:
undetectable		 3bszE-5ab8A:
19.41
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.
3CFL_A_5CHA693_1
(LACTOTRANSFERRIN)		 5szs SPIKE GLYCOPROTEIN
(Human
coronavirus
NL63) 		4 / 4 THR A 653
VAL A 474
GLY A 637
THR A 638
 None
NAG  A1442 ( 4.3A)
None
None
 1.09A 3cflA-5szsA:
undetectable		 3cflA-5szsA:
13.76
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.
3D4S_A_TIMA401_2
(BETA-2 ADRENERGIC
RECEPTOR/T4-LYSOZYME
CHIMERA)		 5szs SPIKE GLYCOPROTEIN
(Human
coronavirus
NL63) 		3 / 3 THR A 669
SER A 668
PHE A 664
 NAG  A1442 ( 4.7A)
NAG  A1442 ( 3.4A)
None
 0.90A 3d4sA-5szsA:
undetectable		 3d4sA-5szsA:
16.38
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.
3DH0_A_SAMA220_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 12 GLY A 145
GLY A 279
PHE A 141
PHE A 291
LEU A 177
 PLP  A1446 (-3.2A)
None
None
None
None
 1.18A 3dh0A-2ykyA:
undetectable		 3dh0A-2ykyA:
16.99
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.
3DL9_A_V2HA602_1
(CYTOCHROME P450 2R1)		 3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE
(Thermotoga
maritima) 		4 / 5 ALA A 161
LEU A 164
GLY A  89
THR A 119
 None
ADP  A1441 ( 4.9A)
None
None
 0.95A 3dl9A-3zl8A:
undetectable		 3dl9A-3zl8A:
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.
3E4E_A_4PZA501_1
(CYTOCHROME P450 2E1)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		3 / 3 ALA A 254
THR A 258
CYH A 391
 HEM  A1444 (-3.3A)
HEM  A1444 ( 3.3A)
HEM  A1444 (-2.5A)
 0.63A 3e4eA-2ve3A:
30.0		 3e4eA-2ve3A:
25.96
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.
3E4E_B_4PZB501_1
(CYTOCHROME P450 2E1)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		3 / 3 ALA A 254
THR A 258
CYH A 391
 HEM  A1444 (-3.3A)
HEM  A1444 ( 3.3A)
HEM  A1444 (-2.5A)
 0.53A 3e4eB-2ve3A:
35.0		 3e4eB-2ve3A:
25.96
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.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		5 / 12 LEU A  74
GLY A  75
TRP A 260
ASP A 427
ASP A 261
 None
None
None
None
CA  A1447 (-4.4A)
 1.19A 3eeoA-2xfgA:
undetectable		 3eeoA-2xfgA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKW_B_DR7B100_2
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.84A 3ekwB-2bwsA:
undetectable		 3ekwB-2bwsA:
11.75
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.
3EL0_A_1UNA201_1
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		4 / 8 GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
MN  A1442 (-2.0A)
None
 0.63A 3el0A-2bwsA:
undetectable		 3el0A-2bwsA:
11.75
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.
3EM4_V_DR7V100_1
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 11 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.82A 3em4U-2bwsA:
undetectable		 3em4U-2bwsA:
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.
3F8W_A_ADNA300_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 12 TYR A  89
GLY A 170
TYR A 172
GLU A 220
GLY A 226
 SFE  A1546 (-4.0A)
None
SFE  A1546 ( 3.7A)
PLP  A1446 (-3.9A)
None
 1.15A 3f8wA-2ykyA:
undetectable		 3f8wA-2ykyA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 12 TYR A  89
GLY A 170
TYR A 172
GLU A 220
GLY A 226
 SFE  A1546 (-4.0A)
None
SFE  A1546 ( 3.7A)
PLP  A1446 (-3.9A)
None
 1.17A 3f8wB-2ykyA:
undetectable		 3f8wB-2ykyA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G2O_A_SAMA500_1
(PCZA361.24)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		3 / 3 ARG A 133
GLU A 232
ASP A 111
 SAH  A1446 (-2.7A)
CA  A1448 ( 4.5A)
None
 0.93A 3g2oA-5fulA:
6.9		 3g2oA-5fulA:
20.65
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.
3G88_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 11 GLY A 157
GLY A 159
ALA A 181
GLU A 209
ARG A 133
 SAH  A1446 (-3.1A)
SAH  A1446 ( 3.9A)
SAH  A1446 (-3.7A)
SAH  A1446 (-3.1A)
SAH  A1446 (-2.7A)
 0.98A 3g88A-5fulA:
7.4		 3g88A-5fulA:
21.43
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.
3G89_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 12 GLY A 157
GLY A 159
ALA A 181
GLU A 209
ARG A 133
 SAH  A1446 (-3.1A)
SAH  A1446 ( 3.9A)
SAH  A1446 (-3.7A)
SAH  A1446 (-3.1A)
SAH  A1446 (-2.7A)
 0.95A 3g89A-5fulA:
7.0		 3g89A-5fulA:
21.43
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.
3G89_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 11 GLY A 157
GLY A 159
ALA A 181
GLU A 209
ARG A 133
 SAH  A1446 (-3.1A)
SAH  A1446 ( 3.9A)
SAH  A1446 (-3.7A)
SAH  A1446 (-3.1A)
SAH  A1446 (-2.7A)
 0.95A 3g89B-5fulA:
7.4		 3g89B-5fulA:
21.43
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.
3G8B_A_SAMA303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 12 GLY A 157
GLY A 159
ALA A 181
GLU A 209
ARG A 133
 SAH  A1446 (-3.1A)
SAH  A1446 ( 3.9A)
SAH  A1446 (-3.7A)
SAH  A1446 (-3.1A)
SAH  A1446 (-2.7A)
 0.95A 3g8bA-5fulA:
7.5		 3g8bA-5fulA:
21.43
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.
3G8B_B_SAMB303_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE G)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 12 GLY A 157
GLY A 159
ALA A 181
GLU A 209
ARG A 133
 SAH  A1446 (-3.1A)
SAH  A1446 ( 3.9A)
SAH  A1446 (-3.7A)
SAH  A1446 (-3.1A)
SAH  A1446 (-2.7A)
 0.98A 3g8bB-5fulA:
7.2		 3g8bB-5fulA:
21.43
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.
3G9E_A_RO7A1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		5 / 12 GLY A  50
SER A 293
HIS A 268
TYR A 270
ILE A 370
 None
None
GOL  A1449 ( 4.8A)
None
None
 1.17A 3g9eA-2wnwA:
undetectable		 3g9eA-2wnwA:
21.15
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.
3HRD_E_NIOE5660_1
(NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 GLU A 408
GLU A 405
TRP A 324
 None
IDE  A1446 (-2.8A)
None
 1.01A 3hrdA-2j7cA:
undetectable
3hrdE-2j7cA:
undetectable
3hrdF-2j7cA:
undetectable		 3hrdA-2j7cA:
19.51
3hrdE-2j7cA:
19.51
3hrdF-2j7cA:
23.33
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.
3HS6_A_EPAA1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3wd7 TYPE III POLYKETIDE
SYNTHASES ACRIDONE
SYNTHASE
(Citrus
x
microcarpa) 		5 / 12 SER A  98
GLY A 139
ALA A 140
LEU A 144
LEU A 147
 SER  A  98 ( 0.0A)
GLY  A 139 ( 0.0A)
ALA  A 140 ( 0.0A)
LEU  A 144 ( 0.5A)
LEU  A 147 ( 0.6A)
 1.05A 3hs6A-3wd7A:
undetectable		 3hs6A-3wd7A:
22.38
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.
3K2H_B_LYAB514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 2y8f RAN-BINDING PROTEIN
3
(Homo
sapiens) 		5 / 12 ILE A 397
ARG A 374
LEU A 360
ILE A 422
LEU A 358
 GOL  A1452 (-4.7A)
CL  A1449 ( 3.9A)
None
None
None
 1.14A 3k2hB-2y8fA:
undetectable		 3k2hB-2y8fA:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K2H_B_LYAB514_2
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 2oaf THIOESTERASE
SUPERFAMILY
(Jannaschia
sp.
CCS1) 		3 / 3 ARG A  33
THR A  63
THR A  86
 PO4  A 144 (-4.2A)
None
None
 0.76A 3k2hB-2oafA:
undetectable		 3k2hB-2oafA:
14.09
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.
3K9F_F_LFXF0_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 4ags THIOL-DEPENDENT
REDUCTASE 1
(Leishmania
infantum) 		4 / 5 SER A 294
ARG A 245
GLY A 335
GLU A 351
 GSH  A1449 (-2.5A)
None
None
None
 1.02A 3k9fA-4agsA:
undetectable
3k9fB-4agsA:
undetectable
3k9fC-4agsA:
undetectable		 3k9fA-4agsA:
22.45
3k9fB-4agsA:
22.45
3k9fC-4agsA:
22.00
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.
3K9F_H_LFXH0_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 4ags THIOL-DEPENDENT
REDUCTASE 1
(Leishmania
infantum) 		4 / 6 ARG A 245
SER A 294
GLY A 335
GLU A 351
 None
GSH  A1449 (-2.5A)
None
None
 1.01A 3k9fA-4agsA:
undetectable
3k9fB-4agsA:
undetectable
3k9fD-4agsA:
undetectable		 3k9fA-4agsA:
22.45
3k9fB-4agsA:
22.45
3k9fD-4agsA:
22.00
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.
3K9W_A_ACTA170_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		3 / 3 SER A 144
GLY A 145
THR A 146
 PLP  A1446 (-3.8A)
PLP  A1446 (-3.2A)
PLP  A1446 (-3.5A)
 0.23A 3k9wA-2ykyA:
undetectable		 3k9wA-2ykyA:
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.
3KEC_B_HAEB271_1
(COLLAGENASE 3)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		3 / 3 HIS A 230
GLU A 231
HIS A 234
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
 0.14A 3kecB-3zuqA:
undetectable		 3kecB-3zuqA:
11.45
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.
3KP6_B_SALB3004_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		4 / 5 ILE A 788
PHE A 777
ASP A 778
GLU A 807
 None
None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
 1.18A 3kp6A-2ya1A:
undetectable
3kp6B-2ya1A:
undetectable		 3kp6A-2ya1A:
10.21
3kp6B-2ya1A:
10.21
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.
3LK0_D_Z80D92_1
(PROTEIN S100-B)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		3 / 3 HIS A 143
PHE A 329
PHE A 311
 EOH  A1446 (-3.5A)
None
None
 0.78A 3lk0D-2bmoA:
0.0		 3lk0D-2bmoA:
12.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LS4_H_TCIH220_1
(HEAVY CHAIN OF
ANTIBODY FAB
FRAGMENT)		 3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE
(Thermotoga
maritima) 		5 / 10 VAL A 160
VAL A 162
LEU A 164
GLY A  86
VAL A 138
 None
None
ADP  A1441 ( 4.9A)
None
None
 1.08A 3ls4H-3zl8A:
undetectable		 3ls4H-3zl8A:
19.28
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.
3LSL_A_PZIA801_0
(GLUTAMATE RECEPTOR 2)		 3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE
(Thermotoga
maritima) 		4 / 8 ILE A 180
SER A  91
GLY A 167
SER A 312
 None
ADP  A1441 (-4.0A)
None
None
 0.85A 3lslA-3zl8A:
undetectable
3lslD-3zl8A:
undetectable		 3lslA-3zl8A:
21.90
3lslD-3zl8A:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSL_D_PZID801_0
(GLUTAMATE RECEPTOR 2)		 3zl8 UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE
(Thermotoga
maritima) 		4 / 8 SER A 312
ILE A 180
SER A  91
GLY A 167
 None
None
ADP  A1441 (-4.0A)
None
 0.94A 3lslA-3zl8A:
undetectable
3lslD-3zl8A:
undetectable		 3lslA-3zl8A:
21.90
3lslD-3zl8A:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3M7R_A_VDXA425_1
(VITAMIN D3 RECEPTOR)		 4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		5 / 12 LEU A 391
LEU A 395
SER A 430
GLN A 388
HIS A 441
 None
None
None
F6P  A1448 ( 4.2A)
None
 1.26A 3m7rA-4d4lA:
undetectable		 3m7rA-4d4lA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3M7R_A_VDXA425_1
(VITAMIN D3 RECEPTOR)		 5ajz 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		5 / 12 LEU A 391
LEU A 395
SER A 430
GLN A 388
HIS A 441
 None
None
None
F6P  A1447 ( 4.0A)
None
 1.27A 3m7rA-5ajzA:
undetectable		 3m7rA-5ajzA:
18.96
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.
3MBG_C_ACTC800_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)		 1y2x LECTIN
(Agaricus
bisporus) 		3 / 3 ASP A  79
ARG A 103
ALA A 106
 NAG  A 144 (-2.8A)
NAG  A 144 (-4.0A)
NAG  A 144 ( 4.2A)
 0.80A 3mbgC-1y2xA:
undetectable		 3mbgC-1y2xA:
19.08
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.
3MS9_A_STIA1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		4 / 6 VAL A 196
VAL A 188
ILE A 211
ARG A 268
 None
None
None
GOL  A1441 ( 4.1A)
 1.09A 3ms9A-2w38A:
undetectable		 3ms9A-2w38A:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MS9_B_STIB1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		4 / 7 VAL A  94
VAL A  29
ILE A 119
ARG A  84
 HEM  A 144 (-4.2A)
None
HEM  A 144 ( 4.9A)
HEM  A 144 (-3.3A)
 1.17A 3ms9B-5ab8A:
undetectable		 3ms9B-5ab8A:
16.21
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.
3MSS_A_STIA1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		4 / 6 VAL A 196
VAL A 188
ILE A 211
ARG A 268
 None
None
None
GOL  A1441 ( 4.1A)
 1.07A 3mssA-2w38A:
undetectable		 3mssA-2w38A:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MSS_C_STIC1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		4 / 6 VAL A 196
VAL A 188
ILE A 211
ARG A 268
 None
None
None
GOL  A1441 ( 4.1A)
 1.08A 3mssC-2w38A:
undetectable		 3mssC-2w38A:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		5 / 11 VAL A  48
ALA A  49
PHE A  25
ILE A  92
ARG A  31
 None
None
None
None
NAD  A1445 (-3.4A)
 1.12A 3n23A-2ixbA:
2.5		 3n23A-2ixbA:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N2O_C_AG2C1002_1
(BIOSYNTHETIC
ARGININE
DECARBOXYLASE)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		4 / 8 HIS A 104
SER A  98
ASP A 380
LEU A 379
 NAD  A1445 (-4.0A)
None
None
None
 1.09A 3n2oC-2ixbA:
undetectable
3n2oD-2ixbA:
undetectable		 3n2oC-2ixbA:
21.25
3n2oD-2ixbA:
21.25
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.
3NAI_C_URFC521_1
(RNA DEPENDENT RNA
POLYMERASE)		 2jk1 HYDROGENASE
TRANSCRIPTIONAL
REGULATORY PROTEIN
HUPR1
(Rhodobacter
capsulatus) 		4 / 5 ARG A  57
ASP A  13
ASP A  55
ASP A  12
 None
MG  A1144 (-2.4A)
MG  A1144 (-2.8A)
MG  A1144 ( 4.6A)
 1.33A 3naiC-2jk1A:
undetectable		 3naiC-2jk1A:
14.09
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.
3NDW_A_RITA100_1
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.81A 3ndwA-2bwsA:
undetectable		 3ndwA-2bwsA:
13.43
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.
3NDX_A_RITA100_1
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.82A 3ndxA-2bwsA:
undetectable		 3ndxA-2bwsA:
13.43
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.
3NDX_A_RITA100_2
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 11 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.87A 3ndxB-2bwsA:
undetectable		 3ndxB-2bwsA:
13.43
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.
3OXX_C_DR7C100_1
(HIV-1 PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.74A 3oxxC-2bwsA:
undetectable		 3oxxC-2bwsA:
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.
3OZU_A_X89A411_1
(FLAVOHEMOPROTEIN)		 1fsl LEGHEMOGLOBIN A
(Glycine
max) 		5 / 12 PHE A  29
TYR A  30
HIS A  92
ALA A 132
TYR A 133
 NIO  A 145 ( 4.9A)
NIO  A 145 (-4.6A)
HEM  A 144 (-3.4A)
None
HEM  A 144 (-2.9A)
 0.80A 3ozuA-1fslA:
12.2		 3ozuA-1fslA:
17.37
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.
3PGY_A_GLYA510_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		4 / 6 GLU A 360
ILE A 323
GLU A 322
ASN A 321
 None
None
F6P  A1448 (-3.7A)
None
 0.99A 3pgyA-4d4lA:
2.3
3pgyB-4d4lA:
2.1		 3pgyA-4d4lA:
20.00
3pgyB-4d4lA:
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.
3PGY_A_GLYA510_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 5ajz 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		4 / 6 GLU A 360
ILE A 323
GLU A 322
ASN A 321
 None
None
F6P  A1447 (-3.5A)
None
 0.99A 3pgyA-5ajzA:
2.4
3pgyB-5ajzA:
2.2		 3pgyA-5ajzA:
21.41
3pgyB-5ajzA:
21.41
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.
3PS9_A_SAMA670_1
(TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 6 GLY A 159
THR A 160
GLU A 180
ASP A 155
 SAH  A1446 ( 3.9A)
None
SAH  A1446 (-2.7A)
SAH  A1446 ( 4.5A)
 0.96A 3ps9A-5fulA:
5.7		 3ps9A-5fulA:
21.87
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.
3QG2_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2an1 PUTATIVE KINASE
(Salmonella
enterica) 		5 / 11 ILE A 146
ASN A 268
ILE A  88
LEU A 267
THR A 144
 ILE  A 146 ( 0.7A)
ASN  A 268 ( 0.6A)
ILE  A  88 ( 0.7A)
LEU  A 267 ( 0.6A)
THR  A 144 ( 0.8A)
 1.17A 3qg2B-2an1A:
undetectable		 3qg2B-2an1A:
19.80
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.
3S3N_A_DLUA398_1
(PFV INTEGRASE)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 8 ASP A 214
GLY A 260
GLU A 217
ARG A 251
 None
None
U63  A1443 ( 4.3A)
U63  A1443 (-3.0A)
 0.98A 3s3nA-4v20A:
undetectable		 3s3nA-4v20A:
21.65
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.
3S3O_A_DLUA399_1
(PFV INTEGRASE)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		4 / 7 ASP A 221
ASP A 166
GLU A 198
ARG A  88
 ZN  A1446 (-2.2A)
ZN  A1446 ( 2.3A)
ZN  A1446 ( 4.6A)
None
 1.23A 3s3oA-1yloA:
undetectable		 3s3oA-1yloA:
21.63
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.
3S8P_A_SAMA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.44A 3s8pA-2vqdA:
undetectable		 3s8pA-2vqdA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S8P_B_SAMB500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.41A 3s8pB-2vqdA:
undetectable		 3s8pB-2vqdA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SFE_C_TMGC1_1
(SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL
SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL)		 2h89 SUCCINATE
DEHYDROGENASE
CYTOCHROME B, LARGE
SUBUNIT
(Gallus
gallus) 		5 / 8 TRP C  32
MET C  36
SER C  39
ILE C  40
ARG C  43
 BHG  C 141 (-4.0A)
UNL  C 144 (-4.7A)
UNL  C 145 ( 3.8A)
UNL  C 144 ( 4.0A)
HEM  C 142 (-3.8A)
 0.80A 3sfeB-2h89C:
undetectable
3sfeC-2h89C:
15.7		 3sfeB-2h89C:
19.76
3sfeC-2h89C:
69.29
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.
3SFU_A_RBVA601_1
(RNA POLYMERASE)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		5 / 9 THR A 319
THR A 320
TYR A  17
GLY A 322
ASP A  22
 GOL  A1442 (-4.0A)
GOL  A1442 ( 4.7A)
None
None
None
 1.41A 3sfuA-2w38A:
undetectable		 3sfuA-2w38A:
21.25
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.
3SGL_A_SAMA692_0
(TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		5 / 12 GLY A 261
GLY A 366
LYS A 337
ASP A 333
GLY A 258
 None
None
None
B3P  A1445 (-3.1A)
None
 1.05A 3sglA-5g4iA:
undetectable		 3sglA-5g4iA:
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.
3SI7_A_ACTA5_0
(CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		3 / 3 LYS A 281
SER A 222
GLN A 254
 PLP  A1441 (-1.4A)
None
PO4  A1442 ( 3.3A)
 1.29A 3si7A-5g4iA:
undetectable		 3si7A-5g4iA:
23.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TAJ_A_NBOA700_1
(LACTOTRANSFERRIN)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 7 THR A 260
GLY A 262
PRO A 402
ASN A 403
 FAD  A1449 (-4.1A)
None
None
FAD  A1449 ( 4.5A)
 0.82A 3tajA-4bv6A:
undetectable		 3tajA-4bv6A:
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.
3TM4_A_SAMA401_1
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 5 HIS A 381
THR A 227
GLU A 223
ASP A 155
 None
None
CA  A1448 (-4.2A)
SAH  A1446 ( 4.5A)
 1.10A 3tm4A-5fulA:
8.8		 3tm4A-5fulA:
19.21
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.
3TM4_B_SAMB401_1
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 5 HIS A 381
THR A 227
GLU A 223
ASP A 155
 None
None
CA  A1448 (-4.2A)
SAH  A1446 ( 4.5A)
 1.13A 3tm4B-5fulA:
8.6		 3tm4B-5fulA:
19.21
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.
3U8Q_A_NPUA7231_1
(LACTOTRANSFERRIN)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 5 THR A 260
GLY A 262
PRO A 402
ASN A 403
 FAD  A1449 (-4.1A)
None
None
FAD  A1449 ( 4.5A)
 0.83A 3u8qA-4bv6A:
undetectable		 3u8qA-4bv6A:
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.
3V1N_A_BEZA288_0
(2-HYDROXY-6-OXO-6-PH
ENYLHEXA-2,4-DIENOAT
E HYDROLASE)		 1v4u HEMOGLOBIN ALPHA
CHAIN
(Thunnus
thynnus) 		5 / 8 GLY A  66
GLY A  67
GLY A  26
ILE A 107
LEU A 103
 None
HEM  A 144 ( 4.2A)
None
None
HEM  A 144 (-4.4A)
 1.42A 3v1nA-1v4uA:
undetectable		 3v1nA-1v4uA:
20.98
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.
3V8V_A_SAMA801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN
(Porphyromonas
gingivalis) 		5 / 12 ILE A 144
MET A  57
ASP A  19
VAL A  77
LEU A  71
 ILE  A 144 ( 0.7A)
VAL  A  77 ( 3.9A)
ASP  A  19 ( 0.6A)
VAL  A  77 ( 0.6A)
LEU  A  71 ( 0.6A)
 1.21A 3v8vA-2nvvA:
undetectable		 3v8vA-2nvvA:
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.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 4ags THIOL-DEPENDENT
REDUCTASE 1
(Leishmania
infantum) 		5 / 6 PHE A 242
ARG A 245
PRO A 281
GLU A 293
SER A 294
 GSH  A1449 (-3.5A)
None
GSH  A1449 (-4.4A)
GSH  A1449 (-3.1A)
GSH  A1449 (-2.5A)
 0.29A 3vlnA-4agsA:
24.0		 3vlnA-4agsA:
18.05
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.
3VN2_A_TLSA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 12 PHE A 133
LEU A 368
LEU A 269
MET A 268
TYR A 333
 None
SFE  A1447 (-4.9A)
SFE  A1447 ( 4.5A)
SFE  A1447 ( 4.2A)
None
 1.20A 3vn2A-2ykyA:
undetectable		 3vn2A-2ykyA:
23.86
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.
3VW7_A_VPXA2001_1
(PROTEINASE-ACTIVATED
RECEPTOR 1, LYSOZYME)		 1spg HEMOGLOBIN
(Leiostomus
xanthurus) 		5 / 12 LEU A  24
LEU A 134
LEU A 131
ALA A  67
ALA A  71
 None
None
None
HEM  A 144 (-3.4A)
None
 1.07A 3vw7A-1spgA:
undetectable		 3vw7A-1spgA:
15.07
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.
3VYW_A_SAMA501_1
(MNMC2)		 1fw3 OUTER MEMBRANE
PHOSPHOLIPASE A
(Escherichia
coli) 		4 / 6 ASP A 251
ASP A 149
ASN A 145
GLU A 111
 None
None
S1H  A 144 ( 4.9A)
None
 1.20A 3vywA-1fw3A:
undetectable		 3vywA-1fw3A:
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.
3VYW_C_SAMC401_1
(MNMC2)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 6 GLY A 159
GLU A 180
ASP A 155
GLU A 209
 SAH  A1446 ( 3.9A)
SAH  A1446 (-2.7A)
SAH  A1446 ( 4.5A)
SAH  A1446 (-3.1A)
 0.82A 3vywC-5fulA:
6.4		 3vywC-5fulA:
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.
3VYW_D_SAMD401_1
(MNMC2)		 1fw3 OUTER MEMBRANE
PHOSPHOLIPASE A
(Escherichia
coli) 		4 / 5 ASP A 251
ASP A 149
ASN A 145
GLU A 111
 None
None
S1H  A 144 ( 4.9A)
None
 1.11A 3vywD-1fw3A:
undetectable		 3vywD-1fw3A:
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.
3W9T_C_W9TC1005_1
(HEMOLYTIC LECTIN
CEL-III)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		3 / 3 ASP A  17
GLY A  63
TYR A 432
 None
EDO  A1447 ( 4.1A)
EDO  A1447 (-4.2A)
 0.77A 3w9tC-4a35A:
undetectable		 3w9tC-4a35A:
20.74
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.
3W9T_C_W9TC1005_1
(HEMOLYTIC LECTIN
CEL-III)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		3 / 3 ASP A  17
GLY A  65
TYR A 432
 None
None
EDO  A1447 (-4.2A)
 0.46A 3w9tC-4a35A:
undetectable		 3w9tC-4a35A:
20.74
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.
3W9T_E_W9TE502_1
(HEMOLYTIC LECTIN
CEL-III)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 6 GLY A 288
LEU A 175
TYR A 170
GLU A 167
 None
FAD  A1449 ( 4.7A)
None
None
 1.16A 3w9tE-4bv6A:
undetectable		 3w9tE-4bv6A:
22.26
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.
3W9T_G_W9TG503_1
(HEMOLYTIC LECTIN
CEL-III)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		3 / 3 ASP A  17
GLY A  63
TYR A 432
 None
EDO  A1447 ( 4.1A)
EDO  A1447 (-4.2A)
 0.77A 3w9tG-4a35A:
undetectable		 3w9tG-4a35A:
20.74
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.
3W9T_G_W9TG503_1
(HEMOLYTIC LECTIN
CEL-III)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		3 / 3 ASP A  17
GLY A  65
TYR A 432
 None
None
EDO  A1447 (-4.2A)
 0.46A 3w9tG-4a35A:
undetectable		 3w9tG-4a35A:
20.74
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.
3WG7_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.05A 3wg7A-1h4pA:
0.2
3wg7C-1h4pA:
undetectable
3wg7P-1h4pA:
undetectable		 3wg7A-1h4pA:
21.08
3wg7C-1h4pA:
18.60
3wg7P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WG7_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.09A 3wg7C-1h4pA:
undetectable
3wg7N-1h4pA:
0.2
3wg7P-1h4pA:
undetectable		 3wg7C-1h4pA:
18.60
3wg7N-1h4pA:
21.08
3wg7P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WXO_A_NIZA803_1
(CATALASE-PEROXIDASE)		 5g4i PHOSPHOLYASE
(Paenarthrobacter
aurescens) 		4 / 4 ASP A 218
THR A 223
VAL A 253
SER A 146
 None
None
PLP  A1441 (-4.2A)
None
 1.45A 3wxoA-5g4iA:
undetectable		 3wxoA-5g4iA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WZE_A_BAXA1201_1
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 5d7a TRAF2 AND
NCK-INTERACTING
PROTEIN KINASE
(Homo
sapiens) 		8 / 12 VAL A  39
ALA A  52
LYS A  54
LEU A  73
PHE A 107
GLY A 111
LEU A 144
HIS A 151
 VAL  A  39 (-0.6A)
ALA  A  52 (-0.0A)
LYS  A  54 ( 0.0A)
LEU  A  73 ( 0.6A)
PHE  A 107 ( 1.3A)
GLY  A 111 (-0.0A)
LEU  A 144 ( 0.6A)
HIS  A 151 ( 1.0A)
 0.71A 3wzeA-5d7aA:
8.8		 3wzeA-5d7aA:
28.07
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.
3X2Q_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.07A 3x2qA-1h4pA:
undetectable
3x2qC-1h4pA:
undetectable
3x2qP-1h4pA:
undetectable		 3x2qA-1h4pA:
21.08
3x2qC-1h4pA:
18.60
3x2qP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3X2Q_P_CHDP308_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.09A 3x2qC-1h4pA:
undetectable
3x2qN-1h4pA:
0.5
3x2qP-1h4pA:
undetectable		 3x2qC-1h4pA:
18.60
3x2qN-1h4pA:
21.08
3x2qP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A6E_A_SAMA1349_1
(HYDROXYINDOLE
O-METHYLTRANSFERASE)		 4b28 METALLOPEPTIDASE,
FAMILY M24, PUTATIVE
(Roseobacter
denitrificans) 		3 / 3 TYR A 366
ASP A 307
ASP A 422
 None
FE  A1446 ( 2.2A)
None
 0.77A 4a6eA-4b28A:
undetectable		 4a6eA-4b28A:
22.69
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.
4AC9_C_DXCC1478_0
(MJ0495-LIKE PROTEIN)		 3v0a LLAMA ANTIBODY F12
(Lama
glama) 		4 / 7 ASP C 102
GLY C  98
THR C  97
PHE C  45
 SO4  C 144 ( 4.6A)
None
None
None
 0.78A 4ac9C-3v0aC:
undetectable		 4ac9C-3v0aC:
13.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)		 2hw2 RIFAMPIN ADP-RIBOSYL
TRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 6 HIS A  19
GLY A  20
TYR A  49
ALA A  57
 None
None
GLY  A 144 (-3.8A)
None
 0.55A 4ae1A-2hw2A:
4.2		 4ae1A-2hw2A:
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.
4ASD_A_BAXA1500_1
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 5d7a TRAF2 AND
NCK-INTERACTING
PROTEIN KINASE
(Homo
sapiens) 		9 / 12 VAL A  39
ALA A  52
LYS A  54
GLU A  69
LEU A  73
PHE A 107
GLY A 111
LEU A 144
HIS A 151
 VAL  A  39 (-0.6A)
ALA  A  52 (-0.0A)
LYS  A  54 ( 0.0A)
GLU  A  69 ( 0.6A)
LEU  A  73 ( 0.6A)
PHE  A 107 ( 1.3A)
GLY  A 111 (-0.0A)
LEU  A 144 ( 0.6A)
HIS  A 151 ( 1.0A)
 0.79A 4asdA-5d7aA:
10.1		 4asdA-5d7aA:
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.
4AWU_A_4CHA502_0
(OXIDOREDUCTASE,
FMN-BINDING)		 1fw3 OUTER MEMBRANE
PHOSPHOLIPASE A
(Escherichia
coli) 		4 / 7 THR A 112
TYR A  92
LEU A  71
PHE A 109
 None
S1H  A 144 ( 3.8A)
None
None
 1.07A 4awuA-1fw3A:
undetectable		 4awuA-1fw3A:
23.77
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.
4BLV_A_SAMA1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 2gqw FERREDOXIN REDUCTASE
(Pseudomonas
sp.
KKS102) 		5 / 12 GLY A  14
GLY A 110
LEU A  77
GLY A  79
PRO A  45
 FAD  A1449 (-3.2A)
FAD  A1449 (-3.3A)
None
None
None
 1.01A 4blvA-2gqwA:
2.4		 4blvA-2gqwA:
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.
4BLV_A_SAMA1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		5 / 12 ASP A 241
GLY A 272
HIS A 315
ASP A 273
GLY A 295
 None
None
None
GOL  A1448 (-4.8A)
None
 1.11A 4blvA-2wnwA:
undetectable		 4blvA-2wnwA:
21.71
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.
4BLV_A_SAMA1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 GLY A 138
GLY A 261
LEU A 228
GLY A 230
PRO A 169
 FAD  A1449 (-3.1A)
FAD  A1449 (-3.4A)
None
None
None
 1.10A 4blvA-4bv6A:
undetectable		 4blvA-4bv6A:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BLV_A_SAMA1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 5ve2 ENOYL-COA HYDRATASE
(Pseudoalteromona
s
atlantica) 		5 / 12 LEU A 144
GLY A 105
LEU A 156
GLY A 160
PRO A 136
 LEU  A 144 ( 0.6A)
GLY  A 105 ( 0.0A)
LEU  A 156 ( 0.5A)
GLY  A 160 ( 0.0A)
PRO  A 136 ( 1.1A)
 1.03A 4blvA-5ve2A:
undetectable		 4blvA-5ve2A:
18.39
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.
4BUP_A_SAMA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.38A 4bupA-2vqdA:
undetectable		 4bupA-2vqdA:
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.
4BUP_B_SAMB500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.37A 4bupB-2vqdA:
undetectable		 4bupB-2vqdA:
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.
4C2P_A_X8ZA709_1
(ANGIOTENSIN-CONVERTI
NG ENZYME)		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		5 / 11 HIS A 230
GLU A 231
HIS A 234
GLU A 268
TYR A 373
 ZN  A1440 (-3.3A)
ZN  A1440 ( 4.5A)
ZN  A1440 (-3.3A)
ZN  A1440 (-2.1A)
None
 0.85A 4c2pA-3zuqA:
4.8		 4c2pA-3zuqA:
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.
4C49_B_HCYB1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 SER A 429
THR A  26
PHE A  52
SER A  83
PHE A  29
 REA  A1445 ( 4.3A)
None
None
None
REA  A1445 (-4.6A)
 1.29A 4c49B-2ve3A:
undetectable		 4c49B-2ve3A:
23.71
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.
4C49_C_HCYC1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 SER A 429
THR A  26
PHE A  52
SER A  83
PHE A  29
 REA  A1445 ( 4.3A)
None
None
None
REA  A1445 (-4.6A)
 1.35A 4c49C-2ve3A:
undetectable		 4c49C-2ve3A:
23.71
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.
4C49_D_HCYD1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 SER A 429
THR A  26
PHE A  52
SER A  83
PHE A  29
 REA  A1445 ( 4.3A)
None
None
None
REA  A1445 (-4.6A)
 1.27A 4c49D-2ve3A:
undetectable		 4c49D-2ve3A:
23.71
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.
4CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3r6y ASPARTASE
(Bacillus
sp.
YM55-1) 		5 / 11 GLN A 139
THR A 141
ALA A 144
LEU A  49
ASN A 136
 GLN  A 139 ( 0.6A)
THR  A 141 ( 0.8A)
ALA  A 144 ( 0.0A)
LEU  A  49 ( 0.6A)
ASN  A 136 ( 0.6A)
 1.24A 4claA-3r6yA:
undetectable		 4claA-3r6yA:
20.15
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.
4CP3_B_RBTB1129_1
(B-CELL LYMPHOMA 6
PROTEIN)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		4 / 7 ASN A  36
ARG A  35
GLY A 245
TYR A 244
 None
EDO  A1444 (-3.8A)
None
None
 0.86A 4cp3A-2bmoA:
undetectable
4cp3B-2bmoA:
undetectable		 4cp3A-2bmoA:
14.94
4cp3B-2bmoA:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_C_ZMRC1470_2
(NEURAMINIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		3 / 3 ARG A 405
ARG A 443
TRP A 442
 PO4  A1446 (-3.8A)
None
None
 0.99A 4cpzC-2wnwA:
undetectable		 4cpzC-2wnwA:
23.96
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.
4CPZ_E_ZMRE1471_2
(NEURAMINIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		3 / 3 ARG A 405
ARG A 443
TRP A 442
 PO4  A1446 (-3.8A)
None
None
 1.06A 4cpzE-2wnwA:
undetectable		 4cpzE-2wnwA:
23.96
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.
4CPZ_H_ZMRH1470_2
(NEURAMINIDASE)		 2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB
(Salmonella
enterica) 		3 / 3 ARG A 405
ARG A 443
TRP A 442
 PO4  A1446 (-3.8A)
None
None
 0.99A 4cpzH-2wnwA:
undetectable		 4cpzH-2wnwA:
23.96
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.
4D7H_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		3 / 3 ARG A 323
THR A  95
TRP A  80
 HEM  A1444 (-2.7A)
None
REA  A1445 ( 3.9A)
 1.05A 4d7hA-2ve3A:
undetectable		 4d7hA-2ve3A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DFR_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		5 / 12 ALA A 218
THR A 121
SER A 124
ILE A 125
LEU A 136
 DLL  A1441 ( 3.7A)
None
None
None
None
 0.96A 4dfrA-2y4oA:
undetectable		 4dfrA-2y4oA:
17.43
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.
4EB6_C_VLBC503_1
(TUBULIN BETA CHAIN
TUBULIN ALPHA CHAIN)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		5 / 12 ASP A  44
TYR A 444
TYR A 377
VAL A  21
ILE A  23
 None
MRD  A1447 (-4.6A)
None
None
None
 1.42A 4eb6B-2ixbA:
undetectable
4eb6C-2ixbA:
3.6		 4eb6B-2ixbA:
20.66
4eb6C-2ixbA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 PHE A  69
PHE A 336
ILE A  46
GLY A 320
ALA A  64
 None
None
None
REA  A1445 (-4.5A)
None
 1.11A 4enhA-2ve3A:
41.4		 4enhA-2ve3A:
27.96
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.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 PHE A  88
ILE A 126
ILE A 381
ALA A 187
GLY A 185
 None
None
None
None
PG4  A1443 ( 4.3A)
 1.15A 4enhA-2veoA:
undetectable		 4enhA-2veoA:
24.32
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.
4EYR_B_RITB301_2
(HIV-1 PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		4 / 8 ARG A 221
GLY A 262
ALA A 261
ASP A 260
 None
None
None
MN  A1442 (-2.0A)
 0.83A 4eyrB-2bwsA:
undetectable		 4eyrB-2bwsA:
13.40
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.
4F84_A_SAMA501_0
(GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E)		 2y77 3-DEHYDROQUINATE
DEHYDRATASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  81
GLY A  78
LEU A  86
SER A 115
TYR A 116
 CB8  A1144 (-3.8A)
CB8  A1144 (-3.3A)
None
None
None
 1.23A 4f84A-2y77A:
undetectable		 4f84A-2y77A:
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.
4FJP_A_NPSA711_1
(LACTOTRANSFERRIN)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 6 THR A 260
GLY A 262
PRO A 402
ASN A 403
 FAD  A1449 (-4.1A)
None
None
FAD  A1449 ( 4.5A)
 0.83A 4fjpA-4bv6A:
undetectable		 4fjpA-4bv6A:
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.
4FOR_A_FLPA711_1
(LACTOTRANSFERRIN)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 7 THR A 260
GLY A 262
PRO A 402
ASN A 403
 FAD  A1449 (-4.1A)
None
None
FAD  A1449 ( 4.5A)
 0.84A 4forA-4bv6A:
undetectable		 4forA-4bv6A:
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.
4G0V_D_MIXD101_1
(DNA TOPOISOMERASE
2-BETA)		 3qde CELLOBIOSE
PHOSPHORYLASE
(Ruminiclostridiu
m
thermocellum) 		4 / 6 ARG A 360
GLY A 358
ASN A 406
GLN A 699
 144  A 813 ( 4.8A)
None
None
PO4  A 812 ( 3.7A)
 1.03A 4g0vB-3qdeA:
undetectable		 4g0vB-3qdeA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G1B_A_ECNA403_1
(FLAVOHEMOGLOBIN)		 1dly HEMOGLOBIN
(Chlamydomonas
moewusii) 		5 / 12 PHE A  19
TYR A  20
PHE A  33
VAL A  83
LEU A  87
 None
CYN  A 122 (-4.3A)
HEM  A 144 ( 4.4A)
HEM  A 144 (-4.3A)
None
 0.88A 4g1bA-1dlyA:
10.2		 4g1bA-1dlyA:
18.25
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.
4G1B_A_ECNA403_1
(FLAVOHEMOGLOBIN)		 1fsl LEGHEMOGLOBIN A
(Glycine
max) 		5 / 12 PHE A  29
TYR A  30
VAL A 105
LEU A 109
TYR A 133
 NIO  A 145 ( 4.9A)
NIO  A 145 (-4.6A)
NIO  A 145 ( 4.0A)
None
HEM  A 144 (-2.9A)
 0.67A 4g1bA-1fslA:
13.5		 4g1bA-1fslA:
18.26
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.
4G1B_A_ECNA403_1
(FLAVOHEMOGLOBIN)		 1fsl LEGHEMOGLOBIN A
(Glycine
max) 		5 / 12 TYR A  30
PHE A  44
VAL A 105
LEU A 109
TYR A 133
 NIO  A 145 (-4.6A)
HEM  A 144 ( 3.8A)
NIO  A 145 ( 4.0A)
None
HEM  A 144 (-2.9A)
 0.78A 4g1bA-1fslA:
13.5		 4g1bA-1fslA:
18.26
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.
4G1B_A_ECNA403_1
(FLAVOHEMOGLOBIN)		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		5 / 12 PHE A  32
TYR A  33
PHE A  46
VAL A  94
LEU A  98
 FMT  A1129 ( 4.9A)
FMT  A1129 (-4.1A)
HEM  A 144 ( 3.9A)
HEM  A 144 (-4.2A)
None
 0.85A 4g1bA-5ab8A:
9.3		 4g1bA-5ab8A:
15.29
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.
4G1B_C_ECNC403_1
(FLAVOHEMOGLOBIN)		 1dly HEMOGLOBIN
(Chlamydomonas
moewusii) 		5 / 9 PHE A  19
TYR A  20
LEU A  49
VAL A  83
LEU A  87
 None
CYN  A 122 (-4.3A)
None
HEM  A 144 (-4.3A)
None
 1.11A 4g1bC-1dlyA:
3.7		 4g1bC-1dlyA:
18.25
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.
4G1B_C_ECNC403_1
(FLAVOHEMOGLOBIN)		 3wd7 TYPE III POLYKETIDE
SYNTHASES ACRIDONE
SYNTHASE
(Citrus
x
microcarpa) 		5 / 9 ILE A 148
THR A 145
LEU A 144
VAL A 186
LEU A 187
 ILE  A 148 ( 0.7A)
THR  A 145 ( 0.8A)
LEU  A 144 ( 0.5A)
VAL  A 186 ( 0.6A)
LEU  A 187 ( 0.5A)
 1.13A 4g1bC-3wd7A:
undetectable		 4g1bC-3wd7A:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G1B_D_ECND403_1
(FLAVOHEMOGLOBIN)		 1dly HEMOGLOBIN
(Chlamydomonas
moewusii) 		5 / 12 PHE A  19
TYR A  20
PHE A  33
LEU A  49
LEU A  87
 None
CYN  A 122 (-4.3A)
HEM  A 144 ( 4.4A)
None
None
 1.15A 4g1bD-1dlyA:
10.0		 4g1bD-1dlyA:
18.25
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.
4HVC_B_HFGB1602_1
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 5 THR A 318
GLU A 312
ARG A 272
HIS A 313
 None
None
NAP  A1447 (-3.8A)
NAP  A1447 (-4.3A)
 1.44A 4hvcB-4a0sA:
2.4		 4hvcB-4a0sA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4II8_A_010A210_0
(LYSOZYME C)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 7 ASP A  56
GLN A 424
ASN A  59
TRP A  61
 None
ACT  A1447 ( 4.8A)
None
None
 0.94A 4ii8A-2j7cA:
undetectable		 4ii8A-2j7cA:
14.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4IPM_A_ACTA503_0
(GH7 FAMILY PROTEIN)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		9 / 9 ASN A 141
ALA A 143
TYR A 145
TYR A 171
ASP A 173
GLU A 212
ASP A 214
GLU A 217
TRP A 374
 None
None
None
None
None
None
None
U63  A1443 ( 4.3A)
None
 0.49A 4ipmA-4v20A:
63.1		 4ipmA-4v20A:
55.76
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.
4IPM_A_ACTA503_0
(GH7 FAMILY PROTEIN)		 5w0a GLUCANASE
(Trichoderma
harzianum) 		9 / 9 ASN A 142
ALA A 144
TYR A 146
TYR A 170
ASP A 172
GLU A 196
ASP A 198
GLU A 201
TRP A 320
 ASN  A 142 ( 0.6A)
ALA  A 144 ( 0.0A)
TYR  A 146 ( 1.3A)
TYR  A 170 ( 1.3A)
ASP  A 172 ( 0.5A)
GLU  A 196 ( 0.6A)
ASP  A 198 (-0.6A)
GLU  A 201 (-0.5A)
TRP  A 320 ( 0.5A)
 0.55A 4ipmA-5w0aA:
48.2		 4ipmA-5w0aA:
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.
4IQQ_A_D16A402_1
(THYMIDYLATE SYNTHASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 ILE A 240
GLY A 147
PHE A 140
TYR A 109
 DLL  A1441 (-4.7A)
DLL  A1441 (-3.6A)
DLL  A1441 (-3.6A)
None
 0.92A 4iqqA-2y4oA:
undetectable		 4iqqA-2y4oA:
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.
4IQQ_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 8 ILE A 240
GLY A 147
PHE A 140
TYR A 109
 DLL  A1441 (-4.7A)
DLL  A1441 (-3.6A)
DLL  A1441 (-3.6A)
None
 0.78A 4iqqD-2y4oA:
undetectable		 4iqqD-2y4oA:
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.
4K0B_B_SAMB504_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4fe2 PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE
(Streptococcus
pneumoniae) 		4 / 8 ASN A  94
ARG A  93
ASN A 158
ILE A 157
 144  A 308 (-4.8A)
AIR  A 301 (-2.9A)
None
None
 1.02A 4k0bA-4fe2A:
undetectable		 4k0bA-4fe2A:
24.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K0B_B_SAMB504_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 5cdn DNA GYRASE SUBUNIT A
(Staphylococcus
aureus) 		4 / 8 ASN A  54
ASP A  40
LEU A 160
ILE A 144
 ASN  A  54 ( 0.6A)
ASP  A  40 ( 0.5A)
LEU  A 160 ( 0.6A)
ILE  A 144 ( 0.4A)
 0.97A 4k0bA-5cdnA:
undetectable		 4k0bA-5cdnA:
23.85
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.
4KFJ_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 ILE A 150
ALA A 148
ILE A 301
PRO A 300
LEU A 305
 PG4  A1443 ( 4.1A)
None
None
None
None
 1.07A 4kfjB-2veoA:
undetectable		 4kfjB-2veoA:
17.65
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.
4KIC_B_SAMB401_1
(METHYLTRANSFERASE
MPPJ)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		3 / 3 ARG A  19
ASP A  35
ASP A  30
 EDO  A1447 (-4.0A)
None
None
 0.67A 4kicB-4a35A:
2.3		 4kicB-4a35A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KR3_A_GLYA701_0
(GLYCINE--TRNA LIGASE)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		4 / 6 GLU A 296
ARG A 338
GLU A 211
GLU A 276
 None
None
None
MG  A1449 ( 2.7A)
 1.47A 4kr3A-2vqdA:
3.5		 4kr3A-2vqdA:
22.88
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.
4KRA_C_CPFC401_1
(OUTER MEMBRANE
PROTEIN F)		 2gqw FERREDOXIN REDUCTASE
(Pseudomonas
sp.
KKS102) 		5 / 9 ARG A  48
TYR A  46
GLU A  43
GLY A  79
THR A  81
 FAD  A1449 (-4.0A)
None
None
None
FAD  A1449 ( 4.3A)
 1.10A 4kraC-2gqwA:
0.0		 4kraC-2gqwA:
21.86
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.
4L6V_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 9 TRP A 252
ALA A 405
LEU A 238
GLY A 402
ALA A 279
 EOH  A1449 ( 4.1A)
None
None
None
None
 1.46A 4l6va-2bmoA:
undetectable
4l6vf-2bmoA:
0.0		 4l6va-2bmoA:
21.68
4l6vf-2bmoA:
14.99
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.
4L7I_B_SAMB501_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 5cdn DNA GYRASE SUBUNIT A
(Staphylococcus
aureus) 		4 / 8 ASN A  54
ASP A  40
LEU A 160
ILE A 144
 ASN  A  54 ( 0.6A)
ASP  A  40 ( 0.5A)
LEU  A 160 ( 0.6A)
ILE  A 144 ( 0.4A)
 0.99A 4l7iA-5cdnA:
undetectable		 4l7iA-5cdnA:
23.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LAJ_B_ACAB512_1
(HIV-1 YU2 GP120
ENVELOPE
GLYCOPROTEIN)		 5t33 RHPA GP120 CORE
(Human
immunodeficiency
virus) 		4 / 6 ASP G  57
PRO G 214
HIS G 216
ARG G 252
 None
None
None
NAG  G1448 (-3.2A)
 0.96A 4lajA-5t33G:
44.7
4lajB-5t33G:
44.9		 4lajA-5t33G:
85.56
4lajB-5t33G:
85.56
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.
4LRH_B_FOLB301_1
(FOLATE RECEPTOR
ALPHA)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 ASP A 123
TRP A 398
SER A  79
 None
IDE  A1446 (-3.6A)
None
 0.95A 4lrhB-2j7cA:
undetectable		 4lrhB-2j7cA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LRH_F_FOLF301_1
(FOLATE RECEPTOR
ALPHA)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 ASP A 123
TRP A 398
SER A  79
 None
IDE  A1446 (-3.6A)
None
 1.04A 4lrhF-2j7cA:
undetectable		 4lrhF-2j7cA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LTW_A_STRA301_2
(ANCESTRAL STEROID
RECEPTOR 2)		 1dly HEMOGLOBIN
(Chlamydomonas
moewusii) 		4 / 8 ALA A  15
THR A 111
VAL A 115
PHE A  80
 None
HEM  A 144 ( 4.1A)
None
HEM  A 144 (-4.4A)
 0.77A 4ltwA-1dlyA:
undetectable		 4ltwA-1dlyA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MJW_A_ACTA603_0
(CHOLINE OXIDASE)		 3pjp TRANSCRIPTION
ELONGATION FACTOR
SPT6
([Candida]
glabrata) 		3 / 3 ARG A1285
HIS A1289
SER A1284
 ACT  A1445 (-4.7A)
None
ACT  A1445 (-3.1A)
 0.86A 4mjwA-3pjpA:
undetectable
4mjwB-3pjpA:
undetectable		 4mjwA-3pjpA:
16.55
4mjwB-3pjpA:
16.55
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.
4MJW_B_ACTB603_0
(CHOLINE OXIDASE)		 3pjp TRANSCRIPTION
ELONGATION FACTOR
SPT6
([Candida]
glabrata) 		3 / 3 SER A1284
ARG A1285
HIS A1289
 ACT  A1445 (-3.1A)
ACT  A1445 (-4.7A)
None
 0.91A 4mjwA-3pjpA:
undetectable
4mjwB-3pjpA:
undetectable		 4mjwA-3pjpA:
16.55
4mjwB-3pjpA:
16.55
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.
4MM7_A_29JA603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 10 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.03A 4mm7A-2cdpA:
undetectable		 4mm7A-2cdpA:
14.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MM9_A_FVXA603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 11 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.13A 4mm9A-2cdpA:
undetectable		 4mm9A-2cdpA:
14.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MMA_A_CXXA603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 11 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.04A 4mmaA-2cdpA:
undetectable		 4mmaA-2cdpA:
14.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MMC_A_29JA603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 10 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 0.97A 4mmcA-2cdpA:
undetectable		 4mmcA-2cdpA:
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.
4MMD_B_29EB603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 12 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.04A 4mmdB-2cdpA:
undetectable		 4mmdB-2cdpA:
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.
4MME_A_29QA603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 9 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.01A 4mmeA-2cdpA:
undetectable		 4mmeA-2cdpA:
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.
4MME_B_29QB603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 9 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 0.93A 4mmeB-2cdpA:
undetectable		 4mmeB-2cdpA:
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.
4MMF_A_29QA603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 9 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.03A 4mmfA-2cdpA:
undetectable		 4mmfA-2cdpA:
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.
4MMF_B_29QB603_1
(TRANSPORTER)		 2cdp BETA-AGARASE 1
(Saccharophagus
degradans) 		5 / 9 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 1.01A 4mmfB-2cdpA:
undetectable		 4mmfB-2cdpA:
14.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4MV7_A_PPFA501_1
(BIOTIN CARBOXYLASE)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		7 / 7 LYS A 238
ASN A 290
ARG A 292
GLN A 294
VAL A 295
GLU A 296
ARG A 338
 None
MG  A1449 ( 4.3A)
None
None
None
None
None
 0.59A 4mv7A-2vqdA:
62.1		 4mv7A-2vqdA:
68.43
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.
4N48_B_SAMB601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 4cn8 PROXIMAL THREAD
MATRIX PROTEIN 1
(Mytilus
galloprovinciali
s) 		4 / 5 ASN A 265
PRO A 329
ASP A 339
ASP A 369
 None
EDO  A1449 ( 4.3A)
None
None
 1.12A 4n48B-4cn8A:
undetectable		 4n48B-4cn8A:
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.
4NJV_A_RITA500_1
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 12 ARG A 221
GLY A 262
ALA A 261
ASP A 260
ILE A 215
 None
None
None
MN  A1442 (-2.0A)
None
 0.90A 4njvA-2bwsA:
undetectable		 4njvA-2bwsA:
11.99
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.
4OBW_C_SAMC601_1
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		4 / 5 ALA A  27
ASP A  52
MET A  57
ASN A  80
 NAD  A1445 (-3.4A)
NAD  A1445 (-2.7A)
NAD  A1445 (-4.3A)
NAD  A1445 (-4.4A)
 0.99A 4obwC-2ixbA:
3.6		 4obwC-2ixbA:
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.
4OLT_A_GCSA306_1
(CHITOSANASE)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		3 / 3 SER A 355
ASP A 272
GLN A 188
 None
PEG  A1445 (-3.9A)
None
 0.84A 4oltA-2yokA:
undetectable
4oltB-2yokA:
undetectable		 4oltA-2yokA:
19.04
4oltB-2yokA:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OR0_A_NPSA601_1
(SERUM ALBUMIN)		 4fe2 PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE
(Streptococcus
pneumoniae) 		5 / 11 VAL A  65
GLY A  64
THR A  67
LEU A 189
SER A  53
 144  A 307 ( 4.3A)
144  A 304 ( 3.6A)
None
None
None
 1.48A 4or0A-4fe2A:
undetectable		 4or0A-4fe2A:
18.63
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.
4P6V_E_RBFE201_1
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT B
NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT E)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		4 / 5 HIS A 209
VAL A 210
GLU A 211
LYS A 238
 AP2  A1448 (-3.7A)
None
None
None
 1.22A 4p6vB-2vqdA:
undetectable
4p6vE-2vqdA:
undetectable		 4p6vB-2vqdA:
21.44
4p6vE-2vqdA:
19.12
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.
4PFJ_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.33A 4pfjA-2bmoA:
undetectable		 4pfjA-2bmoA:
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.
4PO0_A_NPSA602_1
(SERUM ALBUMIN)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		4 / 8 ALA A 218
GLY A 237
LEU A 241
GLU A 155
 PG4  A1443 (-4.4A)
PG4  A1443 (-3.6A)
PG4  A1443 ( 4.9A)
None
 0.83A 4po0A-2veoA:
undetectable		 4po0A-2veoA:
22.68
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.
4PQA_A_X8ZA401_1
(SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		6 / 11 HIS A  62
ASP A 166
GLU A 198
GLU A 199
GLY A 281
HIS A 308
 ZN  A1446 (-3.3A)
ZN  A1446 ( 2.3A)
ZN  A1446 ( 4.6A)
ZN  A1447 (-2.0A)
None
ZN  A1447 (-3.2A)
 0.75A 4pqaA-1yloA:
23.5		 4pqaA-1yloA:
25.62
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.
4PWD_A_NVPA901_1
(HIV-1 REVERSE
TRANSCRIPTASE, P66
SUBUNIT)		 1qhq PROTEIN (AURACYANIN)
(Chloroflexus
aurantiacus) 		4 / 8 PRO A 113
LEU A  94
VAL A  68
TYR A 118
 None
None
SO4  A 144 (-3.7A)
None
 0.92A 4pwdA-1qhqA:
undetectable		 4pwdA-1qhqA:
12.41
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.
4Q5M_A_ROCA1101_3
(PROTEASE)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		3 / 3 ASP A 271
ASP A 260
ASN A 230
 MN  A1442 ( 2.4A)
MN  A1442 (-2.0A)
None
 0.84A 4q5mA-2bwsA:
undetectable		 4q5mA-2bwsA:
19.58
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.
4QB9_E_PARE500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 2veo LIPASE A
(Moesziomyces
antarcticus) 		5 / 12 PHE A 233
LEU A 367
GLU A 181
ASP A 122
GLY A 213
 PG4  A1443 (-4.7A)
None
None
None
None
 1.35A 4qb9E-2veoA:
1.1		 4qb9E-2veoA:
23.69
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.
4QTU_B_SAMB301_1
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 5 TYR A 171
SER A 372
ASP A 214
ASP A 262
 None
None
None
U63  A1443 ( 3.9A)
 1.06A 4qtuB-4v20A:
undetectable		 4qtuB-4v20A:
20.31
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.
4QWP_B_GCSB304_1
(CHITOSANASE)		 2yok EXOGLUCANASE 1
(Trichoderma
harzianum) 		3 / 3 GLN A 188
SER A 355
ASP A 272
 None
None
PEG  A1445 (-3.9A)
 0.82A 4qwpA-2yokA:
undetectable
4qwpB-2yokA:
undetectable		 4qwpA-2yokA:
18.85
4qwpB-2yokA:
18.85
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.
4R1Z_B_AERB601_1
(CYP17A1 PROTEIN)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		4 / 7 ALA A  94
ALA A 254
GLU A 257
THR A 258
 REA  A1445 ( 3.7A)
HEM  A1444 (-3.3A)
None
HEM  A1444 ( 3.3A)
 0.79A 4r1zB-2ve3A:
36.4		 4r1zB-2ve3A:
27.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R29_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 12 ALA A 260
SER A 230
GLY A 407
GLN A 405
GLY A 441
 None
NAP  A1447 (-3.6A)
None
NAP  A1447 (-3.5A)
None
 1.06A 4r29A-4a0sA:
undetectable		 4r29A-4a0sA:
17.12
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.
4R29_D_SAMD301_0
(UNCHARACTERIZED
PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 12 ALA A 260
SER A 230
GLY A 407
GLN A 405
GLY A 441
 None
NAP  A1447 (-3.6A)
None
NAP  A1447 (-3.5A)
None
 1.07A 4r29D-4a0sA:
undetectable		 4r29D-4a0sA:
17.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RJD_A_TFPA203_1
(CALMODULIN)		 4gow CALMODULIN
(Homo
sapiens) 		7 / 8 ILE D 100
LEU D 105
MET D 109
MET D 124
ALA D 128
VAL D 136
MET D 144
 ILE  D 100 ( 0.7A)
LEU  D 105 ( 0.6A)
MET  D 109 ( 0.0A)
MET  D 124 ( 0.0A)
ALA  D 128 ( 0.0A)
VAL  D 136 ( 0.6A)
MET  D 144 ( 0.0A)
 0.80A 4rjdA-4gowD:
12.6		 4rjdA-4gowD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RJD_B_TFPB203_1
(CALMODULIN)		 4gow CALMODULIN
(Homo
sapiens) 		7 / 7 PHE D  92
LEU D 105
MET D 109
MET D 124
ALA D 128
MET D 144
MET D 145
 PHE  D  92 ( 1.3A)
LEU  D 105 ( 0.6A)
MET  D 109 ( 0.0A)
MET  D 124 ( 0.0A)
ALA  D 128 ( 0.0A)
MET  D 144 ( 0.0A)
MET  D 145 ( 0.0A)
 0.93A 4rjdB-4gowD:
12.6		 4rjdB-4gowD:
100.00
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.
4TZC_D_EF2D505_1
(PROTEIN CEREBLON)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		4 / 8 TYR A 667
TRP A 665
HIS A 594
PHE A 939
 BGC  A2144 (-4.5A)
None
None
None
 1.13A 4tzcB-2ya1A:
undetectable
4tzcD-2ya1A:
undetectable		 4tzcB-2ya1A:
6.68
4tzcD-2ya1A:
6.68
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.
4U15_A_0HKA2001_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 2b92 INTERFERON-INDUCED
GUANYLATE-BINDING
PROTEIN 1
(Homo
sapiens) 		3 / 3 ASN A 111
PHE A 116
TYR A 144
 ASN  A 111 ( 0.6A)
PHE  A 116 ( 1.3A)
TYR  A 144 ( 1.3A)
 0.58A 4u15A-2b92A:
undetectable		 4u15A-2b92A:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U15_A_0HKA2001_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 ASN A 165
PHE A 396
TYR A  76
 IDE  A1446 (-3.1A)
None
None
 0.66A 4u15A-2j7cA:
undetectable		 4u15A-2j7cA:
21.07
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.
4UG5_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		3 / 3 ARG A 323
THR A  95
TRP A  80
 HEM  A1444 (-2.7A)
None
REA  A1445 ( 3.9A)
 1.12A 4ug5A-2ve3A:
undetectable		 4ug5A-2ve3A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UGL_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		3 / 3 ARG A 323
THR A  95
TRP A  80
 HEM  A1444 (-2.7A)
None
REA  A1445 ( 3.9A)
 1.05A 4uglA-2ve3A:
undetectable		 4uglA-2ve3A:
20.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4V20_A_ACTA1444_0
(CELLOBIOHYDROLASE)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		5 / 5 GLY A   4
THR A   5
HIS A  42
GLY A  45
GLU A  74
 ACT  A1444 ( 3.7A)
ACT  A1444 (-3.9A)
ACT  A1444 (-4.6A)
ACT  A1444 (-3.8A)
ACT  A1444 ( 4.8A)
 0.00A 4v20A-4v20A:
75.5		 4v20A-4v20A:
100.00
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.
4XI3_B_29SB601_2
(ESTROGEN RECEPTOR)		 1igw ISOCITRATE LYASE
(Escherichia
coli) 		4 / 5 LEU A 229
MET A 175
LEU A 171
HIS A 184
 None
None
None
PYR  A1444 (-4.5A)
 1.37A 4xi3B-1igwA:
0.0		 4xi3B-1igwA:
19.41
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.
4XT7_A_TOPA302_1
(RV2671)		 2bws XAA-PRO
AMINOPEPTIDASE P
(Escherichia
coli) 		5 / 11 ILE A 272
GLY A 262
ASP A 408
GLU A 383
THR A 420
 None
None
None
MN  A1441 (-2.5A)
None
 1.37A 4xt7A-2bwsA:
undetectable		 4xt7A-2bwsA:
23.09
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.
4YDQ_B_HFGB802_0
(PROLINE--TRNA LIGASE)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		5 / 12 PHE A  96
THR A  34
ARG A  31
HIS A 372
GLY A 374
 None
None
NAD  A1445 (-3.4A)
None
None
 1.42A 4ydqB-2ixbA:
undetectable		 4ydqB-2ixbA:
22.91
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.
4YPM_A_BO2A801_1
(LON PROTEASE)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 12 ALA A 444
THR A 445
GLY A 231
SER A 230
ALA A 260
 None
None
NAP  A1447 (-3.3A)
NAP  A1447 (-3.6A)
None
 1.16A 4ypmA-4a0sA:
undetectable		 4ypmA-4a0sA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YPM_A_BO2A801_1
(LON PROTEASE)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 12 ALA A 444
THR A 445
GLY A 407
SER A 230
ALA A 260
 None
None
None
NAP  A1447 (-3.6A)
None
 1.09A 4ypmA-4a0sA:
undetectable		 4ypmA-4a0sA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZBR_A_ACTA608_0
(SERUM ALBUMIN)		 3bdd REGULATORY PROTEIN
MARR
(Streptococcus
suis) 		3 / 3 LYS A  66
ARG A  32
HIS A  64
 None
GOL  A 144 ( 3.2A)
GOL  A 144 (-4.5A)
 0.94A 4zbrA-3bddA:
undetectable		 4zbrA-3bddA:
11.66
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.
5AOX_C_ACTC1001_0
(ALU JO CONSENSUS RNA
SIGNAL RECOGNITION
PARTICLE 14 KDA
PROTEIN)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		3 / 3 TYR A  20
THR A 320
THR A  43
 GOL  A1439 ( 3.5A)
GOL  A1442 ( 4.7A)
GOL  A1442 (-4.2A)
 0.78A 5aoxB-2w38A:
undetectable		 5aoxB-2w38A:
14.25
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.
5AOX_F_ACTF1001_0
(ALU JO CONSENSUS RNA
SIGNAL RECOGNITION
PARTICLE 14 KDA
PROTEIN)		 2w38 SIALIDASE
(Pseudomonas
aeruginosa) 		3 / 3 TYR A  20
THR A 320
THR A  43
 GOL  A1439 ( 3.5A)
GOL  A1442 ( 4.7A)
GOL  A1442 (-4.2A)
 0.83A 5aoxE-2w38A:
2.5		 5aoxE-2w38A:
14.25
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.
5B1A_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.06A 5b1aA-1h4pA:
0.3
5b1aC-1h4pA:
undetectable
5b1aP-1h4pA:
undetectable		 5b1aA-1h4pA:
21.08
5b1aC-1h4pA:
18.60
5b1aP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1B_C_CHDC307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.14A 5b1bA-1h4pA:
0.0
5b1bC-1h4pA:
undetectable
5b1bP-1h4pA:
undetectable		 5b1bA-1h4pA:
21.08
5b1bC-1h4pA:
18.60
5b1bP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B3S_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.05A 5b3sA-1h4pA:
0.3
5b3sC-1h4pA:
undetectable
5b3sP-1h4pA:
undetectable		 5b3sA-1h4pA:
21.08
5b3sC-1h4pA:
18.60
5b3sP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 ARG A 776
ASP A 778
GLU A 807
HIS A 894
ASP A 895
 None
BGC  A2144 (-2.8A)
GLC  A2150 ( 4.5A)
None
GLC  A2150 ( 4.3A)
 0.34A 5csyB-2ya1A:
16.3		 5csyB-2ya1A:
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.
5D4U_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN MJ0489)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 226
ILE A 265
LEU A 255
GLY A 289
GLY A 404
 None
None
None
GOL  A1449 (-3.9A)
None
 1.06A 5d4uA-1h4pA:
undetectable		 5d4uA-1h4pA:
21.14
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.
5D4U_B_SAMB301_0
(UNCHARACTERIZED
PROTEIN MJ0489)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 226
ILE A 265
LEU A 255
GLY A 289
GLY A 404
 None
None
None
GOL  A1449 (-3.9A)
None
 1.06A 5d4uB-1h4pA:
undetectable		 5d4uB-1h4pA:
21.14
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.
5E72_A_SAMA400_0
(N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE)		 2rfm PUTATIVE ANKYRIN
REPEAT PROTEIN
TV1425
(Thermoplasma
volcanium) 		5 / 12 ILE A 182
ILE A 157
ILE A 106
ARG A 143
LEU A 118
 None
None
None
144  A 194 (-4.8A)
None
 1.05A 5e72A-2rfmA:
undetectable		 5e72A-2rfmA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEU_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5eeuC-4a0sA:
undetectable
5eeuD-4a0sA:
undetectable		 5eeuC-4a0sA:
10.76
5eeuD-4a0sA:
10.76
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.
5EEU_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eeuD-4bv6A:
undetectable
5eeuE-4bv6A:
undetectable		 5eeuD-4bv6A:
9.71
5eeuE-4bv6A:
9.71
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.
5EEU_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.23A 5eeuG-4a0sA:
undetectable
5eeuH-4a0sA:
undetectable		 5eeuG-4a0sA:
10.76
5eeuH-4a0sA:
10.76
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.
5EEU_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eeuH-4bv6A:
undetectable
5eeuI-4bv6A:
undetectable		 5eeuH-4bv6A:
9.71
5eeuI-4bv6A:
9.71
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.
5EEU_J_TRPJ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eeuJ-4bv6A:
undetectable
5eeuK-4bv6A:
undetectable		 5eeuJ-4bv6A:
9.71
5eeuK-4bv6A:
9.71
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.
5EEU_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.29A 5eeuL-4a0sA:
undetectable
5eeuV-4a0sA:
undetectable		 5eeuL-4a0sA:
10.76
5eeuV-4a0sA:
10.76
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.
5EEU_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eeuL-4a0sA:
undetectable
5eeuM-4a0sA:
undetectable		 5eeuL-4a0sA:
10.76
5eeuM-4a0sA:
10.76
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.
5EEU_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.30A 5eeuM-4a0sA:
undetectable
5eeuN-4a0sA:
undetectable		 5eeuM-4a0sA:
10.76
5eeuN-4a0sA:
10.76
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.
5EEU_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eeuN-4a0sA:
undetectable
5eeuO-4a0sA:
undetectable		 5eeuN-4a0sA:
10.76
5eeuO-4a0sA:
10.76
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.
5EEU_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eeuP-4a0sA:
undetectable
5eeuQ-4a0sA:
undetectable		 5eeuP-4a0sA:
10.76
5eeuQ-4a0sA:
10.76
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.
5EEU_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.28A 5eeuR-4a0sA:
undetectable
5eeuS-4a0sA:
undetectable		 5eeuR-4a0sA:
10.76
5eeuS-4a0sA:
10.76
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.
5EEU_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eeuS-4a0sA:
undetectable
5eeuT-4a0sA:
undetectable		 5eeuS-4a0sA:
10.76
5eeuT-4a0sA:
10.76
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.
5EEU_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eeuT-4a0sA:
undetectable
5eeuU-4a0sA:
undetectable		 5eeuT-4a0sA:
10.76
5eeuU-4a0sA:
10.76
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.
5EEU_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.28A 5eeuU-4a0sA:
undetectable
5eeuV-4a0sA:
undetectable		 5eeuU-4a0sA:
10.76
5eeuV-4a0sA:
10.76
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.
5EEV_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5eevC-4a0sA:
undetectable
5eevD-4a0sA:
undetectable		 5eevC-4a0sA:
10.76
5eevD-4a0sA:
10.76
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.
5EEV_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eevD-4bv6A:
undetectable
5eevE-4bv6A:
undetectable		 5eevD-4bv6A:
9.71
5eevE-4bv6A:
9.71
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.
5EEV_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5eevG-4a0sA:
undetectable
5eevH-4a0sA:
undetectable		 5eevG-4a0sA:
10.76
5eevH-4a0sA:
10.76
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.
5EEV_J_TRPJ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eevJ-4bv6A:
undetectable
5eevK-4bv6A:
undetectable		 5eevJ-4bv6A:
9.71
5eevK-4bv6A:
9.71
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.
5EEV_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 8 SER A 322
GLY A 228
HIS A 313
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
NAP  A1447 (-4.6A)
 0.94A 5eevL-4a0sA:
undetectable
5eevV-4a0sA:
undetectable		 5eevL-4a0sA:
10.76
5eevV-4a0sA:
10.76
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.
5EEV_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 5eevL-5fulA:
undetectable
5eevV-5fulA:
undetectable		 5eevL-5fulA:
10.25
5eevV-5fulA:
10.25
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.
5EEV_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eevL-4a0sA:
undetectable
5eevM-4a0sA:
undetectable		 5eevL-4a0sA:
10.76
5eevM-4a0sA:
10.76
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.
5EEV_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eevM-4a0sA:
undetectable
5eevN-4a0sA:
undetectable		 5eevM-4a0sA:
10.76
5eevN-4a0sA:
10.76
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.
5EEV_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eevN-4a0sA:
undetectable
5eevO-4a0sA:
undetectable		 5eevN-4a0sA:
10.76
5eevO-4a0sA:
10.76
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.
5EEV_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eevP-4a0sA:
undetectable
5eevQ-4a0sA:
undetectable		 5eevP-4a0sA:
10.76
5eevQ-4a0sA:
10.76
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.
5EEV_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eevR-4a0sA:
undetectable
5eevS-4a0sA:
undetectable		 5eevR-4a0sA:
10.76
5eevS-4a0sA:
10.76
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.
5EEV_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eevS-4a0sA:
undetectable
5eevT-4a0sA:
undetectable		 5eevS-4a0sA:
10.76
5eevT-4a0sA:
10.76
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.
5EEV_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eevT-4a0sA:
undetectable
5eevU-4a0sA:
undetectable		 5eevT-4a0sA:
10.76
5eevU-4a0sA:
10.76
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.
5EEV_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eevU-4a0sA:
undetectable
5eevV-4a0sA:
undetectable		 5eevU-4a0sA:
10.76
5eevV-4a0sA:
10.76
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.
5EEW_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5eewC-4a0sA:
undetectable
5eewD-4a0sA:
undetectable		 5eewC-4a0sA:
10.76
5eewD-4a0sA:
10.76
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.
5EEW_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eewD-4bv6A:
undetectable
5eewE-4bv6A:
undetectable		 5eewD-4bv6A:
9.71
5eewE-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEW_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5eewG-4a0sA:
undetectable
5eewH-4a0sA:
undetectable		 5eewG-4a0sA:
10.76
5eewH-4a0sA:
10.76
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.
5EEW_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eewH-4bv6A:
undetectable
5eewI-4bv6A:
undetectable		 5eewH-4bv6A:
9.71
5eewI-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEW_J_TRPJ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eewJ-4bv6A:
undetectable
5eewK-4bv6A:
undetectable		 5eewJ-4bv6A:
9.71
5eewK-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEW_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 8 SER A 322
GLY A 228
HIS A 313
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
NAP  A1447 (-4.6A)
 0.94A 5eewL-4a0sA:
undetectable
5eewV-4a0sA:
undetectable		 5eewL-4a0sA:
10.76
5eewV-4a0sA:
10.76
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.
5EEW_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 5eewL-5fulA:
undetectable
5eewV-5fulA:
undetectable		 5eewL-5fulA:
10.25
5eewV-5fulA:
10.25
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.
5EEW_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eewL-4a0sA:
undetectable
5eewM-4a0sA:
undetectable		 5eewL-4a0sA:
10.76
5eewM-4a0sA:
10.76
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.
5EEW_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eewM-4a0sA:
undetectable
5eewN-4a0sA:
undetectable		 5eewM-4a0sA:
10.76
5eewN-4a0sA:
10.76
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.
5EEW_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eewN-4a0sA:
undetectable
5eewO-4a0sA:
undetectable		 5eewN-4a0sA:
10.76
5eewO-4a0sA:
10.76
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.
5EEW_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eewP-4a0sA:
undetectable
5eewQ-4a0sA:
undetectable		 5eewP-4a0sA:
10.76
5eewQ-4a0sA:
10.76
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.
5EEW_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eewR-4a0sA:
undetectable
5eewS-4a0sA:
undetectable		 5eewR-4a0sA:
10.76
5eewS-4a0sA:
10.76
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.
5EEW_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eewS-4a0sA:
undetectable
5eewT-4a0sA:
undetectable		 5eewS-4a0sA:
10.76
5eewT-4a0sA:
10.76
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.
5EEW_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eewT-4a0sA:
undetectable
5eewU-4a0sA:
undetectable		 5eewT-4a0sA:
10.76
5eewU-4a0sA:
10.76
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.
5EEW_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eewU-4a0sA:
undetectable
5eewV-4a0sA:
undetectable		 5eewU-4a0sA:
10.76
5eewV-4a0sA:
10.76
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.
5EEX_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5eexC-4a0sA:
undetectable
5eexD-4a0sA:
undetectable		 5eexC-4a0sA:
10.76
5eexD-4a0sA:
10.76
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.
5EEX_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eexD-4bv6A:
undetectable
5eexE-4bv6A:
undetectable		 5eexD-4bv6A:
9.71
5eexE-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEX_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5eexG-4a0sA:
undetectable
5eexH-4a0sA:
undetectable		 5eexG-4a0sA:
10.76
5eexH-4a0sA:
10.76
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.
5EEX_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.31A 5eexH-4bv6A:
undetectable
5eexI-4bv6A:
undetectable		 5eexH-4bv6A:
9.71
5eexI-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEX_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 5eexI-4a0sA:
undetectable
5eexJ-4a0sA:
undetectable		 5eexI-4a0sA:
10.76
5eexJ-4a0sA:
10.76
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.
5EEX_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eexI-4bv6A:
undetectable
5eexJ-4bv6A:
undetectable		 5eexI-4bv6A:
9.71
5eexJ-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEX_J_TRPJ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eexJ-4bv6A:
undetectable
5eexK-4bv6A:
undetectable		 5eexJ-4bv6A:
9.71
5eexK-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEX_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.27A 5eexA-4a0sA:
undetectable
5eexK-4a0sA:
undetectable		 5eexA-4a0sA:
10.76
5eexK-4a0sA:
10.76
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.
5EEX_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 5eexL-4a0sA:
undetectable
5eexV-4a0sA:
undetectable		 5eexL-4a0sA:
10.76
5eexV-4a0sA:
10.76
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.
5EEX_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eexL-4a0sA:
undetectable
5eexM-4a0sA:
undetectable		 5eexL-4a0sA:
10.76
5eexM-4a0sA:
10.76
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.
5EEX_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eexM-4a0sA:
undetectable
5eexN-4a0sA:
undetectable		 5eexM-4a0sA:
10.76
5eexN-4a0sA:
10.76
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.
5EEX_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eexN-4a0sA:
undetectable
5eexO-4a0sA:
undetectable		 5eexN-4a0sA:
10.76
5eexO-4a0sA:
10.76
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.
5EEX_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eexP-4a0sA:
undetectable
5eexQ-4a0sA:
undetectable		 5eexP-4a0sA:
10.76
5eexQ-4a0sA:
10.76
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.
5EEX_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eexR-4a0sA:
undetectable
5eexS-4a0sA:
undetectable		 5eexR-4a0sA:
10.76
5eexS-4a0sA:
10.76
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.
5EEX_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eexS-4a0sA:
undetectable
5eexT-4a0sA:
undetectable		 5eexS-4a0sA:
10.76
5eexT-4a0sA:
10.76
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.
5EEX_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eexT-4a0sA:
undetectable
5eexU-4a0sA:
undetectable		 5eexT-4a0sA:
10.76
5eexU-4a0sA:
10.76
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.
5EEX_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eexU-4a0sA:
undetectable
5eexV-4a0sA:
undetectable		 5eexU-4a0sA:
10.76
5eexV-4a0sA:
10.76
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.
5EEY_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5eeyC-4a0sA:
undetectable
5eeyD-4a0sA:
undetectable		 5eeyC-4a0sA:
10.76
5eeyD-4a0sA:
10.76
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.
5EEY_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eeyD-4bv6A:
undetectable
5eeyE-4bv6A:
undetectable		 5eeyD-4bv6A:
9.71
5eeyE-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEY_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5eeyG-4a0sA:
undetectable
5eeyH-4a0sA:
undetectable		 5eeyG-4a0sA:
10.76
5eeyH-4a0sA:
10.76
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.
5EEY_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 5eeyI-4a0sA:
undetectable
5eeyJ-4a0sA:
undetectable		 5eeyI-4a0sA:
10.76
5eeyJ-4a0sA:
10.76
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.
5EEY_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eeyI-4bv6A:
undetectable
5eeyJ-4bv6A:
undetectable		 5eeyI-4bv6A:
9.71
5eeyJ-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEY_J_TRPJ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.32A 5eeyJ-4bv6A:
undetectable
5eeyK-4bv6A:
undetectable		 5eeyJ-4bv6A:
9.71
5eeyK-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEY_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 5eeyL-4a0sA:
undetectable
5eeyV-4a0sA:
undetectable		 5eeyL-4a0sA:
10.76
5eeyV-4a0sA:
10.76
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.
5EEY_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eeyL-4a0sA:
undetectable
5eeyM-4a0sA:
undetectable		 5eeyL-4a0sA:
10.76
5eeyM-4a0sA:
10.76
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.
5EEY_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eeyM-4a0sA:
undetectable
5eeyN-4a0sA:
undetectable		 5eeyM-4a0sA:
10.76
5eeyN-4a0sA:
10.76
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.
5EEY_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eeyN-4a0sA:
undetectable
5eeyO-4a0sA:
undetectable		 5eeyN-4a0sA:
10.76
5eeyO-4a0sA:
10.76
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.
5EEY_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eeyP-4a0sA:
undetectable
5eeyQ-4a0sA:
undetectable		 5eeyP-4a0sA:
10.76
5eeyQ-4a0sA:
10.76
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.
5EEY_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eeyR-4a0sA:
undetectable
5eeyS-4a0sA:
undetectable		 5eeyR-4a0sA:
10.76
5eeyS-4a0sA:
10.76
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.
5EEY_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eeyS-4a0sA:
undetectable
5eeyT-4a0sA:
undetectable		 5eeyS-4a0sA:
10.76
5eeyT-4a0sA:
10.76
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.
5EEY_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eeyT-4a0sA:
undetectable
5eeyU-4a0sA:
undetectable		 5eeyT-4a0sA:
10.76
5eeyU-4a0sA:
10.76
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.
5EEY_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eeyU-4a0sA:
undetectable
5eeyV-4a0sA:
undetectable		 5eeyU-4a0sA:
10.76
5eeyV-4a0sA:
10.76
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.
5EEZ_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5eezC-4a0sA:
undetectable
5eezD-4a0sA:
undetectable		 5eezC-4a0sA:
10.76
5eezD-4a0sA:
10.76
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.
5EEZ_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.27A 5eezD-4bv6A:
undetectable
5eezE-4bv6A:
undetectable		 5eezD-4bv6A:
9.71
5eezE-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEZ_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5eezG-4a0sA:
undetectable
5eezH-4a0sA:
undetectable		 5eezG-4a0sA:
10.76
5eezH-4a0sA:
10.76
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.
5EEZ_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 5eezI-4a0sA:
undetectable
5eezJ-4a0sA:
undetectable		 5eezI-4a0sA:
10.76
5eezJ-4a0sA:
10.76
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.
5EEZ_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5eezI-4bv6A:
undetectable
5eezJ-4bv6A:
undetectable		 5eezI-4bv6A:
9.71
5eezJ-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEZ_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 8 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 5eezL-4a0sA:
undetectable
5eezV-4a0sA:
undetectable		 5eezL-4a0sA:
10.76
5eezV-4a0sA:
10.76
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.
5EEZ_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 5eezL-5fulA:
undetectable
5eezV-5fulA:
undetectable		 5eezL-5fulA:
10.25
5eezV-5fulA:
10.25
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.
5EEZ_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eezL-4a0sA:
undetectable
5eezM-4a0sA:
undetectable		 5eezL-4a0sA:
10.76
5eezM-4a0sA:
10.76
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.
5EEZ_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eezM-4a0sA:
undetectable
5eezN-4a0sA:
undetectable		 5eezM-4a0sA:
10.76
5eezN-4a0sA:
10.76
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.
5EEZ_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5eezN-4a0sA:
undetectable
5eezO-4a0sA:
undetectable		 5eezN-4a0sA:
10.76
5eezO-4a0sA:
10.76
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.
5EEZ_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eezP-4a0sA:
undetectable
5eezQ-4a0sA:
undetectable		 5eezP-4a0sA:
10.76
5eezQ-4a0sA:
10.76
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.
5EEZ_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eezR-4a0sA:
undetectable
5eezS-4a0sA:
undetectable		 5eezR-4a0sA:
10.76
5eezS-4a0sA:
10.76
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.
5EEZ_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5eezS-4a0sA:
undetectable
5eezT-4a0sA:
undetectable		 5eezS-4a0sA:
10.76
5eezT-4a0sA:
10.76
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.
5EEZ_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5eezT-4a0sA:
undetectable
5eezU-4a0sA:
undetectable		 5eezT-4a0sA:
10.76
5eezU-4a0sA:
10.76
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.
5EEZ_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5eezU-4a0sA:
undetectable
5eezV-4a0sA:
undetectable		 5eezU-4a0sA:
10.76
5eezV-4a0sA:
10.76
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.
5EF0_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5ef0C-4a0sA:
undetectable
5ef0D-4a0sA:
undetectable		 5ef0C-4a0sA:
10.76
5ef0D-4a0sA:
10.76
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.
5EF0_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.27A 5ef0D-4bv6A:
undetectable
5ef0E-4bv6A:
undetectable		 5ef0D-4bv6A:
9.71
5ef0E-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF0_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5ef0G-4a0sA:
undetectable
5ef0H-4a0sA:
undetectable		 5ef0G-4a0sA:
10.76
5ef0H-4a0sA:
10.76
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.
5EF0_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5ef0I-4a0sA:
undetectable
5ef0J-4a0sA:
undetectable		 5ef0I-4a0sA:
10.76
5ef0J-4a0sA:
10.76
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.
5EF0_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5ef0I-4bv6A:
undetectable
5ef0J-4bv6A:
undetectable		 5ef0I-4bv6A:
9.71
5ef0J-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF0_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.27A 5ef0A-4a0sA:
undetectable
5ef0K-4a0sA:
undetectable		 5ef0A-4a0sA:
10.76
5ef0K-4a0sA:
10.76
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.
5EF0_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 5ef0L-4a0sA:
undetectable
5ef0V-4a0sA:
undetectable		 5ef0L-4a0sA:
10.76
5ef0V-4a0sA:
10.76
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.
5EF0_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef0L-4a0sA:
undetectable
5ef0M-4a0sA:
undetectable		 5ef0L-4a0sA:
10.76
5ef0M-4a0sA:
10.76
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.
5EF0_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef0M-4a0sA:
undetectable
5ef0N-4a0sA:
undetectable		 5ef0M-4a0sA:
10.76
5ef0N-4a0sA:
10.76
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.
5EF0_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef0N-4a0sA:
undetectable
5ef0O-4a0sA:
undetectable		 5ef0N-4a0sA:
10.76
5ef0O-4a0sA:
10.76
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.
5EF0_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef0P-4a0sA:
undetectable
5ef0Q-4a0sA:
undetectable		 5ef0P-4a0sA:
10.76
5ef0Q-4a0sA:
10.76
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.
5EF0_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef0R-4a0sA:
undetectable
5ef0S-4a0sA:
undetectable		 5ef0R-4a0sA:
10.76
5ef0S-4a0sA:
10.76
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.
5EF0_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef0S-4a0sA:
undetectable
5ef0T-4a0sA:
undetectable		 5ef0S-4a0sA:
10.76
5ef0T-4a0sA:
10.76
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.
5EF0_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef0T-4a0sA:
undetectable
5ef0U-4a0sA:
undetectable		 5ef0T-4a0sA:
10.76
5ef0U-4a0sA:
10.76
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.
5EF0_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef0U-4a0sA:
undetectable
5ef0V-4a0sA:
undetectable		 5ef0U-4a0sA:
10.76
5ef0V-4a0sA:
10.76
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.
5EF1_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5ef1C-4a0sA:
undetectable
5ef1D-4a0sA:
undetectable		 5ef1C-4a0sA:
10.76
5ef1D-4a0sA:
10.76
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.
5EF1_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.27A 5ef1D-4bv6A:
undetectable
5ef1E-4bv6A:
undetectable		 5ef1D-4bv6A:
9.71
5ef1E-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF1_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5ef1G-4a0sA:
undetectable
5ef1H-4a0sA:
undetectable		 5ef1G-4a0sA:
10.76
5ef1H-4a0sA:
10.76
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.
5EF1_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 5ef1I-4a0sA:
undetectable
5ef1J-4a0sA:
undetectable		 5ef1I-4a0sA:
10.76
5ef1J-4a0sA:
10.76
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.
5EF1_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5ef1I-4bv6A:
undetectable
5ef1J-4bv6A:
undetectable		 5ef1I-4bv6A:
9.71
5ef1J-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF1_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 8 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 5ef1L-4a0sA:
undetectable
5ef1V-4a0sA:
undetectable		 5ef1L-4a0sA:
10.76
5ef1V-4a0sA:
10.76
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.
5EF1_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 5ef1L-5fulA:
undetectable
5ef1V-5fulA:
undetectable		 5ef1L-5fulA:
10.25
5ef1V-5fulA:
10.25
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.
5EF1_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef1L-4a0sA:
undetectable
5ef1M-4a0sA:
undetectable		 5ef1L-4a0sA:
10.76
5ef1M-4a0sA:
10.76
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.
5EF1_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef1M-4a0sA:
undetectable
5ef1N-4a0sA:
undetectable		 5ef1M-4a0sA:
10.76
5ef1N-4a0sA:
10.76
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.
5EF1_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef1N-4a0sA:
undetectable
5ef1O-4a0sA:
undetectable		 5ef1N-4a0sA:
10.76
5ef1O-4a0sA:
10.76
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.
5EF1_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef1P-4a0sA:
undetectable
5ef1Q-4a0sA:
undetectable		 5ef1P-4a0sA:
10.76
5ef1Q-4a0sA:
10.76
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.
5EF1_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef1R-4a0sA:
undetectable
5ef1S-4a0sA:
undetectable		 5ef1R-4a0sA:
10.76
5ef1S-4a0sA:
10.76
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.
5EF1_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef1S-4a0sA:
undetectable
5ef1T-4a0sA:
undetectable		 5ef1S-4a0sA:
10.76
5ef1T-4a0sA:
10.76
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.
5EF1_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef1T-4a0sA:
undetectable
5ef1U-4a0sA:
undetectable		 5ef1T-4a0sA:
10.76
5ef1U-4a0sA:
10.76
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.
5EF1_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef1U-4a0sA:
undetectable
5ef1V-4a0sA:
undetectable		 5ef1U-4a0sA:
10.76
5ef1V-4a0sA:
10.76
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.
5EF2_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5ef2C-4a0sA:
undetectable
5ef2D-4a0sA:
undetectable		 5ef2C-4a0sA:
10.76
5ef2D-4a0sA:
10.76
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.
5EF2_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.27A 5ef2D-4bv6A:
undetectable
5ef2E-4bv6A:
undetectable		 5ef2D-4bv6A:
9.71
5ef2E-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF2_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5ef2G-4a0sA:
undetectable
5ef2H-4a0sA:
undetectable		 5ef2G-4a0sA:
10.76
5ef2H-4a0sA:
10.76
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.
5EF2_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 5ef2I-4a0sA:
undetectable
5ef2J-4a0sA:
undetectable		 5ef2I-4a0sA:
10.76
5ef2J-4a0sA:
10.76
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.
5EF2_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5ef2I-4bv6A:
undetectable
5ef2J-4bv6A:
undetectable		 5ef2I-4bv6A:
9.71
5ef2J-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF2_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 8 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.30A 5ef2L-4a0sA:
undetectable
5ef2V-4a0sA:
undetectable		 5ef2L-4a0sA:
10.76
5ef2V-4a0sA:
10.76
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.
5EF2_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 5ef2L-5fulA:
undetectable
5ef2V-5fulA:
undetectable		 5ef2L-5fulA:
10.25
5ef2V-5fulA:
10.25
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.
5EF2_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef2L-4a0sA:
undetectable
5ef2M-4a0sA:
undetectable		 5ef2L-4a0sA:
10.76
5ef2M-4a0sA:
10.76
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.
5EF2_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef2M-4a0sA:
undetectable
5ef2N-4a0sA:
undetectable		 5ef2M-4a0sA:
10.76
5ef2N-4a0sA:
10.76
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.
5EF2_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef2N-4a0sA:
undetectable
5ef2O-4a0sA:
undetectable		 5ef2N-4a0sA:
10.76
5ef2O-4a0sA:
10.76
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.
5EF2_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef2P-4a0sA:
undetectable
5ef2Q-4a0sA:
undetectable		 5ef2P-4a0sA:
10.76
5ef2Q-4a0sA:
10.76
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.
5EF2_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef2R-4a0sA:
undetectable
5ef2S-4a0sA:
undetectable		 5ef2R-4a0sA:
10.76
5ef2S-4a0sA:
10.76
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.
5EF2_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef2S-4a0sA:
undetectable
5ef2T-4a0sA:
undetectable		 5ef2S-4a0sA:
10.76
5ef2T-4a0sA:
10.76
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.
5EF2_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef2T-4a0sA:
undetectable
5ef2U-4a0sA:
undetectable		 5ef2T-4a0sA:
10.76
5ef2U-4a0sA:
10.76
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.
5EF2_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef2U-4a0sA:
undetectable
5ef2V-4a0sA:
undetectable		 5ef2U-4a0sA:
10.76
5ef2V-4a0sA:
10.76
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.
5EF3_C_TRPC101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.27A 5ef3C-4a0sA:
undetectable
5ef3D-4a0sA:
undetectable		 5ef3C-4a0sA:
10.76
5ef3D-4a0sA:
10.76
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.
5EF3_D_TRPD101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.27A 5ef3D-4bv6A:
undetectable
5ef3E-4bv6A:
undetectable		 5ef3D-4bv6A:
9.71
5ef3E-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF3_G_TRPG101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.24A 5ef3G-4a0sA:
undetectable
5ef3H-4a0sA:
undetectable		 5ef3G-4a0sA:
10.76
5ef3H-4a0sA:
10.76
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.
5EF3_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 11 SER A 322
GLY A 228
HIS A 313
THR A 318
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
 1.26A 5ef3I-4a0sA:
undetectable
5ef3J-4a0sA:
undetectable		 5ef3I-4a0sA:
10.76
5ef3J-4a0sA:
10.76
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.
5EF3_I_TRPI101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 ARG A 172
GLY A 462
HIS A 457
ALA A 259
HIS A 455
 FAD  A1449 (-3.9A)
None
None
FAD  A1449 (-4.9A)
None
 1.28A 5ef3I-4bv6A:
undetectable
5ef3J-4bv6A:
undetectable		 5ef3I-4bv6A:
9.71
5ef3J-4bv6A:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF3_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.27A 5ef3A-4a0sA:
undetectable
5ef3K-4a0sA:
undetectable		 5ef3A-4a0sA:
10.76
5ef3K-4a0sA:
10.76
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.
5EF3_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 8 SER A 322
GLY A 228
HIS A 313
THR A 314
 None
NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
NAP  A1447 (-4.6A)
 0.94A 5ef3L-4a0sA:
undetectable
5ef3V-4a0sA:
undetectable		 5ef3L-4a0sA:
10.76
5ef3V-4a0sA:
10.76
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.
5EF3_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		4 / 8 SER A 182
GLY A 161
HIS A 187
THR A 188
 SAH  A1446 ( 4.4A)
None
None
None
 0.76A 5ef3L-5fulA:
undetectable
5ef3V-5fulA:
undetectable		 5ef3L-5fulA:
10.25
5ef3V-5fulA:
10.25
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.
5EF3_M_TRPM101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef3L-4a0sA:
undetectable
5ef3M-4a0sA:
undetectable		 5ef3L-4a0sA:
10.76
5ef3M-4a0sA:
10.76
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.
5EF3_N_TRPN101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef3M-4a0sA:
undetectable
5ef3N-4a0sA:
undetectable		 5ef3M-4a0sA:
10.76
5ef3N-4a0sA:
10.76
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.
5EF3_O_TRPO101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.33A 5ef3N-4a0sA:
undetectable
5ef3O-4a0sA:
undetectable		 5ef3N-4a0sA:
10.76
5ef3O-4a0sA:
10.76
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.
5EF3_Q_TRPQ101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef3P-4a0sA:
undetectable
5ef3Q-4a0sA:
undetectable		 5ef3P-4a0sA:
10.76
5ef3Q-4a0sA:
10.76
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.
5EF3_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef3R-4a0sA:
undetectable
5ef3S-4a0sA:
undetectable		 5ef3R-4a0sA:
10.76
5ef3S-4a0sA:
10.76
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.
5EF3_T_TRPT101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.32A 5ef3S-4a0sA:
undetectable
5ef3T-4a0sA:
undetectable		 5ef3S-4a0sA:
10.76
5ef3T-4a0sA:
10.76
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.
5EF3_U_TRPU101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.31A 5ef3T-4a0sA:
undetectable
5ef3U-4a0sA:
undetectable		 5ef3T-4a0sA:
10.76
5ef3U-4a0sA:
10.76
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.
5EF3_V_TRPV101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.29A 5ef3U-4a0sA:
undetectable
5ef3V-4a0sA:
undetectable		 5ef3U-4a0sA:
10.76
5ef3V-4a0sA:
10.76
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.
5EML_A_SAMA701_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
5)		 3zyi LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4
(Homo
sapiens) 		5 / 12 GLY A 420
LEU A 386
ASN A 440
ARG A 360
LEU A 372
 None
None
None
NAG  A1442 ( 4.7A)
None
 1.45A 5emlA-3zyiA:
undetectable		 5emlA-3zyiA:
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.
5FHR_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 2xfg ENDOGLUCANASE 1
(Ruminiclostridiu
m
thermocellum) 		4 / 5 SER A 208
GLU A 156
TYR A  69
SER A 217
 CA  A1447 (-4.7A)
None
None
None
 1.26A 5fhrA-2xfgA:
undetectable		 5fhrA-2xfgA:
19.58
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.
5G6C_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE OXYGENASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		3 / 3 ARG A 323
THR A  95
TRP A  80
 HEM  A1444 (-2.7A)
None
REA  A1445 ( 3.9A)
 1.07A 5g6cA-2ve3A:
undetectable		 5g6cA-2ve3A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5H3A_A_D16A401_1
(ORF70)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 7 ILE A 240
GLY A 147
PHE A 140
TYR A 109
 DLL  A1441 (-4.7A)
DLL  A1441 (-3.6A)
DLL  A1441 (-3.6A)
None
 0.90A 5h3aA-2y4oA:
undetectable		 5h3aA-2y4oA:
24.21
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)		 5d7a TRAF2 AND
NCK-INTERACTING
PROTEIN KINASE
(Homo
sapiens) 		6 / 12 ALA A  52
LYS A  54
GLU A  69
LEU A  73
LEU A 144
HIS A 151
 ALA  A  52 (-0.0A)
LYS  A  54 ( 0.0A)
GLU  A  69 ( 0.6A)
LEU  A  73 ( 0.6A)
LEU  A 144 ( 0.6A)
HIS  A 151 ( 1.0A)
 0.92A 5hi2A-5d7aA:
24.7		 5hi2A-5d7aA:
31.43
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.
5HM8_A_ADNA501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.30A 5hm8A-2bmoA:
undetectable		 5hm8A-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_B_ADNB501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.30A 5hm8B-2bmoA:
undetectable		 5hm8B-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_C_ADNC501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.30A 5hm8C-2bmoA:
undetectable		 5hm8C-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_D_ADND501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.29A 5hm8D-2bmoA:
undetectable		 5hm8D-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_E_ADNE501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.29A 5hm8E-2bmoA:
undetectable		 5hm8E-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_F_ADNF501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.30A 5hm8F-2bmoA:
undetectable		 5hm8F-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_G_ADNG501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.30A 5hm8G-2bmoA:
undetectable		 5hm8G-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_H_ADNH501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.29A 5hm8H-2bmoA:
undetectable		 5hm8H-2bmoA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HRQ_G_IPHG101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT
(Carboxydothermus
hydrogenoformans) 		4 / 6 LEU A  53
CYH A  42
HIS A  11
LEU A  12
 None
SF4  A1444 (-2.3A)
None
SF4  A1444 ( 4.5A)
 1.38A 5hrqD-4c1nA:
undetectable
5hrqG-4c1nA:
undetectable
5hrqH-4c1nA:
undetectable		 5hrqD-4c1nA:
7.37
5hrqG-4c1nA:
3.76
5hrqH-4c1nA:
7.37
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.
5I3C_B_AC2B301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 2jk1 HYDROGENASE
TRANSCRIPTIONAL
REGULATORY PROTEIN
HUPR1
(Rhodobacter
capsulatus) 		5 / 10 GLY A  63
ALA A  94
VAL A  64
ASP A  55
ILE A  81
 None
None
None
MG  A1144 (-2.8A)
None
 1.11A 5i3cB-2jk1A:
2.8		 5i3cB-2jk1A:
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.
5IGV_A_ZITA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 GLY A 245
TYR A 160
ARG A  35
ALA A 154
ILE A 422
 None
None
EDO  A1444 (-3.8A)
None
None
 1.06A 5igvA-2bmoA:
undetectable		 5igvA-2bmoA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IGV_A_ZITA404_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 5npy FLAGELLAR BASAL BODY
PROTEIN
(Helicobacter
pylori) 		4 / 4 ASN A 226
ILE A 240
TYR A 266
PHE A 264
 144  A 701 (-4.3A)
None
None
None
 1.44A 5igvA-5npyA:
undetectable		 5igvA-5npyA:
20.87
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.
5IH0_A_ERYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4a6q HISTONE DEACETYLASE
COMPLEX SUBUNIT
SAP18
(Mus
musculus) 		4 / 6 ASP A 134
HIS A  41
ILE A 137
TYR A  77
 None
None
None
IPA  A1144 (-3.8A)
 1.25A 5ih0A-4a6qA:
undetectable		 5ih0A-4a6qA:
20.14
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.
5IKR_B_ID8B602_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		3 / 3 SER A 383
LEU A 368
MET A 222
 None
SFE  A1447 (-4.9A)
None
 0.58A 5ikrB-2ykyA:
undetectable		 5ikrB-2ykyA:
23.38
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.
5IY5_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.14A 5iy5C-1h4pA:
undetectable
5iy5N-1h4pA:
0.1
5iy5P-1h4pA:
undetectable		 5iy5C-1h4pA:
18.16
5iy5N-1h4pA:
21.08
5iy5P-1h4pA:
18.16
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.
5JO9_A_SORA302_0
(RIBITOL
2-DEHYDROGENASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		5 / 12 TYR A 305
THR A 105
GLU A 245
GLY A 248
VAL A 251
 None
None
DLL  A1441 ( 4.6A)
DLL  A1441 ( 4.4A)
None
 1.45A 5jo9A-2y4oA:
5.5		 5jo9A-2y4oA:
21.18
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.
5JWA_H_ACTH612_0
(NADH DEHYDROGENASE,
PUTATIVE)		 4fe2 PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE
(Streptococcus
pneumoniae) 		3 / 3 ARG A 155
PRO A 115
ASN A  94
 None
144  A 308 ( 4.9A)
144  A 308 (-4.8A)
 1.02A 5jwaA-4fe2A:
undetectable
5jwaH-4fe2A:
undetectable		 5jwaA-4fe2A:
21.67
5jwaH-4fe2A:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5K4P_A_SORA611_0
(PROBABLE
PHOSPHATIDYLETHANOLA
MINE TRANSFERASE
MCR-1)		 2qj6 TOXIN A
(Clostridioides
difficile) 		4 / 6 GLY A 129
THR A 128
TYR A 139
GLY A 144
 GLY  A 129 ( 0.0A)
THR  A 128 ( 0.8A)
TYR  A 139 ( 1.3A)
GLY  A 144 ( 0.0A)
 0.91A 5k4pA-2qj6A:
undetectable		 5k4pA-2qj6A:
22.77
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.
5KPR_A_PAUA404_0
(PANTOTHENATE KINASE
3)		 2vpq ACETYL-COA
CARBOXYLASE
(Staphylococcus
aureus) 		4 / 5 GLU A 288
GLY A 163
ARG A 292
GLY A  82
 MG  A1451 (-1.9A)
ANP  A1449 (-3.9A)
CL  A1452 (-3.0A)
None
 1.12A 5kprA-2vpqA:
3.3		 5kprA-2vpqA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LAK_I_BEZI1_0
(3CL PROTEASE
BEZ-TYR-TYR-ASN-ECC
PEPTIDE INHIBITOR)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 SER A 296
TYR A 295
TYR A 294
 None
IDE  A1446 (-3.5A)
None
 0.74A 5lakA-2j7cA:
undetectable
5lakI-2j7cA:
undetectable		 5lakA-2j7cA:
21.79
5lakI-2j7cA:
3.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LAK_J_BEZJ1_0
(3CL PROTEASE
BEZ-TYR-TYR-ASN-ECC
PEPTIDE INHIBITOR)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 SER A 296
TYR A 295
TYR A 294
 None
IDE  A1446 (-3.5A)
None
 0.62A 5lakC-2j7cA:
undetectable
5lakJ-2j7cA:
undetectable		 5lakC-2j7cA:
21.79
5lakJ-2j7cA:
3.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LG3_H_Z80H401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 3v9o DIHYDRONEOPTERIN
ALDOLASE
(Burkholderia
thailandensis) 		5 / 10 ILE A  32
ILE A  87
VAL A  45
THR A 114
ASP A  95
 None
EDO  A 144 (-4.5A)
None
None
None
 1.15A 5lg3H-3v9oA:
undetectable		 5lg3H-3v9oA:
17.92
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.
5LG3_I_Z80I401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 3v9o DIHYDRONEOPTERIN
ALDOLASE
(Burkholderia
thailandensis) 		4 / 9 ILE A  87
VAL A  45
THR A 114
ASP A  95
 EDO  A 144 (-4.5A)
None
None
None
 0.95A 5lg3I-3v9oA:
undetectable		 5lg3I-3v9oA:
17.92
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.
5M5K_C_ADNC502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.32A 5m5kC-2bmoA:
undetectable		 5m5kC-2bmoA:
22.39
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.
5MRA_B_DM2B204_1
(SORCIN)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		4 / 6 THR A 246
ARG A 251
ASP A 250
GLY A 253
 U63  A1443 (-4.0A)
U63  A1443 (-3.0A)
None
None
 0.81A 5mraA-4v20A:
undetectable
5mraB-4v20A:
undetectable		 5mraA-4v20A:
16.82
5mraB-4v20A:
16.82
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.
5MWY_A_YNUA1101_0
(MINERALOCORTICOID
RECEPTOR)		 1spg HEMOGLOBIN
(Leiostomus
xanthurus) 		5 / 12 LEU A 131
LEU A 134
ALA A 137
SER A  86
LEU A  85
 None
None
None
None
HEM  A 144 ( 4.9A)
 1.20A 5mwyA-1spgA:
undetectable		 5mwyA-1spgA:
18.24
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.
5NCD_D_ACTD301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		4 / 4 ASP A 101
HIS A 243
HIS A 281
HIS A 135
 FE  A 556 (-2.8A)
FE  A 556 (-3.4A)
FE  A 556 ( 3.3A)
PO4  A1444 (-3.8A)
 1.46A 5ncdD-2xmoA:
2.7		 5ncdD-2xmoA:
18.69
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.
5NOO_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 2y4o PHENYLACETATE-COENZY
ME A LIGASE
(Burkholderia
cenocepacia) 		4 / 8 ILE A 240
GLY A 147
PHE A 140
TYR A 109
 DLL  A1441 (-4.7A)
DLL  A1441 (-3.6A)
DLL  A1441 (-3.6A)
None
 0.78A 5nooD-2y4oA:
undetectable		 5nooD-2y4oA:
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.
5ODQ_D_ACTD202_0
(METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
D)		 1odu PUTATIVE
ALPHA-L-FUCOSIDASE
(Thermotoga
maritima) 		3 / 3 HIS A 129
GLU A  66
TRP A  67
 FUL  A1448 (-4.0A)
FUL  A1448 (-3.3A)
FUL  A1448 (-4.1A)
 1.13A 5odqD-1oduA:
undetectable		 5odqD-1oduA:
15.62
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.
5PBE_A_TYLA2001_1
(BROMODOMAIN ADJACENT
TO ZINC FINGER
DOMAIN PROTEIN 2B)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 6 PRO A 248
VAL A 269
VAL A 252
ILE A 238
 None
None
NAP  A1447 (-3.8A)
None
 0.90A 5pbeA-4a0sA:
undetectable		 5pbeA-4a0sA:
13.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TDZ_A_ADNA905_1
(ATP-CITRATE SYNTHASE)		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		4 / 6 ARG A  84
THR A  49
ARG A  53
LEU A  54
 HEM  A 144 (-3.3A)
HEM  A 144 ( 2.9A)
HEM  A 144 ( 3.3A)
HEM  A 144 (-4.7A)
 1.04A 5tdzA-5ab8A:
undetectable		 5tdzA-5ab8A:
17.38
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.
5TUD_D_ERMD1201_1
(5-HYDROXYTRYPTAMINE
RECEPTOR 2B,SOLUBLE
CYTOCHROME B562
CHIMERA)		 1v4u HEMOGLOBIN ALPHA
CHAIN
(Thunnus
thynnus) 		5 / 12 VAL A  64
PHE A 130
VAL A 111
LEU A 131
VAL A 134
 HEM  A 144 (-3.8A)
None
None
None
None
 1.06A 5tudD-1v4uA:
2.3		 5tudD-1v4uA:
14.81
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.
5V4V_A_NCAA402_0
(NADPH DEHYDROGENASE
3)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		4 / 8 THR A 103
HIS A 243
ASN A 134
PRO A 210
 None
FE  A 556 (-3.4A)
PO4  A1444 ( 2.6A)
None
 1.23A 5v4vA-2xmoA:
2.1		 5v4vA-2xmoA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V4V_B_NCAB402_0
(NADPH DEHYDROGENASE
3)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		4 / 8 THR A 103
HIS A 243
ASN A 134
PRO A 210
 None
FE  A 556 (-3.4A)
PO4  A1444 ( 2.6A)
None
 1.23A 5v4vB-2xmoA:
undetectable		 5v4vB-2xmoA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V5Z_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4zch TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B
(Homo
sapiens) 		5 / 12 PHE A 136
PHE A  86
GLY A 408
LEU A  56
PHE A 109
 None
None
None
None
144  A 501 (-4.7A)
 1.18A 5v5zA-4zchA:
undetectable		 5v5zA-4zchA:
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.
5V96_B_ADNB502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.28A 5v96B-2bmoA:
undetectable		 5v96B-2bmoA:
22.98
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.
5V96_D_ADND502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 LEU A 305
THR A 326
ASP A 360
GLY A 351
PHE A 200
 None
None
FE  A1441 ( 2.0A)
None
EDO  A1442 (-3.7A)
 1.25A 5v96D-2bmoA:
undetectable		 5v96D-2bmoA:
22.98
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.
5W97_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		4 / 8 ASP A  37
THR A  22
HIS A 396
LEU A 441
 EDO  A1449 (-2.9A)
None
None
EDO  A1449 ( 4.7A)
 1.18A 5w97A-4a35A:
undetectable
5w97C-4a35A:
undetectable
5w97c-4a35A:
undetectable		 5w97A-4a35A:
19.28
5w97C-4a35A:
19.24
5w97c-4a35A:
19.24
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.
5W97_C_CHDC302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		4 / 7 LEU A 441
ASP A  37
THR A  22
HIS A 396
 EDO  A1449 ( 4.7A)
EDO  A1449 (-2.9A)
None
None
 1.16A 5w97C-4a35A:
undetectable
5w97a-4a35A:
undetectable
5w97c-4a35A:
undetectable		 5w97C-4a35A:
19.24
5w97a-4a35A:
19.28
5w97c-4a35A:
19.24
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.
5WAU_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.12A 5wauA-1h4pA:
undetectable
5wauC-1h4pA:
undetectable
5wauc-1h4pA:
undetectable		 5wauA-1h4pA:
21.08
5wauC-1h4pA:
18.60
5wauc-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_C_CHDC303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 7 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.11A 5wauC-1h4pA:
undetectable
5waua-1h4pA:
undetectable
5wauc-1h4pA:
undetectable		 5wauC-1h4pA:
18.60
5waua-1h4pA:
21.08
5wauc-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WBV_A_SAMA402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.47A 5wbvA-2vqdA:
undetectable		 5wbvA-2vqdA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WBV_B_SAMB402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 2vqd BIOTIN CARBOXYLASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY A 163
ALA A 160
SER A 118
PHE A 286
GLU A 276
 None
None
None
None
MG  A1449 ( 2.7A)
 1.46A 5wbvB-2vqdA:
undetectable		 5wbvB-2vqdA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X19_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.17A 5x19A-1h4pA:
0.2
5x19C-1h4pA:
undetectable
5x19P-1h4pA:
undetectable		 5x19A-1h4pA:
21.08
5x19C-1h4pA:
18.60
5x19P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X19_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		4 / 8 ASP A  37
THR A  22
HIS A 396
LEU A 441
 EDO  A1449 (-2.9A)
None
None
EDO  A1449 ( 4.7A)
 1.18A 5x19A-4a35A:
undetectable
5x19C-4a35A:
undetectable
5x19P-4a35A:
undetectable		 5x19A-4a35A:
19.28
5x19C-4a35A:
19.24
5x19P-4a35A:
19.24
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.
5X1F_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 7 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.18A 5x1fA-1h4pA:
0.4
5x1fC-1h4pA:
undetectable
5x1fP-1h4pA:
undetectable		 5x1fA-1h4pA:
21.08
5x1fC-1h4pA:
18.60
5x1fP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X1F_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		4 / 7 ASP A  37
THR A  22
HIS A 396
LEU A 441
 EDO  A1449 (-2.9A)
None
None
EDO  A1449 ( 4.7A)
 1.20A 5x1fA-4a35A:
undetectable
5x1fC-4a35A:
undetectable
5x1fP-4a35A:
undetectable		 5x1fA-4a35A:
19.28
5x1fC-4a35A:
19.24
5x1fP-4a35A:
19.24
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.
5X6Y_C_SAMC902_0
(MRNA CAPPING ENZYME
P5)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 12 LEU A 390
GLY A 114
ALA A 174
PRO A 141
PHE A 166
 None
None
None
CO8  A1446 ( 4.4A)
CO8  A1446 (-4.2A)
 1.25A 5x6yC-4a0sA:
2.5		 5x6yC-4a0sA:
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.
5XDQ_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.11A 5xdqA-1h4pA:
0.2
5xdqC-1h4pA:
undetectable
5xdqP-1h4pA:
undetectable		 5xdqA-1h4pA:
21.08
5xdqC-1h4pA:
18.60
5xdqP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDQ_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.10A 5xdqC-1h4pA:
undetectable
5xdqN-1h4pA:
0.4
5xdqP-1h4pA:
undetectable		 5xdqC-1h4pA:
18.60
5xdqN-1h4pA:
21.08
5xdqP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.11A 5xdxC-1h4pA:
undetectable
5xdxN-1h4pA:
0.0
5xdxP-1h4pA:
undetectable		 5xdxC-1h4pA:
17.96
5xdxN-1h4pA:
21.08
5xdxP-1h4pA:
17.96
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.
5YF0_A_SAMA505_0
(CARNOSINE
N-METHYLTRANSFERASE)		 2bmo OXYGENASE-ALPHA NBDO
(Comamonas
sp.
JS765) 		5 / 12 GLY A 296
GLY A 247
MET A 240
PHE A 200
THR A 306
 None
None
None
EDO  A1442 (-3.7A)
None
 1.29A 5yf0A-2bmoA:
undetectable		 5yf0A-2bmoA:
21.47
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.
5Z84_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.10A 5z84A-1h4pA:
0.3
5z84C-1h4pA:
undetectable
5z84P-1h4pA:
undetectable		 5z84A-1h4pA:
21.08
5z84C-1h4pA:
18.60
5z84P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z84_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 7 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.08A 5z84C-1h4pA:
undetectable
5z84N-1h4pA:
0.3
5z84P-1h4pA:
undetectable		 5z84C-1h4pA:
18.60
5z84N-1h4pA:
21.08
5z84P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z85_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.07A 5z85A-1h4pA:
0.4
5z85C-1h4pA:
undetectable
5z85P-1h4pA:
undetectable		 5z85A-1h4pA:
21.08
5z85C-1h4pA:
18.60
5z85P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z85_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 7 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.09A 5z85C-1h4pA:
undetectable
5z85N-1h4pA:
0.3
5z85P-1h4pA:
undetectable		 5z85C-1h4pA:
18.60
5z85N-1h4pA:
21.08
5z85P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z86_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.11A 5z86A-1h4pA:
0.5
5z86C-1h4pA:
undetectable
5z86P-1h4pA:
undetectable		 5z86A-1h4pA:
21.08
5z86C-1h4pA:
18.60
5z86P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z86_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.11A 5z86C-1h4pA:
undetectable
5z86N-1h4pA:
0.3
5z86P-1h4pA:
undetectable		 5z86C-1h4pA:
18.60
5z86N-1h4pA:
21.08
5z86P-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.07A 5zcoA-1h4pA:
undetectable
5zcoC-1h4pA:
undetectable
5zcoP-1h4pA:
undetectable		 5zcoA-1h4pA:
21.08
5zcoC-1h4pA:
18.60
5zcoP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.06A 5zcoC-1h4pA:
undetectable
5zcoN-1h4pA:
0.2
5zcoP-1h4pA:
undetectable		 5zcoC-1h4pA:
18.60
5zcoN-1h4pA:
21.08
5zcoP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCP_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.11A 5zcpA-1h4pA:
0.5
5zcpC-1h4pA:
undetectable
5zcpP-1h4pA:
undetectable		 5zcpA-1h4pA:
21.08
5zcpC-1h4pA:
18.60
5zcpP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCP_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 LEU A 196
ASP A 246
TYR A 247
HIS A 328
 None
None
None
GOL  A1449 ( 4.1A)
 1.10A 5zcpC-1h4pA:
undetectable
5zcpN-1h4pA:
0.2
5zcpP-1h4pA:
undetectable		 5zcpC-1h4pA:
18.60
5zcpN-1h4pA:
21.08
5zcpP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCQ_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II
(Saccharomyces
cerevisiae) 		4 / 8 ASP A 246
TYR A 247
HIS A 328
LEU A 196
 None
None
GOL  A1449 ( 4.1A)
None
 1.08A 5zcqA-1h4pA:
0.5
5zcqC-1h4pA:
undetectable
5zcqP-1h4pA:
undetectable		 5zcqA-1h4pA:
21.08
5zcqC-1h4pA:
18.60
5zcqP-1h4pA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZJ8_A_9DCA303_0
(METALLO-BETA-LACTAMA
SE TYPE 2)		 2xmo LMO2642 PROTEIN
(Listeria
monocytogenes) 		4 / 8 HIS A 135
ASP A 136
HIS A  49
ASN A 104
 PO4  A1444 (-3.8A)
None
MN  A 555 ( 3.4A)
None
 1.05A 5zj8A-2xmoA:
undetectable		 5zj8A-2xmoA:
18.93
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.
5ZSF_A_6T0A910_0
(TOLL-LIKE RECEPTOR 7)		 4b62 TSSL1
(Pseudomonas
aeruginosa) 		4 / 7 THR A 414
LEU A 370
ILE A 441
THR A 442
 None
None
None
EDO  A1447 (-2.9A)
 0.98A 5zsfA-4b62A:
undetectable
5zsfB-4b62A:
undetectable		 5zsfA-4b62A:
17.20
5zsfB-4b62A:
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.
6AG0_A_ACRA610_0
(ALPHA-AMYLASE)		 2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE
(Streptococcus
pneumoniae) 		5 / 12 TYR A 667
HIS A 715
ASP A 778
HIS A 894
ASP A 895
 BGC  A2144 (-4.5A)
BGC  A2144 (-4.2A)
BGC  A2144 (-2.8A)
None
GLC  A2150 ( 4.3A)
 0.51A 6ag0A-2ya1A:
18.2		 6ag0A-2ya1A:
6.33
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.
6B4Y_A_OAQA302_0
(SULFOTRANSFERASE
OXAMNIQUINE
RESISTANCE PROTEIN)		 1ylo HYPOTHETICAL PROTEIN
SF2450
(Shigella
flexneri) 		5 / 10 ASP A 167
VAL A 299
ASP A 276
PHE A 278
THR A 283
 ZN  A1446 ( 4.5A)
None
None
None
None
 1.43A 6b4yA-1yloA:
1.2		 6b4yA-1yloA:
21.39
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.
6B58_A_ACTA608_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		3 / 3 GLY A 336
THR A 334
GLU A 312
 NAP  A1447 ( 4.1A)
None
None
 0.46A 6b58A-4a0sA:
2.8		 6b58A-4a0sA:
22.74
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.
6B5V_A_ECLA1001_1
(TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 5)		 4zch TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B
(Homo
sapiens) 		4 / 7 PHE A 353
LEU A  56
ILE A 158
ALA A 256
 None
None
144  A 501 ( 4.2A)
None
 0.78A 6b5vA-4zchA:
undetectable
6b5vC-4zchA:
undetectable		 6b5vA-4zchA:
10.80
6b5vC-4zchA:
10.80
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.
6B5V_C_ECLC1001_1
(TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 5)		 4zch TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B
(Homo
sapiens) 		4 / 7 PHE A 353
LEU A  56
ILE A 158
ALA A 256
 None
None
144  A 501 ( 4.2A)
None
 0.78A 6b5vC-4zchA:
undetectable
6b5vD-4zchA:
undetectable		 6b5vC-4zchA:
10.80
6b5vD-4zchA:
10.80
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.
6B5V_D_ECLD1001_1
(TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 5)		 4zch TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B
(Homo
sapiens) 		4 / 7 ALA A 256
PHE A 353
LEU A  56
ILE A 158
 None
None
None
144  A 501 ( 4.2A)
 0.80A 6b5vB-4zchA:
undetectable
6b5vD-4zchA:
undetectable		 6b5vB-4zchA:
10.80
6b5vD-4zchA:
10.80
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.
6BER_A_DVAA2_0
(E(DVA)DP(DGL)(DHI)(D
PR)N(DAL)(DPR))		 3zuq BOTULINUM NEUROTOXIN
TYPE B
(Clostridium
botulinum) 		3 / 3 GLU A 268
ASP A 276
PRO A 277
 ZN  A1440 (-2.1A)
None
None
 0.48A 6berA-3zuqA:
undetectable		 6berA-3zuqA:
1.47
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.
6BKL_C_EU7C101_0
(MATRIX PROTEIN 2)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 9 ALA A 260
VAL A 252
ALA A 229
SER A 230
VAL A 269
 None
NAP  A1447 (-3.8A)
None
NAP  A1447 (-3.6A)
None
 1.26A 6bklA-4a0sA:
undetectable
6bklB-4a0sA:
undetectable
6bklC-4a0sA:
undetectable
6bklD-4a0sA:
undetectable		 6bklA-4a0sA:
4.81
6bklB-4a0sA:
4.81
6bklC-4a0sA:
4.81
6bklD-4a0sA:
4.81
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.
6BRD_A_RFPA502_1
(RIFAMPIN
MONOOXYGENASE)		 5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2
(Mus
musculus) 		5 / 12 MET A 334
VAL A 419
PHE A 387
THR A 227
GLY A 226
 None
None
None
None
CA  A1448 ( 4.2A)
 1.21A 6brdA-5fulA:
undetectable		 6brdA-5fulA:
9.89
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 5ajz 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		4 / 7 SER A 437
HIS A 253
GLY A 254
ARG A 252
 None
PHS  A1446 (-3.4A)
None
PHS  A1446 (-3.5A)
 1.16A 6btxA-5ajzA:
undetectable		 6btxA-5ajzA:
20.89
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.
6C2M_C_SUEC1203_1
(NS3 PROTEASE)		 4v20 CELLOBIOHYDROLASE
(Aspergillus
fumigatus) 		5 / 9 VAL A  41
HIS A  42
ILE A 183
LEU A 180
ARG A  39
 None
ACT  A1444 (-4.6A)
None
None
None
 1.42A 6c2mC-4v20A:
undetectable		 6c2mC-4v20A:
12.56
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.
6CDU_I_EY4I500_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 4ce4 MRPL3
(Sus
scrofa) 		4 / 5 GLN E 267
VAL E 269
TRP E 273
THR E 306
 None
None
None
U  A1440 ( 4.3A)
 1.47A 6cduI-4ce4E:
undetectable
6cduJ-4ce4E:
undetectable		 6cduI-4ce4E:
21.98
6cduJ-4ce4E:
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.
6CZM_D_HISD402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2gqw FERREDOXIN REDUCTASE
(Pseudomonas
sp.
KKS102) 		5 / 8 GLY A  14
LEU A  13
VAL A 268
VAL A 274
LEU A 105
 FAD  A1449 (-3.2A)
None
None
None
None
 1.36A 6czmD-2gqwA:
undetectable
6czmF-2gqwA:
undetectable		 6czmD-2gqwA:
23.29
6czmF-2gqwA:
23.29
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.
6CZM_E_HISE402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2gqw FERREDOXIN REDUCTASE
(Pseudomonas
sp.
KKS102) 		5 / 9 VAL A 268
VAL A 274
LEU A 105
GLY A  14
LEU A  13
 None
None
None
FAD  A1449 (-3.2A)
None
 1.33A 6czmD-2gqwA:
undetectable
6czmE-2gqwA:
undetectable		 6czmD-2gqwA:
23.29
6czmE-2gqwA:
23.29
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.
6DJZ_C_GMJC301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 4a35 MITOCHONDRIAL
ENOLASE SUPERFAMILY
MEMBER 1
(Homo
sapiens) 		4 / 6 LEU A 326
TYR A 194
ASP A 254
GLU A 280
 None
None
MG  A1445 (-2.6A)
MG  A1445 (-3.0A)
 1.48A 6djzC-4a35A:
undetectable		 6djzC-4a35A:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6E5Z_A_CCSA106_0
(PROTEIN/NUCLEIC ACID
DEGLYCASE DJ-1)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 10 GLU A 220
GLY A 171
ASN A 178
ALA A 180
GLY A 224
 PLP  A1446 (-3.9A)
None
None
None
None
 1.01A 6e5zA-2ykyA:
3.0		 6e5zA-2ykyA:
17.41
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.
6ECX_A_SAMA1301_0
(STIE PROTEIN)		 2y77 3-DEHYDROQUINATE
DEHYDRATASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  13
GLY A 132
ILE A  36
VAL A 100
ILE A  73
 CB8  A1144 (-4.5A)
None
None
None
None
 1.02A 6ecxA-2y77A:
2.0		 6ecxA-2y77A:
18.07
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.
6ELI_A_T27A701_1
(REVERSE
TRANSCRIPTASE)		 2ve3 PUTATIVE CYTOCHROME
P450 120
(Synechocystis
sp.
PCC
6803) 		5 / 12 LEU A 403
VAL A 154
TYR A 120
PHE A 396
LEU A 399
 None
None
None
HEM  A1444 (-4.7A)
None
 1.49A 6eliA-2ve3A:
undetectable		 6eliA-2ve3A:
11.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FGC_A_ACTA810_0
(GEPHYRIN)		 1b0b HEMOGLOBIN
(Phacoides
pectinatus) 		3 / 3 LEU A  46
SER A  44
PHE A  43
 HEM  A 144 ( 3.9A)
None
HEM  A 144 ( 3.8A)
 0.60A 6fgcA-1b0bA:
undetectable		 6fgcA-1b0bA:
16.43
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.
6GIQ_A_CUA601_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 2f22 BH3987
(Bacillus
halodurans) 		3 / 3 HIS A  42
HIS A 114
HIS A 118
 NI  A 144 (-3.3A)
NI  A 144 (-3.2A)
NI  A 144 (-3.2A)
 0.65A 6giqa-2f22A:
2.5		 6giqa-2f22A:
12.74
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.
6GNA_A_ACTA307_0
(THIOREDOXIN
REDUCTASE)		 4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		3 / 3 ARG A  75
LYS A 168
TYR A 174
 None
PO4  A1447 (-2.9A)
None
 1.37A 6gnaA-4d4lA:
undetectable		 6gnaA-4d4lA:
20.92
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.
6GNB_A_ACTA307_0
(THIOREDOXIN
REDUCTASE)		 4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3
(Homo
sapiens) 		3 / 3 ARG A  75
LYS A 168
TYR A 174
 None
PO4  A1447 (-2.9A)
None
 1.37A 6gnbA-4d4lA:
undetectable		 6gnbA-4d4lA:
20.92
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.
6GNF_A_QPSA602_1
(-)		 1odu PUTATIVE
ALPHA-L-FUCOSIDASE
(Thermotoga
maritima) 		5 / 12 ASN A  62
PHE A  59
ASN A 293
GLU A  66
GLY A 291
 None
None
None
FUL  A1448 (-3.3A)
None
 1.15A 6gnfA-1oduA:
2.0		 6gnfA-1oduA:
21.66
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.
6HU9_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		5 / 10 TYR A 388
VAL A 409
GLY A 407
SER A 230
ALA A 229
 None
None
None
NAP  A1447 (-3.6A)
None
 1.48A 6hu9L-4a0sA:
undetectable
6hu9P-4a0sA:
undetectable
6hu9T-4a0sA:
undetectable		 6hu9L-4a0sA:
21.71
6hu9P-4a0sA:
19.24
6hu9T-4a0sA:
9.01
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.
6HWD_K_BO2K301_0
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 2yky BETA-TRANSAMINASE
(Mesorhizobium
sp.
LUK) 		5 / 11 ALA A 148
ALA A 152
GLY A 175
GLY A 174
ASP A 253
 None
None
None
PLP  A1446 (-3.5A)
PLP  A1446 (-2.8A)
 0.91A 6hwdK-2ykyA:
undetectable
6hwdL-2ykyA:
undetectable		 6hwdK-2ykyA:
11.42
6hwdL-2ykyA:
11.82
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.
6MN8_A_HFGA603_1
(UNCHARACTERIZED
PROTEIN)		 4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E
(Streptomyces
cinnabarigriseus) 		4 / 4 THR A 318
GLU A 312
ARG A 272
HIS A 313
 None
None
NAP  A1447 (-3.8A)
NAP  A1447 (-4.3A)
 1.35A 6mn8A-4a0sA:
undetectable		 6mn8A-4a0sA:
22.39
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.
6MVX_A_K4DA1304_0
(ION TRANSPORT
PROTEIN)		 4b62 TSSL1
(Pseudomonas
aeruginosa) 		4 / 6 THR A 442
LEU A 370
THR A 333
LEU A 403
 EDO  A1447 (-2.9A)
None
None
None
 1.21A 6mvxA-4b62A:
undetectable
6mvxB-4b62A:
undetectable
6mvxC-4b62A:
undetectable		 6mvxA-4b62A:
20.00
6mvxB-4b62A:
20.00
6mvxC-4b62A:
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.
6NKN_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4ags THIOL-DEPENDENT
REDUCTASE 1
(Leishmania
infantum) 		3 / 3 ARG A 431
PHE A 242
PHE A 430
 None
GSH  A1449 (-3.5A)
None
 1.04A 6nknC-4agsA:
undetectable
6nknJ-4agsA:
undetectable		 6nknC-4agsA:
20.27
6nknJ-4agsA:
8.64