SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '480'


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_A_DCFA353_1
(ADENOSINE DEAMINASE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		5 / 12 PHE A 219
ALA A 362
HIS A 331
HIS A 339
ASP A 251
 MED  A 601 ( 3.9A)
ZN  A 480 ( 3.7A)
ZN  A 480 ( 3.4A)
MED  A 601 (-3.3A)
ZN  A 479 ( 1.9A)
 1.21A 1a4lA-1kq0A:
undetectable		 1a4lA-1kq0A:
19.64
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.
1A4L_A_DCFA353_1
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		6 / 12 HIS A  93
HIS A  95
HIS A 259
GLU A 262
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 1.00A 1a4lA-3hpaA:
22.9		 1a4lA-3hpaA:
22.15
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.
1A4L_A_DCFA353_1
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  93
MET A 184
HIS A 259
GLU A 262
HIS A 296
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
 1.06A 1a4lA-3hpaA:
22.9		 1a4lA-3hpaA:
22.15
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.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		5 / 12 PHE A 219
ALA A 362
HIS A 331
HIS A 339
ASP A 251
 MED  A 601 ( 3.9A)
ZN  A 480 ( 3.7A)
ZN  A 480 ( 3.4A)
MED  A 601 (-3.3A)
ZN  A 479 ( 1.9A)
 1.21A 1a4lB-1kq0A:
undetectable		 1a4lB-1kq0A:
19.64
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.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
HIS A 259
GLU A 262
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.99A 1a4lB-3hpaA:
22.9		 1a4lB-3hpaA:
22.15
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.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 116
HIS A 259
GLU A 262
HIS A 296
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
 1.08A 1a4lB-3hpaA:
22.9		 1a4lB-3hpaA:
22.15
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.
1A4L_C_DCFC1353_1
(ADENOSINE DEAMINASE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		5 / 12 PHE A 219
ALA A 362
HIS A 331
HIS A 339
ASP A 251
 MED  A 601 ( 3.9A)
ZN  A 480 ( 3.7A)
ZN  A 480 ( 3.4A)
MED  A 601 (-3.3A)
ZN  A 479 ( 1.9A)
 1.19A 1a4lC-1kq0A:
undetectable		 1a4lC-1kq0A:
19.64
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.
1A4L_C_DCFC1353_1
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		6 / 12 HIS A  93
HIS A  95
HIS A 259
GLU A 262
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.92A 1a4lC-3hpaA:
22.7		 1a4lC-3hpaA:
22.15
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.
1A4L_D_DCFD1853_1
(ADENOSINE DEAMINASE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		5 / 12 PHE A 219
ALA A 362
HIS A 331
HIS A 339
ASP A 251
 MED  A 601 ( 3.9A)
ZN  A 480 ( 3.7A)
ZN  A 480 ( 3.4A)
MED  A 601 (-3.3A)
ZN  A 479 ( 1.9A)
 1.28A 1a4lD-1kq0A:
undetectable		 1a4lD-1kq0A:
19.64
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.
1AEG_A_4APA296_1
(CYTOCHROME C
PEROXIDASE)		 4y13 TRANSCRIPTIONAL
REGULATOR OF FTSQAZ
GENE CLUSTER
(Escherichia
coli) 		4 / 8 GLY A 118
THR A 120
LEU A  83
ASP A  80
 None
None
None
480  A 303 (-2.4A)
 0.79A 1aegA-4y13A:
undetectable		 1aegA-4y13A:
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.
1BZM_A_MZMA262_1
(CARBONIC ANHYDRASE I)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 8 HIS A 259
HIS A  93
HIS A 296
HIS A  95
 ZN  A 480 (-3.5A)
ZN  A 480 (-3.3A)
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.3A)
 1.01A 1bzmA-3hpaA:
undetectable		 1bzmA-3hpaA:
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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 5 HIS A 270
HIS A 437
HIS A  79
HIS A 128
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 0.88A 1e9yB-1fwxA:
undetectable		 1e9yB-1fwxA:
23.51
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.
1EI6_D_PPFD412_1
(PHOSPHONOACETATE
HYDROLASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 8 ASP A 347
HIS A  93
HIS A 259
HIS A 296
 ZN  A 480 (-3.2A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
 0.97A 1ei6D-3hpaA:
undetectable		 1ei6D-3hpaA:
22.75
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.
1EQB_B_GLYB2292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 8 SER A  29
HIS A 437
SER A  25
ARG A  33
 None
CUZ  A4801 (-3.0A)
None
None
 0.99A 1eqbA-1fwxA:
undetectable
1eqbB-1fwxA:
undetectable		 1eqbA-1fwxA:
21.68
1eqbB-1fwxA:
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.
1EQB_C_GLYC3292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 8 SER A  29
HIS A 437
SER A  25
ARG A  33
 None
CUZ  A4801 (-3.0A)
None
None
 0.99A 1eqbC-1fwxA:
undetectable
1eqbD-1fwxA:
undetectable		 1eqbC-1fwxA:
21.68
1eqbD-1fwxA:
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.
1EQB_D_GLYD4292_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 8 SER A  29
HIS A 437
SER A  25
ARG A  33
 None
CUZ  A4801 (-3.0A)
None
None
 0.98A 1eqbC-1fwxA:
undetectable
1eqbD-1fwxA:
undetectable		 1eqbC-1fwxA:
21.68
1eqbD-1fwxA:
21.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FMO_E_ADNE351_1
(CAMP-DEPENDENT
PROTEIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 GLY A  83
VAL A  90
ALA A 103
VAL A 137
ASN A 203
LEU A 205
ASP A 216
PHE A 368
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
ANP  A1480 (-4.5A)
 0.80A 1fmoE-2v55A:
4.6		 1fmoE-2v55A:
34.59
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.
1ICU_D_NIOD223_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4y13 TRANSCRIPTIONAL
REGULATOR OF FTSQAZ
GENE CLUSTER
(Escherichia
coli) 		4 / 5 GLY A 131
SER A 134
THR A 120
PHE A 132
 None
480  A 303 (-3.3A)
None
None
 1.29A 1icuC-4y13A:
undetectable
1icuD-4y13A:
undetectable		 1icuC-4y13A:
22.66
1icuD-4y13A:
22.66
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.
1JG2_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 GLY A  17
GLY A 316
ILE A 145
GLY A  14
ALA A  21
 FAD  A 480 (-3.2A)
FAD  A 480 ( 4.0A)
None
FAD  A 480 ( 4.7A)
None
 1.09A 1jg2A-1dxlA:
4.2		 1jg2A-1dxlA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG3_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 11 GLY A  15
GLY A  10
ILE A 140
LEU A   9
GLY A 324
 None
FAD  A 480 (-3.2A)
None
FAD  A 480 (-4.1A)
None
 0.94A 1jg3A-2a8xA:
3.5		 1jg3A-2a8xA:
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.
1JG3_B_ADNB550_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 11 GLY A  15
GLY A  10
ILE A 140
LEU A   9
GLY A 324
 None
FAD  A 480 (-3.2A)
None
FAD  A 480 (-4.1A)
None
 0.92A 1jg3B-2a8xA:
3.5		 1jg3B-2a8xA:
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.
1KIA_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 324
VAL A 322
ALA A 333
GLY A  12
LEU A  45
 FAD  A 480 (-3.2A)
None
FAD  A 480 (-3.4A)
FAD  A 480 (-3.1A)
None
 1.01A 1kiaC-1v59A:
2.7		 1kiaC-1v59A:
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.
1KQB_B_BEZB525_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4y13 TRANSCRIPTIONAL
REGULATOR OF FTSQAZ
GENE CLUSTER
(Escherichia
coli) 		4 / 5 GLY A 131
SER A 134
THR A 120
PHE A 132
 None
480  A 303 (-3.3A)
None
None
 1.19A 1kqbA-4y13A:
undetectable
1kqbB-4y13A:
undetectable		 1kqbA-4y13A:
22.05
1kqbB-4y13A:
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.
1MAA_D_DMED999_1
(ACETYLCHOLINESTERASE)		 2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE
(Arabidopsis
thaliana) 		4 / 8 GLY A 366
GLU A 372
SER A 369
TYR A 315
 TRS  A1478 ( 3.5A)
UDP  A1477 (-2.6A)
UDP  A1477 (-2.6A)
EDO  A1480 (-4.8A)
 0.96A 1maaD-2vg8A:
undetectable		 1maaD-2vg8A:
23.55
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.
1MRL_B_DOLB301_1
(STREPTOGRAMIN A
ACETYLTRANSFERASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 TYR A  97
ILE A 131
LEU A 163
VAL A 346
ASP A 347
 None
None
None
None
ZN  A 480 (-3.2A)
 1.49A 1mrlB-3hpaA:
undetectable
1mrlC-3hpaA:
undetectable		 1mrlB-3hpaA:
18.12
1mrlC-3hpaA:
18.12
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.
1MUO_A_ADNA1_1
(AURORA-RELATED
KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 9 GLY A  83
VAL A  90
ALA A 103
TYR A 155
LEU A 205
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
 0.51A 1muoA-2v55A:
9.7		 1muoA-2v55A:
27.23
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.
1NV8_A_SAMA300_0
(HEMK PROTEIN)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 ILE A  12
GLY A  13
GLY A  15
THR A 147
ALA A  22
 None
FAD  A 480 ( 3.8A)
FAD  A 480 (-3.9A)
FAD  A 480 (-4.0A)
None
 1.10A 1nv8A-1dxlA:
4.4		 1nv8A-1dxlA:
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.
1NV8_B_SAMB301_0
(HEMK PROTEIN)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 307
GLY A 308
GLY A 312
ILE A 291
GLU A 321
 None
FAD  A 480 (-3.2A)
None
None
None
 0.91A 1nv8B-2a8xA:
2.8		 1nv8B-2a8xA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 5 HIS A  94
HIS A 296
HIS A  93
HIS A 259
 None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 1.12A 1os2A-3hpaA:
undetectable		 1os2A-3hpaA:
14.85
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.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 5 HIS A 294
HIS A  93
HIS A 259
HIS A 153
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
 1.12A 1os2A-3hpaA:
undetectable		 1os2A-3hpaA:
14.85
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.
1P91_A_SAMA1401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 11 GLY A  15
GLY A  10
ILE A 140
TYR A 305
HIS A 303
 None
FAD  A 480 (-3.2A)
None
None
None
 1.14A 1p91A-2a8xA:
2.2		 1p91A-2a8xA:
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.
1Q23_B_FUAB703_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 PHE A 433
PHE A 112
LEU A 150
VAL A 149
VAL A 107
 ANP  A 480 (-3.6A)
ANP  A 480 (-3.5A)
None
None
None
 1.23A 1q23B-3fhtA:
undetectable		 1q23B-3fhtA:
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.
1RJ6_A_AZMA400_1
(CARBONIC ANHYDRASE
XIV)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 10 GLN A  98
HIS A  95
HIS A  93
HIS A 153
LEU A 119
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
None
 1.43A 1rj6A-3hpaA:
undetectable		 1rj6A-3hpaA:
19.71
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.
1RJO_A_CUA701_0
(PHENYLETHYLAMINE
OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.39A 1rjoA-3hpaA:
undetectable		 1rjoA-3hpaA:
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.
1RKY_A_CUA801_0
(LYSYL OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.37A 1rkyA-3hpaA:
undetectable		 1rkyA-3hpaA:
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.
1RR8_A_TTCA100_1
(DNA TOPOISOMERASE I)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 GLU A  33
ARG A  99
LYS A  94
ASP A  95
 FAD  A 480 (-2.8A)
None
None
None
 1.44A 1rr8C-3ladA:
undetectable		 1rr8C-3ladA:
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.
1SDV_B_MK1B902_1
(PROTEASE RETROPEPSIN)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 10 ALA A  17
GLY A  10
GLY A   9
ILE A   8
ILE A 312
 None
None
FAD  A 480 (-3.6A)
FAD  A 480 (-4.7A)
None
 0.94A 1sdvA-2qaeA:
undetectable		 1sdvA-2qaeA:
12.37
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.
1SG9_B_SAMB302_0
(HEMK PROTEIN)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 307
GLY A 308
GLY A 312
ILE A 291
GLU A 321
 None
FAD  A 480 (-3.2A)
None
None
None
 0.86A 1sg9B-2a8xA:
2.8		 1sg9B-2a8xA:
21.06
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.
1SGU_B_MK1B2632_1
(POL POLYPROTEIN)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		5 / 8 ALA A  21
GLY A  13
GLY A  12
ILE A  11
ALA A 343
 None
FAD  A 480 ( 4.8A)
FAD  A 480 (-3.1A)
None
None
 1.23A 1sguA-1v59A:
undetectable		 1sguA-1v59A:
13.78
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.
1T46_A_STIA3_1
(HOMO SAPIENS V-KIT
HARDY-ZUCKERMAN 4
FELINE SARCOMA VIRAL
ONCOGENE HOMOLOG)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
LYS A 105
GLU A 124
VAL A 137
GLY A 159
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.7A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 1.07A 1t46A-2v55A:
18.5		 1t46A-2v55A:
23.65
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.
1V54_A_CUA517_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.68A 1v54A-3hpaA:
undetectable		 1v54A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V54_N_CUN517_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 1v54N-3hpaA:
undetectable		 1v54N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V55_A_CUA517_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.69A 1v55A-3hpaA:
undetectable		 1v55A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V55_N_CUN517_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.69A 1v55N-3hpaA:
undetectable		 1v55N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VID_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 5 SER A  60
GLU A 191
TYR A 356
SER A 167
 None
FAD  A 480 ( 4.6A)
FAD  A 480 (-4.7A)
FAD  A 480 (-3.7A)
 1.23A 1vidA-1dxlA:
4.3		 1vidA-1dxlA:
19.15
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.
1VID_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 5 SER A  63
GLU A 194
TYR A 357
SER A 170
 None
None
FAD  A 480 ( 4.7A)
FAD  A 480 ( 3.7A)
 1.24A 1vidA-1lpfA:
2.9		 1vidA-1lpfA:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VID_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 5 SER A  59
GLU A 197
TYR A 364
SER A 173
 None
FAD  A 480 ( 4.8A)
FAD  A 480 (-4.4A)
FAD  A 480 (-3.9A)
 1.15A 1vidA-1v59A:
3.2		 1vidA-1v59A:
17.08
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.
1VID_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 SER A  63
GLU A 194
TYR A 357
SER A 170
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.1A)
 1.14A 1vidA-3ladA:
undetectable		 1vidA-3ladA:
18.92
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.
1VQ1_B_SAMB301_0
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 307
GLY A 308
GLY A 312
ILE A 291
GLU A 321
 None
FAD  A 480 (-3.2A)
None
None
None
 0.88A 1vq1B-2a8xA:
2.8		 1vq1B-2a8xA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1W2Z_A_CUA701_0
(AMINE OXIDASE,
COPPER CONTAINING)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.47A 1w2zA-3hpaA:
undetectable		 1w2zA-3hpaA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1W2Z_B_CUB701_0
(AMINE OXIDASE,
COPPER CONTAINING)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.42A 1w2zB-3hpaA:
undetectable		 1w2zB-3hpaA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1W2Z_C_CUC701_0
(AMINE OXIDASE,
COPPER CONTAINING)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.41A 1w2zC-3hpaA:
undetectable		 1w2zC-3hpaA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1W2Z_D_CUD701_0
(AMINE OXIDASE,
COPPER CONTAINING)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.38A 1w2zD-3hpaA:
undetectable		 1w2zD-3hpaA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XZX_X_T3X500_1
(THYROID HORMONE
RECEPTOR BETA-1)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 140
ILE A 139
ALA A 138
LEU A   9
ILE A 109
 None
None
None
FAD  A 480 (-4.1A)
None
 1.23A 1xzxX-2a8xA:
undetectable		 1xzxX-2a8xA:
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.
2AOH_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		4 / 5 LEU A   9
GLY A 282
ALA A 138
ILE A 140
 FAD  A 480 (-4.1A)
None
None
None
 0.83A 2aohB-2a8xA:
undetectable		 2aohB-2a8xA:
12.39
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.
2CL5_B_SAMB1217_1
(CATECHOL
O-METHYLTRANSFERASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 6 SER A  59
GLU A 197
TYR A 364
SER A 173
 None
FAD  A 480 ( 4.8A)
FAD  A 480 (-4.4A)
FAD  A 480 (-3.9A)
 1.17A 2cl5B-1v59A:
2.9		 2cl5B-1v59A:
17.08
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.
2CL5_B_SAMB1217_1
(CATECHOL
O-METHYLTRANSFERASE)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 SER A  63
GLU A 194
TYR A 357
SER A 170
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.1A)
 1.17A 2cl5B-3ladA:
undetectable		 2cl5B-3ladA:
18.92
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.
2DYR_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.68A 2dyrA-3hpaA:
undetectable		 2dyrA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYR_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 2dyrN-3hpaA:
undetectable		 2dyrN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYS_A_CUA601_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.69A 2dysA-3hpaA:
undetectable		 2dysA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYS_N_CUN601_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 2dysN-3hpaA:
undetectable		 2dysN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIJ_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.67A 2eijA-3hpaA:
undetectable		 2eijA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIJ_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.69A 2eijN-3hpaA:
0.1		 2eijN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIK_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.66A 2eikA-3hpaA:
undetectable		 2eikA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIK_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 2eikN-3hpaA:
undetectable		 2eikN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.68A 2eilA-3hpaA:
undetectable		 2eilA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.72A 2eilN-3hpaA:
undetectable		 2eilN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIM_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 2eimA-3hpaA:
undetectable		 2eimA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIM_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 2eimN-3hpaA:
undetectable		 2eimN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIN_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.68A 2einA-3hpaA:
undetectable		 2einA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIN_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 2einN-3hpaA:
0.4		 2einN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ILE A  82
VAL A  90
LYS A 105
VAL A 137
ASP A 160
ASN A 203
LEU A 205
ALA A 215
 None
None
ANP  A1480 (-3.4A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.0A)
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.89A 2eufB-2v55A:
24.1		 2eufB-2v55A:
25.90
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.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 LYS A 105
VAL A 137
ASP A 160
ASN A 203
LEU A 205
ALA A 215
ASP A 216
 ANP  A1480 (-3.4A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.0A)
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.84A 2eufB-2v55A:
24.1		 2eufB-2v55A:
25.90
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.
2EVA_A_ADNA498_1
(TAK1 KINASE - TAB1
CHIMERA FUSION
PROTEIN)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 11 GLY A  83
VAL A  90
ALA A 103
MET A 153
TYR A 155
LEU A 205
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
 0.60A 2evaA-2v55A:
20.5		 2evaA-2v55A:
26.88
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.
2F6D_A_ACRA996_1
(GLUCOAMYLASE GLU1)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		4 / 7 ASN A 126
ASP A 127
THR A 114
GLY A 113
 None
None
None
FAD  A 480 (-3.7A)
 0.73A 2f6dA-2a8xA:
undetectable		 2f6dA-2a8xA:
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.
2FUM_B_MIXB1539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 GLY A  83
VAL A  90
ALA A 103
MET A 153
TYR A 155
LYS A 200
ASN A 203
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
ANP  A1480 (-2.9A)
MG  A1481 (-3.5A)
 0.69A 2fumB-2v55A:
23.0		 2fumB-2v55A:
26.30
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.
2FUM_D_MIXD3539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 GLY A  83
GLY A  85
VAL A  90
ALA A 103
MET A 153
LYS A 200
ASN A 203
 ANP  A1480 ( 4.3A)
ANP  A1480 ( 3.8A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
ANP  A1480 (-2.9A)
MG  A1481 (-3.5A)
 1.09A 2fumD-2v55A:
21.8		 2fumD-2v55A:
26.30
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.
2G70_B_SAMB2002_1
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		4 / 7 GLY A 277
THR A 114
TYR A 112
ASP A 279
 None
None
FAD  A 480 (-3.4A)
None
 1.05A 2g70B-2a8xA:
2.3		 2g70B-2a8xA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HA4_A_ACHA546_0
(ACETYLCHOLINESTERASE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		4 / 8 TYR A 444
GLU A 364
HIS A 331
GLY A 330
 MED  A 601 ( 4.7A)
ZN  A 480 (-2.6A)
ZN  A 480 ( 3.4A)
None
 0.82A 2ha4A-1kq0A:
undetectable		 2ha4A-1kq0A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HA4_B_ACHB603_0
(ACETYLCHOLINESTERASE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		4 / 7 TYR A 444
GLU A 364
HIS A 331
GLY A 330
 MED  A 601 ( 4.7A)
ZN  A 480 (-2.6A)
ZN  A 480 ( 3.4A)
None
 0.80A 2ha4B-1kq0A:
undetectable		 2ha4B-1kq0A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HKK_A_ALEA300_1
(CARBONIC ANHYDRASE 2)		 1qd1 FORMIMINOTRANSFERASE
-CYCLODEAMINASE
(Sus
scrofa) 		4 / 6 HIS A  82
ASN A 186
GLN A 268
THR A  44
 GOL  A 480 ( 4.1A)
FON  A 330 (-4.0A)
FON  A 330 (-3.0A)
FON  A 330 (-3.1A)
 1.21A 2hkkA-1qd1A:
undetectable		 2hkkA-1qd1A:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HYY_C_STIC600_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ALA A 103
ILE A 127
VAL A 137
GLY A 158
LEU A 205
ALA A 215
ASP A 216
 ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 1.27A 2hyyC-2v55A:
17.8		 2hyyC-2v55A:
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.
2HYY_C_STIC600_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ALA A 103
ILE A 127
VAL A 137
GLY A 159
LEU A 205
ALA A 215
ASP A 216
 ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 1.19A 2hyyC-2v55A:
17.8		 2hyyC-2v55A:
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.
2HYY_C_STIC600_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 VAL A  90
ALA A 103
ILE A 127
VAL A 137
GLY A 159
LEU A 205
ALA A 215
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 1.21A 2hyyC-2v55A:
17.8		 2hyyC-2v55A:
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.
2IVU_A_ZD6A3015_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
PRECURSOR)		 2ppl PANCREATIC
LIPASE-RELATED
PROTEIN 1
(Homo
sapiens) 		3 / 3 ALA A 174
GLY A 234
SER A 284
 None
NA  A 480 (-4.3A)
None
 0.55A 2ivuA-2pplA:
undetectable		 2ivuA-2pplA:
19.10
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.
2J2P_C_SC2C1289_1
(FICOLIN-2)		 2ilu ALDEHYDE
DEHYDROGENASE A
(Escherichia
coli) 		4 / 6 SER A 407
SER A 455
LEU A 411
GLY A 410
 SO4  A 480 ( 4.8A)
SO4  A 480 ( 3.7A)
SO4  A 480 (-4.3A)
SO4  A 480 (-2.9A)
 1.01A 2j2pA-2iluA:
undetectable
2j2pC-2iluA:
undetectable		 2j2pA-2iluA:
16.37
2j2pC-2iluA:
16.37
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.
2J2P_F_SC2F1289_1
(FICOLIN-2)		 2ilu ALDEHYDE
DEHYDROGENASE A
(Escherichia
coli) 		4 / 6 SER A 407
SER A 455
LEU A 411
GLY A 410
 SO4  A 480 ( 4.8A)
SO4  A 480 ( 3.7A)
SO4  A 480 (-4.3A)
SO4  A 480 (-2.9A)
 1.00A 2j2pD-2iluA:
undetectable
2j2pF-2iluA:
undetectable		 2j2pD-2iluA:
16.37
2j2pF-2iluA:
16.37
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.
2O4K_A_DR7A301_1
(PROTEASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 LEU A 284
ASP A 317
GLY A  15
GLY A  18
ILE A  11
 FAD  A 480 ( 4.9A)
FAD  A 480 (-2.9A)
FAD  A 480 (-3.9A)
None
None
 1.10A 2o4kA-1dxlA:
0.0		 2o4kA-1dxlA:
13.44
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.
2OKC_B_SAMB500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 5c05 PUTATIVE
GAMMA-TERPINENE
SYNTHASE
(Thymus
vulgaris) 		5 / 12 ALA A 543
ASN A 541
VAL A 206
ASN A 480
ARG A 564
 ALA  A 543 ( 0.0A)
ASN  A 541 (-0.6A)
VAL  A 206 ( 0.6A)
ASN  A 480 ( 0.6A)
ARG  A 564 ( 0.6A)
 1.12A 2okcB-5c05A:
undetectable		 2okcB-5c05A:
22.43
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.
2OQE_A_CUA801_0
(PEROXISOMAL COPPER
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.43A 2oqeA-3hpaA:
undetectable		 2oqeA-3hpaA:
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.
2OQE_B_CUB801_0
(PEROXISOMAL COPPER
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.44A 2oqeB-3hpaA:
undetectable		 2oqeB-3hpaA:
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.
2OQE_C_CUC801_0
(PEROXISOMAL COPPER
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.42A 2oqeC-3hpaA:
undetectable		 2oqeC-3hpaA:
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.
2OQE_D_CUD801_0
(PEROXISOMAL COPPER
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.42A 2oqeD-3hpaA:
undetectable		 2oqeD-3hpaA:
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.
2OQE_F_CUF801_0
(PEROXISOMAL COPPER
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.43A 2oqeF-3hpaA:
undetectable		 2oqeF-3hpaA:
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.
2PGR_A_DCFA501_1
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		6 / 12 HIS A  93
HIS A  95
HIS A 259
GLU A 262
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.86A 2pgrA-3hpaA:
22.7		 2pgrA-3hpaA:
22.51
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.
2VCV_B_ASDB1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 6 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.23A 2vcvB-2a8xA:
1.8		 2vcvB-2a8xA:
18.84
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.
2VCV_D_ASDD1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 9 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.22A 2vcvD-2a8xA:
undetectable		 2vcvD-2a8xA:
18.84
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.
2VCV_E_ASDE1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 9 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.25A 2vcvE-2a8xA:
undetectable		 2vcvE-2a8xA:
18.84
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.
2VCV_F_ASDF1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 8 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.20A 2vcvF-2a8xA:
undetectable		 2vcvF-2a8xA:
18.84
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.
2VCV_H_ASDH1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 9 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.29A 2vcvH-2a8xA:
undetectable		 2vcvH-2a8xA:
18.84
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.
2VCV_I_ASDI1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 9 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.14A 2vcvI-2a8xA:
undetectable		 2vcvI-2a8xA:
18.84
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.
2VCV_K_ASDK1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 6 PHE A 350
LEU A 316
PRO A 346
LEU A 420
ALA A 417
 FAD  A 480 ( 4.8A)
FAD  A 480 (-3.7A)
None
None
None
 1.17A 2vcvK-2a8xA:
1.8		 2vcvK-2a8xA:
18.84
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.
2W0Q_A_CUA801_0
(COPPER AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.35A 2w0qA-3hpaA:
undetectable		 2w0qA-3hpaA:
21.27
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.
2W0Q_B_CUB801_0
(COPPER AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.38A 2w0qB-3hpaA:
undetectable		 2w0qB-3hpaA:
21.27
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.
2W3M_B_FOLB1188_0
(DIHYDROFOLATE
REDUCTASE)		 4y13 TRANSCRIPTIONAL
REGULATOR OF FTSQAZ
GENE CLUSTER
(Escherichia
coli) 		5 / 12 ALA A 110
LEU A 106
ASN A  87
LEU A  93
TYR A  63
 GOL  A 304 (-2.8A)
480  A 303 ( 4.5A)
None
None
480  A 303 (-4.3A)
 1.20A 2w3mB-4y13A:
undetectable		 2w3mB-4y13A:
19.37
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.
2WGJ_A_VGHA2346_1
(HEPATOCYTE GROWTH
FACTOR RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 GLY A  83
VAL A  90
ALA A 103
TYR A 155
MET A 156
GLY A 159
ALA A 215
ASP A 216
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 ( 4.9A)
None
None
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.86A 2wgjA-2v55A:
14.7		 2wgjA-2v55A:
23.92
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.
2X45_A_HSMA1161_1
(ALLERGEN ARG R 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 5 VAL A 101
TYR A 155
ASP A 364
SER A 361
 None
ANP  A1480 ( 4.9A)
None
None
 1.31A 2x45A-2v55A:
undetectable		 2x45A-2v55A:
14.18
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.
2XP2_A_VGHA9000_1
(TYROSINE-PROTEIN
KINASE RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 9 VAL A  90
ALA A 103
MET A 156
GLY A 159
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 0.85A 2xp2A-2v55A:
19.6		 2xp2A-2v55A:
23.47
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.
2Y69_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.75A 2y69A-3hpaA:
undetectable		 2y69A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y6O_A_1N1A1892_1
(EPHRIN TYPE-A
RECEPTOR 4)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		9 / 12 LYS A  80
ILE A  82
ALA A 103
LYS A 105
GLU A 124
MET A 128
TYR A 155
GLY A 159
LEU A 205
 None
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
 1.06A 2y6oA-2v55A:
18.6		 2y6oA-2v55A:
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.
2Y7J_C_B49C1294_1
(PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 10 ILE A  82
VAL A  90
ALA A 103
MET A 156
GLY A 159
LEU A 205
 None
None
ANP  A1480 ( 3.9A)
None
None
ANP  A1480 ( 4.7A)
 0.82A 2y7jC-2v55A:
27.7		 2y7jC-2v55A:
24.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_B_SALB1305_1
(LYSR-TYPE REGULATORY
PROTEIN)		 5o60 50S RIBOSOMAL
PROTEIN L28
(Mycolicibacteriu
m
smegmatis) 		4 / 5 SER Y  26
PRO Y  12
GLY Y  13
TRP Y  29
 G  A 188 ( 2.6A)
A  A1480 ( 4.5A)
G  A 483 ( 3.4A)
G  A 483 ( 3.4A)
 0.97A 2y7kB-5o60Y:
undetectable		 2y7kB-5o60Y:
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.
2YA7_A_ZMRA1776_2
(NEURAMINIDASE A)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 6 ARG A 277
ILE A  51
LEU A  98
TYR A  19
 FAD  A 480 (-3.5A)
None
None
None
 1.00A 2ya7A-1dxlA:
0.0		 2ya7A-1dxlA:
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.
2YA7_A_ZMRA1776_2
(NEURAMINIDASE A)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		4 / 6 ARG A 274
ILE A  47
LEU A  95
TYR A  15
 FAD  A 480 (-3.9A)
None
None
None
 1.07A 2ya7A-2qaeA:
undetectable		 2ya7A-2qaeA:
22.01
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.
2YA7_B_ZMRB1776_2
(NEURAMINIDASE A)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 6 ARG A 277
ILE A  51
LEU A  98
TYR A  19
 FAD  A 480 (-3.5A)
None
None
None
 1.01A 2ya7B-1dxlA:
0.0		 2ya7B-1dxlA:
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.
2YA7_B_ZMRB1776_2
(NEURAMINIDASE A)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		4 / 6 ARG A 274
ILE A  47
LEU A  95
TYR A  15
 FAD  A 480 (-3.9A)
None
None
None
 1.07A 2ya7B-2qaeA:
undetectable		 2ya7B-2qaeA:
22.01
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.
2YA7_D_ZMRD1776_2
(NEURAMINIDASE A)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 6 ARG A 277
ILE A  51
LEU A  98
TYR A  19
 FAD  A 480 (-3.5A)
None
None
None
 1.00A 2ya7D-1dxlA:
0.0		 2ya7D-1dxlA:
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.
2YA7_D_ZMRD1776_2
(NEURAMINIDASE A)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		4 / 6 ARG A 274
ILE A  47
LEU A  95
TYR A  15
 FAD  A 480 (-3.9A)
None
None
None
 1.07A 2ya7D-2qaeA:
undetectable		 2ya7D-2qaeA:
22.01
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.
2YA7_D_ZMRD1776_2
(NEURAMINIDASE A)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 ARG A 278
ILE A  54
LEU A 101
TYR A  16
 FAD  A 480 (-3.9A)
None
None
None
 1.07A 2ya7D-3ladA:
undetectable		 2ya7D-3ladA:
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.
2YVL_A_SAMA601_0
(HYPOTHETICAL PROTEIN)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 ILE A 145
ILE A 144
ALA A 314
ALA A 325
VAL A  20
 None
None
None
FAD  A 480 (-3.5A)
None
 1.08A 2yvlA-1dxlA:
3.9		 2yvlA-1dxlA:
21.94
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.
2YVL_A_SAMA601_0
(HYPOTHETICAL PROTEIN)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 ILE A 145
ILE A 144
GLY A 316
ALA A 314
ALA A 325
 None
None
FAD  A 480 ( 4.0A)
None
FAD  A 480 (-3.5A)
 0.99A 2yvlA-1dxlA:
3.9		 2yvlA-1dxlA:
21.94
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.
2YVL_A_SAMA601_0
(HYPOTHETICAL PROTEIN)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 ILE A 142
ILE A 141
GLY A 313
ALA A 311
VAL A  16
 None
None
FAD  A 480 (-3.4A)
None
None
 0.99A 2yvlA-2qaeA:
3.0		 2yvlA-2qaeA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2YVL_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 ILE A 145
ILE A 144
GLY A 316
ALA A 314
VAL A  20
 None
None
FAD  A 480 ( 4.0A)
None
None
 1.00A 2yvlB-1dxlA:
4.1		 2yvlB-1dxlA:
21.94
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.
2YVL_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 ILE A 145
ILE A 144
GLY A 316
ALA A 325
VAL A  20
 None
None
FAD  A 480 ( 4.0A)
FAD  A 480 (-3.5A)
None
 1.08A 2yvlB-1dxlA:
4.1		 2yvlB-1dxlA:
21.94
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.
2YVL_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 ILE A 142
ILE A 141
GLY A 313
ALA A 311
VAL A  16
 None
None
FAD  A 480 (-3.4A)
None
None
 1.00A 2yvlB-2qaeA:
3.1		 2yvlB-2qaeA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2YVL_C_SAMC604_0
(HYPOTHETICAL PROTEIN)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		6 / 12 ILE A 145
ILE A 144
GLY A 316
ALA A 314
ALA A 325
VAL A  20
 None
None
FAD  A 480 ( 4.0A)
None
FAD  A 480 (-3.5A)
None
 1.12A 2yvlC-1dxlA:
3.8		 2yvlC-1dxlA:
21.94
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.
2YVL_C_SAMC604_0
(HYPOTHETICAL PROTEIN)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 ILE A 142
ILE A 141
GLY A 313
ALA A 311
VAL A  16
 None
None
FAD  A 480 (-3.4A)
None
None
 0.96A 2yvlC-2qaeA:
2.8		 2yvlC-2qaeA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZVA_A_1N1A513_1
(TYROSINE-PROTEIN
KINASE LYN)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ALA A 103
LYS A 105
GLU A 124
VAL A 137
MET A 156
GLY A 159
LEU A 205
ALA A 215
 ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.7A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.93A 2zvaA-2v55A:
21.2		 2zvaA-2v55A:
23.00
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.
2ZWE_B_DAHB98_1
(TYROSINASE
MELC)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.19A 2zweA-1fwxA:
0.0
2zweB-1fwxA:
0.6		 2zweA-1fwxA:
18.57
2zweB-1fwxA:
12.25
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.
2ZWF_B_DAHB98_1
(TYROSINASE
MELC)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.20A 2zwfA-1fwxA:
undetectable
2zwfB-1fwxA:
0.7		 2zwfA-1fwxA:
18.57
2zwfB-1fwxA:
12.25
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.
2ZWG_B_DAHB98_1
(TYROSINASE
MELC)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.22A 2zwgA-1fwxA:
undetectable
2zwgB-1fwxA:
0.7		 2zwgA-1fwxA:
18.57
2zwgB-1fwxA:
12.25
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.
2ZXW_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.77A 2zxwN-3hpaA:
undetectable		 2zxwN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A51_E_VDYE6178_1
(VITAMIN D
HYDROXYLASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 THR A 137
ILE A   8
ALA A 143
VAL A 296
LEU A 283
 None
FAD  A 480 (-4.7A)
None
None
None
 1.15A 3a51E-2qaeA:
undetectable		 3a51E-2qaeA:
23.05
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.
3ABK_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 3abkA-3hpaA:
undetectable		 3abkA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABL_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.75A 3ablA-3hpaA:
undetectable		 3ablA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABL_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.77A 3ablN-3hpaA:
undetectable		 3ablN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 3abmA-3hpaA:
undetectable		 3abmA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 3abmN-3hpaA:
undetectable		 3abmN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG1_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 3ag1A-3hpaA:
undetectable		 3ag1A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG1_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 3ag1N-3hpaA:
undetectable		 3ag1N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG2_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.73A 3ag2A-3hpaA:
undetectable		 3ag2A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG2_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.73A 3ag2N-3hpaA:
undetectable		 3ag2N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG3_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.73A 3ag3A-3hpaA:
undetectable		 3ag3A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG3_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 3ag3N-3hpaA:
undetectable		 3ag3N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG4_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.70A 3ag4A-3hpaA:
undetectable		 3ag4A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG4_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 3ag4N-3hpaA:
undetectable		 3ag4N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ARU_A_PNXA608_1
(CHITINASE A)		 5fv0 ESSC
(Geobacillus
thermodenitrific
ans) 		4 / 6 ASN A1036
SER A1037
ALA A1038
ASP A1105
 ONA  A2480 ( 4.3A)
None
ONA  A2480 ( 4.0A)
ONA  A2480 (-3.3A)
 1.24A 3aruA-5fv0A:
2.1		 3aruA-5fv0A:
20.20
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.
3ASN_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.73A 3asnA-3hpaA:
undetectable		 3asnA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASO_A_CUA517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.73A 3asoA-3hpaA:
undetectable		 3asoA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASO_N_CUN517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 3asoN-3hpaA:
undetectable		 3asoN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BEX_C_PAUC248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 VAL A 288
THR A 140
ILE A   8
LEU A 281
THR A 144
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
 1.10A 3bexC-2qaeA:
undetectable
3bexD-2qaeA:
undetectable		 3bexC-2qaeA:
19.11
3bexD-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BEX_D_PAUD248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 10 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.11A 3bexC-2qaeA:
undetectable
3bexD-2qaeA:
undetectable		 3bexC-2qaeA:
19.11
3bexD-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BEX_E_PAUE248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 10 VAL A 288
THR A 140
ILE A   8
LEU A 281
THR A 144
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
 1.10A 3bexE-2qaeA:
undetectable
3bexF-2qaeA:
undetectable		 3bexE-2qaeA:
19.11
3bexF-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BEX_F_PAUF248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.10A 3bexE-2qaeA:
undetectable
3bexF-2qaeA:
undetectable		 3bexE-2qaeA:
19.11
3bexF-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BF1_A_PAUA248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 VAL A 288
THR A 140
ILE A   8
LEU A 281
THR A 144
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
 1.15A 3bf1A-2qaeA:
undetectable
3bf1B-2qaeA:
2.0		 3bf1A-2qaeA:
19.11
3bf1B-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BF1_B_PAUB248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.20A 3bf1A-2qaeA:
undetectable
3bf1B-2qaeA:
2.0		 3bf1A-2qaeA:
19.11
3bf1B-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BF1_C_PAUC248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 VAL A 288
THR A 140
ILE A   8
LEU A 281
THR A 144
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
 1.10A 3bf1C-2qaeA:
undetectable
3bf1D-2qaeA:
undetectable		 3bf1C-2qaeA:
19.11
3bf1D-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BF1_D_PAUD248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.14A 3bf1C-2qaeA:
undetectable
3bf1D-2qaeA:
undetectable		 3bf1C-2qaeA:
19.11
3bf1D-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BF1_E_PAUE248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 VAL A 288
THR A 140
ILE A   8
LEU A 281
THR A 144
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
 1.09A 3bf1E-2qaeA:
undetectable
3bf1F-2qaeA:
undetectable		 3bf1E-2qaeA:
19.11
3bf1F-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BF1_F_PAUF248_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 11 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.13A 3bf1E-2qaeA:
undetectable
3bf1F-2qaeA:
undetectable		 3bf1E-2qaeA:
19.11
3bf1F-2qaeA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJ8_C_SPMC500_1
(DIAMINE
ACETYLTRANSFERASE 1)		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		4 / 6 ASP A2995
LEU A2935
LEU A3012
HIS A2932
 ADP  A4805 ( 4.6A)
None
None
None
 1.17A 3bj8C-5nugA:
undetectable
3bj8D-5nugA:
undetectable		 3bj8C-5nugA:
3.31
3bj8D-5nugA:
3.31
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.
3DTU_A_CUA1023_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.75A 3dtuA-3hpaA:
undetectable		 3dtuA-3hpaA:
23.67
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.
3DTU_C_CUC569_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 3dtuC-3hpaA:
undetectable		 3dtuC-3hpaA:
23.67
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.
3DZY_A_9CRA463_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3fmp ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 ILE B 295
ALA B 122
GLN B 119
ASN B  73
ALA B 147
 None
None
ADP  B 480 (-3.3A)
None
None
 1.11A 3dzyA-3fmpB:
undetectable		 3dzyA-3fmpB:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EIG_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 4y13 TRANSCRIPTIONAL
REGULATOR OF FTSQAZ
GENE CLUSTER
(Escherichia
coli) 		5 / 12 ALA A 110
LEU A 106
ASN A  87
LEU A  93
TYR A  63
 GOL  A 304 (-2.8A)
480  A 303 ( 4.5A)
None
None
480  A 303 (-4.3A)
 1.35A 3eigA-4y13A:
undetectable		 3eigA-4y13A:
17.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FRQ_A_ERYA195_1
(REPRESSOR PROTEIN
MPHR(A))		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 5 ASN A 268
ASN A 189
HIS A 325
ALA A 284
 CA  A4903 (-3.0A)
CL  A4901 (-3.8A)
CUZ  A4801 ( 3.3A)
None
 1.44A 3frqA-1fwxA:
0.0		 3frqA-1fwxA:
16.30
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.
3FRQ_B_ERYB195_1
(REPRESSOR PROTEIN
MPHR(A))		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 ASN A 268
ASN A 189
HIS A 325
ALA A 284
 CA  A4903 (-3.0A)
CL  A4901 (-3.8A)
CUZ  A4801 ( 3.3A)
None
 1.44A 3frqB-1fwxA:
undetectable		 3frqB-1fwxA:
16.30
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.
3FZG_A_SAMA300_0
(16S RRNA METHYLASE)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 THR A 145
GLY A 186
LEU A 150
VAL A 156
GLN A 212
 ANP  A 480 ( 3.5A)
None
None
None
None
 1.23A 3fzgA-3fhtA:
3.2		 3fzgA-3fhtA:
18.48
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.
3G0F_A_B49A9001_1
(MAST/STEM CELL
GROWTH FACTOR
RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 11 VAL A  90
ALA A 103
TYR A 155
GLY A 159
ASP A 160
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 0.58A 3g0fA-2v55A:
18.6		 3g0fA-2v55A:
24.02
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.
3G5D_B_1N1B1_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
LYS A 105
GLU A 124
VAL A 137
TYR A 155
LEU A 205
ALA A 215
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.84A 3g5dB-2v55A:
19.4		 3g5dB-2v55A:
23.10
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.
3G8I_A_RO7A1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA)		 2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE
(Arabidopsis
thaliana) 		5 / 12 VAL A  24
SER A 277
ILE A  42
ILE A  86
TYR A 386
 None
UDP  A1477 (-2.5A)
EDO  A1483 (-4.8A)
EDO  A1480 (-4.9A)
None
 1.26A 3g8iA-2vg8A:
undetectable		 3g8iA-2vg8A:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GRY_A_SAMA300_0
(DIMETHYLADENOSINE
TRANSFERASE)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		6 / 12 LEU A 438
GLY A 428
GLY A 431
ILE A 397
ASP A 398
ALA A 394
 None
None
None
None
ANP  A 480 (-3.2A)
None
 1.35A 3gryA-3fhtA:
3.7		 3gryA-3fhtA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3H5G_B_LEIB16_0
(COIL SER L16D-PEN)		 1b7e PROTEIN (TRANSPOSASE
INHIBITOR PROTEIN
FROM TN5)
(Escherichia
coli) 		4 / 5 LEU A 456
GLN A 403
LEU A 405
GLU A 401
 None
TPT  A 480 (-4.0A)
None
None
 1.15A 3h5gA-1b7eA:
undetectable
3h5gB-1b7eA:
undetectable		 3h5gA-1b7eA:
7.10
3h5gB-1b7eA:
7.10
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.
3HAV_A_SRYA403_1
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 5a2a APO FORM OF
ANOXYBACILLUS
ALPHA-AMYLASES
(Anoxybacillus
ayderensis) 		4 / 8 ASP A 104
ASP A 213
ASP A 182
TYR A 193
 None
ACT  A1479 (-2.6A)
CA  A1480 (-2.4A)
None
 1.20A 3havA-5a2aA:
undetectable		 3havA-5a2aA:
21.01
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.
3HII_A_CUA801_0
(AMILORIDE-SENSITIVE
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.43A 3hiiA-3hpaA:
undetectable		 3hiiA-3hpaA:
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.
3HII_B_CUB801_0
(AMILORIDE-SENSITIVE
AMINE OXIDASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A  95
HIS A  93
HIS A 153
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.42A 3hiiB-3hpaA:
undetectable		 3hiiB-3hpaA:
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.
3JX1_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 5l5n PLEXIN-A4
(Mus
musculus) 		4 / 8 GLU A 498
SER A 497
ARG A 430
VAL A 480
 GLU  A 498 ( 0.5A)
SER  A 497 ( 0.0A)
ARG  A 430 ( 0.6A)
VAL  A 480 ( 0.6A)
 1.33A 3jx1A-5l5nA:
undetectable
3jx1B-5l5nA:
undetectable		 3jx1A-5l5nA:
16.53
3jx1B-5l5nA:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JZ0_B_CLYB900_1
(LINCOSAMIDE
NUCLEOTIDYLTRANSFERA
SE)		 2qne PUTATIVE
METHYLTRANSFERASE
(Desulfitobacteri
um
hafniense) 		4 / 8 TYR A 114
TYR A  94
GLU A 136
ILE A 466
 None
None
None
EDO  A 480 ( 4.3A)
 1.08A 3jz0B-2qneA:
undetectable		 3jz0B-2qneA:
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.
3K9F_F_LFXF0_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 2ilu ALDEHYDE
DEHYDROGENASE A
(Escherichia
coli) 		4 / 5 SER A 276
ARG A 277
ARG A 290
GLY A 254
 None
None
None
SO4  A 480 (-3.1A)
 1.34A 3k9fA-2iluA:
undetectable
3k9fB-2iluA:
undetectable
3k9fC-2iluA:
1.9		 3k9fA-2iluA:
24.07
3k9fB-2iluA:
24.07
3k9fC-2iluA:
19.91
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.
3LBD_A_9CRA424_1
(RETINOIC ACID
RECEPTOR GAMMA)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 ALA A 167
LEU A 269
ILE A 185
ARG A 274
ALA A 194
 None
None
FAD  A 480 (-4.3A)
FAD  A 480 (-3.9A)
None
 1.36A 3lbdA-2qaeA:
undetectable		 3lbdA-2qaeA:
19.96
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.
3LIK_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 5 HIS A  94
HIS A 296
HIS A  93
HIS A 259
 None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 1.14A 3likA-3hpaA:
undetectable		 3likA-3hpaA:
14.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MSS_D_STID1_1
(TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 ALA A 103
ILE A 127
GLY A 159
LEU A 205
ALA A 215
ASP A 216
 ANP  A1480 ( 3.9A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 1.13A 3mssD-2v55A:
17.6		 3mssD-2v55A:
23.51
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.
3P2K_C_SAMC6735_0
(16S RRNA METHYLASE)		 2ilu ALDEHYDE
DEHYDROGENASE A
(Escherichia
coli) 		6 / 12 GLY A 253
VAL A 284
ASN A 153
ALA A 256
LEU A 250
LEU A 411
 None
None
None
SO4  A 480 (-3.8A)
OCS  A 249 ( 3.7A)
SO4  A 480 (-4.3A)
 1.25A 3p2kC-2iluA:
4.3		 3p2kC-2iluA:
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.
3PGH_A_FLPA701_1
(CYCLOOXYGENASE-2)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 VAL A 192
GLY A 166
ALA A 167
SER A 164
LEU A 189
 None
None
None
FAD  A 480 (-3.6A)
None
 1.29A 3pghA-2qaeA:
undetectable		 3pghA-2qaeA:
21.01
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.
3QL3_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ILE A   7
ALA A  19
LEU A 116
ILE A   9
THR A  29
 None
None
None
FAD  A 480 ( 4.9A)
None
 1.23A 3ql3A-3ladA:
undetectable		 3ql3A-3ladA:
16.14
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.
3QLG_A_1N1A601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
LYS A 105
GLU A 124
VAL A 137
TYR A 155
GLY A 159
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
 0.75A 3qlgA-2v55A:
19.2		 3qlgA-2v55A:
23.10
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.
3QLG_B_1N1B601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
GLU A 124
VAL A 137
TYR A 155
GLY A 159
LEU A 205
ALA A 215
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.90A 3qlgB-2v55A:
19.5		 3qlgB-2v55A:
23.10
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.
3T7V_A_SAMA992_0
(METHYLORNITHINE
SYNTHASE PYLB)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  12
GLY A  10
GLU A 108
VAL A  94
ALA A  95
 FAD  A 480 (-3.5A)
FAD  A 480 (-3.2A)
None
None
None
 1.21A 3t7vA-2a8xA:
undetectable		 3t7vA-2a8xA:
22.51
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.
3T8N_D_EDTD135_0
(STEROID
DELTA-ISOMERASE)		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		5 / 11 THR A1910
GLY A1909
ARG A2358
THR A1913
ASP A2320
 None
ADP  A4801 (-3.8A)
ADP  A4801 (-2.9A)
ADP  A4801 (-3.8A)
ADP  A4801 (-3.3A)
 1.16A 3t8nD-5nugA:
undetectable
3t8nF-5nugA:
undetectable		 3t8nD-5nugA:
2.56
3t8nF-5nugA:
2.56
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.
3T8N_D_EDTD135_0
(STEROID
DELTA-ISOMERASE)		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		5 / 11 THR A1910
GLY A1909
THR A1913
PRO A1904
ASP A2320
 None
ADP  A4801 (-3.8A)
ADP  A4801 (-3.8A)
None
ADP  A4801 (-3.3A)
 1.36A 3t8nD-5nugA:
undetectable
3t8nF-5nugA:
undetectable		 3t8nD-5nugA:
2.56
3t8nF-5nugA:
2.56
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.
3TI1_A_B49A299_1
(CYCLIN-DEPENDENT
KINASE 2)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 9 ILE A  82
ALA A 103
VAL A 137
ASP A 160
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 0.85A 3ti1A-2v55A:
21.2		 3ti1A-2v55A:
23.43
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.
3V5W_A_8PRA701_1
(G-PROTEIN COUPLED
RECEPTOR KINASE 2)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
GLY A  85
GLY A  88
VAL A  90
ALA A 103
LYS A 105
LEU A 107
 None
ANP  A1480 ( 3.8A)
None
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
 0.82A 3v5wA-2v55A:
10.9		 3v5wA-2v55A:
22.93
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.
3W6H_A_AZMA303_1
(CARBONIC ANHYDRASE 1)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 8 HIS A  80
HIS A 128
HIS A  79
HIS A 270
 CUZ  A4801 (-3.3A)
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 1.05A 3w6hA-1fwxA:
undetectable		 3w6hA-1fwxA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W6H_A_AZMA303_1
(CARBONIC ANHYDRASE 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 8 GLN A  98
HIS A  95
HIS A  93
HIS A 153
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
None
 0.96A 3w6hA-3hpaA:
undetectable		 3w6hA-3hpaA:
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.
3WG7_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.73A 3wg7A-3hpaA:
undetectable		 3wg7A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WG7_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 3wg7N-3hpaA:
undetectable		 3wg7N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3X2Q_A_CUA604_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 3x2qA-3hpaA:
undetectable		 3x2qA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3X2Q_N_CUN604_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.72A 3x2qN-3hpaA:
0.3		 3x2qN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A7B_B_HAEB1270_1
(COLLAGENASE 3)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 5 LEU A 116
HIS A 259
GLU A 262
HIS A 296
 None
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
 1.22A 4a7bB-3hpaA:
undetectable		 4a7bB-3hpaA:
16.09
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.
4ANQ_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 9 VAL A  90
ALA A 103
MET A 156
GLY A 159
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.97A 4anqA-2v55A:
19.5		 4anqA-2v55A:
23.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ANS_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 9 VAL A  90
ALA A 103
MET A 153
MET A 156
GLY A 159
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
None
None
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.88A 4ansA-2v55A:
19.5		 4ansA-2v55A:
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.
4ANS_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 9 VAL A  90
ALA A 103
MET A 156
GLY A 159
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.99A 4ansA-2v55A:
19.5		 4ansA-2v55A:
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.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 GLN A  98
HIS A 259
HIS A 296
SER A 321
ASP A 347
 None
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
None
ZN  A 480 (-3.2A)
 0.40A 4aqlA-3hpaA:
43.1		 4aqlA-3hpaA:
25.39
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.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		6 / 12 GLN A  98
LEU A 112
LEU A 116
HIS A 259
GLU A 262
HIS A 296
 None
None
None
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
 1.13A 4aqlA-3hpaA:
43.1		 4aqlA-3hpaA:
25.39
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.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 GLN A  98
LEU A 116
HIS A 259
HIS A 296
SER A 321
 None
None
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
None
 0.76A 4aqlA-3hpaA:
43.1		 4aqlA-3hpaA:
25.39
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.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 LEU A 112
HIS A 259
HIS A 296
SER A 321
ASP A 347
 None
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
None
ZN  A 480 (-3.2A)
 1.10A 4aqlA-3hpaA:
43.1		 4aqlA-3hpaA:
25.39
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.
4AQL_A_TXCA1452_2
(GUANINE DEAMINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 5 HIS A 270
LEU A  78
LEU A 130
ASP A  99
 CUZ  A4801 (-3.2A)
None
None
None
 1.23A 4aqlA-1fwxA:
undetectable		 4aqlA-1fwxA:
20.99
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.
4BKJ_B_STIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 VAL A  90
ALA A 103
GLU A 124
ILE A 127
MET A 128
MET A 151
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
None
None
None
ANP  A1480 (-3.5A)
 1.31A 4bkjB-2v55A:
18.5		 4bkjB-2v55A:
23.15
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.
4BKJ_B_STIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 VAL A  90
ALA A 103
GLU A 124
MET A 128
MET A 151
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 1.18A 4bkjB-2v55A:
18.5		 4bkjB-2v55A:
23.15
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.
4BKJ_B_STIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 VAL A  90
ALA A 103
MET A 151
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 1.07A 4bkjB-2v55A:
18.5		 4bkjB-2v55A:
23.15
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.
4BLV_A_SAMA1281_1
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE
(Arabidopsis
thaliana) 		4 / 6 HIS A  19
SER A  14
GLU A  45
ASP A  75
 EDO  A1480 ( 3.8A)
None
None
None
 1.13A 4blvA-2vg8A:
2.5		 4blvA-2vg8A:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 2ppl PANCREATIC
LIPASE-RELATED
PROTEIN 1
(Homo
sapiens) 		5 / 12 ASP A 243
HIS A 175
ASP A 194
HIS A 221
GLY A 234
 None
None
None
None
NA  A 480 (-4.3A)
 1.45A 4bz6A-2pplA:
undetectable
4bz6B-2pplA:
undetectable		 4bz6A-2pplA:
23.93
4bz6B-2pplA:
23.93
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.
4C8B_A_0LIA1000_1
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ALA A 103
LYS A 105
GLU A 124
HIS A 196
LEU A 205
ALA A 215
ASP A 216
 ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 1.12A 4c8bA-2v55A:
20.4		 4c8bA-2v55A:
24.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		5 / 11 GLY A 317
GLY A 151
ILE A 148
ASP A 318
PRO A  13
 FAD  A 480 (-3.4A)
FAD  A 480 (-3.4A)
None
FAD  A 480 (-2.9A)
FAD  A 480 (-3.5A)
 1.10A 4dcmA-1lpfA:
3.8		 4dcmA-1lpfA:
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 11 GLY A 308
GLY A 143
ILE A 140
ASP A 309
PRO A  13
 FAD  A 480 (-3.2A)
FAD  A 480 (-3.2A)
None
FAD  A 480 (-2.8A)
FAD  A 480 (-4.0A)
 1.12A 4dcmA-2a8xA:
2.6		 4dcmA-2a8xA:
22.97
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.
4DF2_A_4CHA506_0
(NADPH DEHYDROGENASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 6 TYR A  97
HIS A  93
HIS A 259
TYR A 120
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
 1.49A 4df2A-3hpaA:
6.5		 4df2A-3hpaA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DF2_A_4CHA506_0
(NADPH DEHYDROGENASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 6 TYR A  97
HIS A 153
HIS A 259
TYR A 155
 None
None
ZN  A 480 (-3.5A)
None
 1.37A 4df2A-3hpaA:
6.5		 4df2A-3hpaA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DF2_A_4CHA506_0
(NADPH DEHYDROGENASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 6 TYR A 120
HIS A  95
HIS A 259
TYR A 155
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
 1.25A 4df2A-3hpaA:
6.5		 4df2A-3hpaA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EYR_B_RITB301_1
(HIV-1 PROTEASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 7 LEU A 212
ASP A 216
VAL A 136
ILE A 195
 None
ANP  A1480 (-3.5A)
None
None
 0.90A 4eyrA-2v55A:
undetectable		 4eyrA-2v55A:
15.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FGK_A_0TXA302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 2ilu ALDEHYDE
DEHYDROGENASE A
(Escherichia
coli) 		4 / 7 TRP A 152
GLY A 253
GLY A 254
GLU A 251
 NDP  A 482 (-4.1A)
None
SO4  A 480 (-3.1A)
None
 0.90A 4fgkB-2iluA:
undetectable		 4fgkB-2iluA:
18.87
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.
4FGL_C_CLQC303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		4 / 5 GLY A2201
GLY A2200
MET A2373
GLU A2205
 None
None
ATP  A4802 (-3.4A)
None
 1.31A 4fglC-5nugA:
undetectable		 4fglC-5nugA:
4.40
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.
4H9M_A_HAEA929_1
(UREASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 5 HIS A 270
HIS A 437
HIS A  79
HIS A 128
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 0.75A 4h9mA-1fwxA:
undetectable		 4h9mA-1fwxA:
22.01
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.
4IAA_A_RTZA401_1
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 11 VAL A  90
ALA A 103
LYS A 105
ASP A 160
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 0.83A 4iaaA-2v55A:
24.3		 4iaaA-2v55A:
24.94
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.
4IFG_A_1E8A601_1
(CALMODULIN-DOMAIN
PROTEIN KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 GLY A  83
VAL A  90
ALA A 103
LEU A 139
GLY A 159
LEU A 205
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
None
None
ANP  A1480 ( 4.7A)
 0.49A 4ifgA-2v55A:
22.4		 4ifgA-2v55A:
23.67
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.
4JTP_A_ASCA802_0
(RRNA N-GLYCOSIDASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 5 TYR A 117
ILE A  35
ASN A 285
ILE A  12
 FAD  A 480 (-3.7A)
None
None
None
 0.87A 4jtpA-1dxlA:
0.0		 4jtpA-1dxlA:
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.
4K50_A_ACTA505_0
(RNA POLYMERASE
3D-POL)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		3 / 3 CYH A 314
ASN A 309
LYS A 322
 HEC  A   5 (-1.6A)
EDO  A 480 (-4.7A)
EDO  A 480 (-3.1A)
 1.44A 4k50A-2rf7A:
undetectable		 4k50A-2rf7A:
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.
4KS8_A_B49A701_1
(SERINE/THREONINE-PRO
TEIN KINASE PAK 6)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 10 ILE A  82
ALA A 103
VAL A 137
MET A 153
GLY A 159
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.1A)
None
ANP  A1480 ( 4.7A)
 0.66A 4ks8A-2v55A:
26.7		 4ks8A-2v55A:
27.09
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.
4L9I_A_8PRA601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 7 ALA A 103
LEU A 107
MET A 153
MET A 156
 ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.1A)
None
 0.82A 4l9iA-2v55A:
12.1		 4l9iA-2v55A:
27.69
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.
4L9I_A_8PRA601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 7 ALA A 103
MET A 153
MET A 156
ASP A 160
LEU A 205
 ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
None
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 0.63A 4l9iA-2v55A:
12.1		 4l9iA-2v55A:
27.69
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.
4L9I_A_8PRA601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 7 VAL A  90
ALA A 103
LEU A 107
MET A 153
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.1A)
 0.46A 4l9iA-2v55A:
12.1		 4l9iA-2v55A:
27.69
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.
4L9I_A_8PRA601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 7 VAL A  90
ALA A 103
MET A 153
ASP A 160
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 0.73A 4l9iA-2v55A:
12.1		 4l9iA-2v55A:
27.69
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.
4L9I_B_8PRB601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 8 GLY A  85
ALA A 103
LYS A 105
MET A 153
MET A 156
ASP A 160
LEU A 205
 ANP  A1480 ( 3.8A)
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
ANP  A1480 (-4.1A)
None
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 0.90A 4l9iB-2v55A:
28.0		 4l9iB-2v55A:
27.69
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.
4L9I_B_8PRB601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 8 GLY A  85
VAL A  90
ALA A 103
LYS A 105
MET A 153
ASP A 160
LEU A 205
 ANP  A1480 ( 3.8A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
ANP  A1480 (-4.1A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 0.81A 4l9iB-2v55A:
28.0		 4l9iB-2v55A:
27.69
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.
4L9I_B_8PRB601_1
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 8 GLY A  88
VAL A  90
ALA A 103
LYS A 105
MET A 153
 None
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
ANP  A1480 (-4.1A)
 1.25A 4l9iB-2v55A:
28.0		 4l9iB-2v55A:
27.69
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.
4LG1_B_SAMB301_0
(PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21D)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 285
LYS A 289
ALA A 141
TYR A 276
GLU A 274
 None
None
FAD  A 480 (-4.6A)
FAD  A 480 (-4.4A)
None
 1.13A 4lg1B-2a8xA:
3.8		 4lg1B-2a8xA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LL3_A_017A201_1
(PROTEASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		5 / 8 ALA A  18
VAL A 336
GLY A 317
VAL A 146
ILE A 147
 None
None
FAD  A 480 (-3.4A)
None
None
 1.37A 4ll3A-1lpfA:
undetectable		 4ll3A-1lpfA:
12.66
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.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 2x98 ALKALINE PHOSPHATASE
(Halobacterium
salinarum) 		5 / 12 ASP A 433
HIS A 347
HIS A 435
GLY A 434
ASP A  56
 MG  A1480 (-2.4A)
ZN  A1476 ( 3.1A)
ZN  A1475 ( 3.2A)
None
ZN  A1476 (-2.2A)
 1.01A 4lxzA-2x98A:
3.0		 4lxzA-2x98A:
20.58
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.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 2x98 ALKALINE PHOSPHATASE
(Halobacterium
salinarum) 		5 / 12 ASP A 433
HIS A 347
HIS A 435
GLY A 434
ASP A  56
 MG  A1480 (-2.4A)
ZN  A1476 ( 3.1A)
ZN  A1475 ( 3.2A)
None
ZN  A1476 (-2.2A)
 1.03A 4lxzC-2x98A:
3.2		 4lxzC-2x98A:
20.58
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.
4MXY_A_DB8A601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ALA A 103
GLU A 124
VAL A 137
MET A 153
TYR A 155
GLY A 159
LEU A 205
ASP A 216
 ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 0.91A 4mxyA-2v55A:
20.5		 4mxyA-2v55A:
23.10
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.
4MXZ_A_DB8A601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ALA A 103
GLU A 124
VAL A 137
MET A 153
TYR A 155
GLY A 159
LEU A 205
ASP A 216
 ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 0.91A 4mxzA-2v55A:
20.5		 4mxzA-2v55A:
23.10
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.
4O5F_B_PAUB302_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.10A 4o5fA-2qaeA:
undetectable
4o5fB-2qaeA:
undetectable		 4o5fA-2qaeA:
21.11
4o5fB-2qaeA:
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.
4OGR_I_ADNI401_1
(CYCLIN-DEPENDENT
KINASE 9)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 9 ILE A  82
VAL A  90
ALA A 103
ASP A 160
ASN A 203
LEU A 205
 None
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.0A)
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
 0.89A 4ogrI-2v55A:
25.0		 4ogrI-2v55A:
27.11
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.
4OTW_A_DB8A1101_1
(RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-3)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 VAL A  90
LYS A 105
VAL A 137
TYR A 155
GLY A 159
LEU A 205
ALA A 215
 None
ANP  A1480 (-3.4A)
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.90A 4otwA-2v55A:
18.0		 4otwA-2v55A:
22.64
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.
4P6S_A_DAHA305_1
(TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.87A 4p6sA-1fwxA:
undetectable		 4p6sA-1fwxA:
17.47
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.
4P6S_B_DAHB305_1
(TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.94A 4p6sB-1fwxA:
undetectable		 4p6sB-1fwxA:
17.47
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.
4PEV_B_ADNB501_1
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 SER A  56
GLY A 172
ASP A 175
GLY A  52
LYS A  94
 FAD  A 480 (-3.3A)
None
None
FAD  A 480 (-3.3A)
None
 1.30A 4pevB-3ladA:
undetectable		 4pevB-3ladA:
22.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PL1_A_SAMA401_0
(DUAL-SPECIFICITY RNA
METHYLTRANSFERASE
RLMN)		 3sm9 METABOTROPIC
GLUTAMATE RECEPTOR 3
(Homo
sapiens) 		5 / 11 PHE A 162
PRO A  21
SER A 148
ILE A 130
ASN A 134
 None
CL  A 486 ( 3.9A)
Z99  A 485 (-4.6A)
None
SO4  A 480 (-3.4A)
 1.36A 4pl1A-3sm9A:
1.9		 4pl1A-3sm9A:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QMN_A_DB8A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ALA A 103
LYS A 105
GLU A 124
MET A 153
TYR A 155
LEU A 205
ASP A 216
 ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 1.08A 4qmnA-2v55A:
26.5		 4qmnA-2v55A:
26.78
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.
4QMN_A_DB8A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
ALA A 103
GLU A 124
TYR A 155
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.92A 4qmnA-2v55A:
26.5		 4qmnA-2v55A:
26.78
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.
4QMN_A_DB8A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
ALA A 103
LYS A 105
GLU A 124
TYR A 155
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 0.88A 4qmnA-2v55A:
26.5		 4qmnA-2v55A:
26.78
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.
4QMZ_A_B49A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
GLY A  83
VAL A  90
ALA A 103
MET A 153
TYR A 155
LEU A 205
 None
ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
 0.67A 4qmzA-2v55A:
26.5		 4qmzA-2v55A:
26.78
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.
4R29_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 SER A 116
ALA A 109
MET A 110
GLY A 111
PHE A 112
 None
None
None
None
ANP  A 480 (-3.5A)
 1.25A 4r29A-3fhtA:
undetectable		 4r29A-3fhtA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R29_B_SAMB301_0
(UNCHARACTERIZED
PROTEIN)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 SER A 116
ALA A 109
MET A 110
GLY A 111
PHE A 112
 None
None
None
None
ANP  A 480 (-3.5A)
 1.20A 4r29B-3fhtA:
undetectable		 4r29B-3fhtA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R29_C_SAMC301_0
(UNCHARACTERIZED
PROTEIN)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 SER A 116
ALA A 109
MET A 110
GLY A 111
PHE A 112
 None
None
None
None
ANP  A 480 (-3.5A)
 1.21A 4r29C-3fhtA:
undetectable		 4r29C-3fhtA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R88_A_1LDA501_0
(CYTOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		6 / 12 HIS A  95
LEU A 112
HIS A 259
HIS A 296
LEU A 325
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
None
ZN  A 480 (-3.2A)
 0.71A 4r88A-3hpaA:
34.0		 4r88A-3hpaA:
25.83
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.
4R88_B_1LDB501_0
(CYTOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
LEU A 325
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 (-3.2A)
 0.73A 4r88B-3hpaA:
34.8		 4r88B-3hpaA:
25.83
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.
4R88_C_1LDC501_0
(CYTOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
LEU A 325
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 (-3.2A)
 0.75A 4r88C-3hpaA:
34.2		 4r88C-3hpaA:
25.83
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.
4R88_D_1LDD501_0
(CYTOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
LEU A 325
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 (-3.2A)
 0.70A 4r88D-3hpaA:
34.3		 4r88D-3hpaA:
25.83
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.
4R88_E_1LDE501_0
(CYTOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
LEU A 325
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 (-3.2A)
 0.70A 4r88E-3hpaA:
34.0		 4r88E-3hpaA:
25.83
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.
4R88_F_1LDF502_0
(CYTOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
LEU A 325
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
None
ZN  A 480 (-3.2A)
 0.73A 4r88F-3hpaA:
34.3		 4r88F-3hpaA:
25.83
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.
4RN6_B_15UB301_1
(THROMBIN HEAVY CHAIN)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 12 LEU A  99
ALA A 146
VAL A 149
GLY A 106
GLY A 186
 None
ANP  A 480 ( 4.6A)
None
None
None
 0.78A 4rn6B-3fhtA:
undetectable		 4rn6B-3fhtA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWP_A_AXIA601_1
(TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		9 / 12 VAL A  90
ALA A 103
LYS A 105
MET A 156
GLY A 159
ASN A 203
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.83A 4twpA-2v55A:
20.7		 4twpA-2v55A:
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.
4TWP_B_AXIB601_1
(TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
LYS A 105
MET A 156
GLY A 159
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.90A 4twpB-2v55A:
21.0		 4twpB-2v55A:
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.
4TWP_B_AXIB601_1
(TYROSINE-PROTEIN
KINASE ABL1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
MET A 156
GLY A 159
ASN A 203
LEU A 205
ALA A 215
ASP A 216
 None
ANP  A1480 ( 3.9A)
None
None
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.80A 4twpB-2v55A:
21.0		 4twpB-2v55A:
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.
4U5J_A_RXTA601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		10 / 11 GLY A  85
VAL A  90
ALA A 103
TYR A 155
MET A 156
GLY A 159
ASN A 203
LEU A 205
ALA A 215
ASP A 216
 ANP  A1480 ( 3.8A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 ( 4.9A)
None
None
MG  A1481 (-3.5A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
ANP  A1480 (-3.5A)
 0.72A 4u5jA-2v55A:
21.2		 4u5jA-2v55A:
23.10
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.
4U5J_B_RXTB601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 9 VAL A  90
ALA A 103
TYR A 155
MET A 156
GLY A 159
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 ( 4.9A)
None
None
ANP  A1480 ( 4.7A)
 0.72A 4u5jB-2v55A:
20.8		 4u5jB-2v55A:
23.10
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.
4WBO_C_ANWC601_0
(RHODOPSIN KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 6 ALA A 103
MET A 153
MET A 156
LEU A 205
 ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
None
ANP  A1480 ( 4.7A)
 0.45A 4wboC-2v55A:
27.8		 4wboC-2v55A:
27.34
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.
4WG0_B_CHDB102_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 3fmp ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 11 LEU B  97
LEU B  99
LEU B 127
ALA B 146
LEU B 150
 None
None
None
ADP  B 480 (-3.4A)
None
 1.04A 4wg0B-3fmpB:
undetectable
4wg0C-3fmpB:
undetectable
4wg0D-3fmpB:
undetectable		 4wg0B-3fmpB:
2.88
4wg0C-3fmpB:
2.88
4wg0D-3fmpB:
2.88
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.
4WG0_D_CHDD102_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 3fmp ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 11 LEU B  97
LEU B  99
LEU B 127
ALA B 146
LEU B 150
 None
None
None
ADP  B 480 (-3.4A)
None
 1.04A 4wg0D-3fmpB:
undetectable
4wg0E-3fmpB:
undetectable
4wg0F-3fmpB:
undetectable		 4wg0D-3fmpB:
2.88
4wg0E-3fmpB:
2.88
4wg0F-3fmpB:
2.88
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.
4WG0_F_CHDF103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 3fmp ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 11 LEU B  97
LEU B  99
LEU B 127
ALA B 146
LEU B 150
 None
None
None
ADP  B 480 (-3.4A)
None
 1.06A 4wg0F-3fmpB:
undetectable
4wg0G-3fmpB:
undetectable
4wg0H-3fmpB:
undetectable		 4wg0F-3fmpB:
2.88
4wg0G-3fmpB:
2.88
4wg0H-3fmpB:
2.88
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.
4WG0_I_CHDI103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 3fmp ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 11 ALA B 146
LEU B 150
LEU B 127
LEU B  97
LEU B  99
 ADP  B 480 (-3.4A)
None
None
None
None
 1.06A 4wg0G-3fmpB:
undetectable
4wg0H-3fmpB:
undetectable
4wg0I-3fmpB:
undetectable		 4wg0G-3fmpB:
2.88
4wg0H-3fmpB:
2.88
4wg0I-3fmpB:
2.88
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.
4WG0_M_CHDM103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 3fmp ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		5 / 11 ALA B 146
LEU B 150
LEU B 127
LEU B  97
LEU B  99
 ADP  B 480 (-3.4A)
None
None
None
None
 1.05A 4wg0K-3fmpB:
undetectable
4wg0L-3fmpB:
undetectable
4wg0M-3fmpB:
undetectable		 4wg0K-3fmpB:
2.88
4wg0L-3fmpB:
2.88
4wg0M-3fmpB:
2.88
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.
4XDR_A_ADNA402_1
(FAD:PROTEIN FMN
TRANSFERASE)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 GLY A  12
ALA A  11
ILE A 109
ILE A  20
VAL A 114
 FAD  A 480 (-3.1A)
None
None
None
None
 0.90A 4xdrA-3ladA:
undetectable		 4xdrA-3ladA:
23.78
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.
4XLI_A_1N1A601_1
(NON-SPECIFIC
PROTEIN-TYROSINE
KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ALA A 103
GLU A 124
VAL A 137
TYR A 155
MET A 156
GLY A 159
LEU A 205
ALA A 215
 ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.85A 4xliA-2v55A:
21.5		 4xliA-2v55A:
23.10
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.
4XLI_A_1N1A601_1
(NON-SPECIFIC
PROTEIN-TYROSINE
KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ALA A 103
LYS A 105
GLU A 124
VAL A 137
TYR A 155
MET A 156
GLY A 159
LEU A 205
 ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
None
None
ANP  A1480 ( 4.7A)
 0.86A 4xliA-2v55A:
21.5		 4xliA-2v55A:
23.10
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.
4XLI_B_1N1B600_1
(NON-SPECIFIC
PROTEIN-TYROSINE
KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ALA A 103
LYS A 105
GLU A 124
VAL A 137
TYR A 155
GLY A 159
LEU A 205
ALA A 215
 ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.82A 4xliB-2v55A:
21.4		 4xliB-2v55A:
23.10
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.
4XUD_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 GLU A  36
GLY A  13
TYR A  19
ILE A  12
ILE A 144
 FAD  A 480 (-3.6A)
FAD  A 480 ( 3.8A)
None
None
None
 1.48A 4xudA-1dxlA:
4.1		 4xudA-1dxlA:
18.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		3 / 3 GLU A 114
LYS A  33
ASN A 126
 None
FAD  A 480 (-4.6A)
None
 0.90A 4y1dA-2qaeA:
undetectable
4y1dD-2qaeA:
undetectable		 4y1dA-2qaeA:
16.85
4y1dD-2qaeA:
1.85
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.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		5 / 8 ALA A 149
VAL A   8
GLY A  14
ALA A 329
GLY A 333
 FAD  A 480 (-4.8A)
None
FAD  A 480 (-3.8A)
FAD  A 480 ( 4.0A)
None
 1.26A 4zjzB-1lpfA:
2.5		 4zjzB-1lpfA:
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.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 8 ALA A 141
VAL A   8
GLY A  14
ALA A 320
GLY A 324
 FAD  A 480 (-4.6A)
None
FAD  A 480 (-4.0A)
FAD  A 480 ( 3.9A)
None
 1.28A 4zjzB-2a8xA:
undetectable		 4zjzB-2a8xA:
22.45
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.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 8 ALA A 143
VAL A   7
GLY A  13
ALA A 326
GLY A 330
 None
None
FAD  A 480 (-3.6A)
FAD  A 480 ( 3.9A)
None
 1.21A 4zjzB-2qaeA:
undetectable		 4zjzB-2qaeA:
23.04
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.
5A06_A_SORA1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 7 ILE A 102
LEU A  46
GLY A  43
GLY A  42
 None
None
FAD  A 480 (-3.2A)
None
 0.84A 5a06A-1dxlA:
2.7		 5a06A-1dxlA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_A_SORA1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 7 ILE A 105
LEU A  49
GLY A  46
GLY A  45
 None
None
FAD  A 480 (-3.1A)
None
 0.80A 5a06A-1lpfA:
undetectable		 5a06A-1lpfA:
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.
5A06_A_SORA1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
 None
FAD  A 480 (-2.5A)
FAD  A 480 (-3.4A)
None
 0.83A 5a06A-1v59A:
undetectable		 5a06A-1v59A:
20.52
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.
5A06_B_SORB1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 7 ILE A 105
LEU A  49
GLY A  46
GLY A  45
 None
None
FAD  A 480 (-3.1A)
None
 0.80A 5a06B-1lpfA:
undetectable		 5a06B-1lpfA:
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.
5A06_C_SORC1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 7 ILE A 102
LEU A  46
GLY A  43
GLY A  42
 None
None
FAD  A 480 (-3.2A)
None
 0.83A 5a06C-1dxlA:
2.1		 5a06C-1dxlA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_C_SORC1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 7 ILE A 105
LEU A  49
GLY A  46
GLY A  45
 None
None
FAD  A 480 (-3.1A)
None
 0.80A 5a06C-1lpfA:
undetectable		 5a06C-1lpfA:
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.
5A06_C_SORC1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
 None
FAD  A 480 (-2.5A)
FAD  A 480 (-3.4A)
None
 0.81A 5a06C-1v59A:
undetectable		 5a06C-1v59A:
20.52
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.
5A06_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 7 ILE A 102
LEU A  46
GLY A  43
GLY A  42
 None
None
FAD  A 480 (-3.2A)
None
 0.83A 5a06E-1dxlA:
2.7		 5a06E-1dxlA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 7 ILE A 105
LEU A  49
GLY A  46
GLY A  45
 None
None
FAD  A 480 (-3.1A)
None
 0.80A 5a06E-1lpfA:
undetectable		 5a06E-1lpfA:
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.
5A06_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
 None
FAD  A 480 (-2.5A)
FAD  A 480 (-3.4A)
None
 0.84A 5a06E-1v59A:
undetectable		 5a06E-1v59A:
20.52
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.
5A06_F_SORF1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 7 ILE A 102
LEU A  46
GLY A  43
GLY A  42
 None
None
FAD  A 480 (-3.2A)
None
 0.85A 5a06F-1dxlA:
2.1		 5a06F-1dxlA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_F_SORF1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 7 ILE A 105
LEU A  49
GLY A  46
GLY A  45
 None
None
FAD  A 480 (-3.1A)
None
 0.78A 5a06F-1lpfA:
2.0		 5a06F-1lpfA:
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.
5A06_F_SORF1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 7 ILE A  10
GLU A  35
GLY A  14
GLY A  17
 None
FAD  A 480 (-2.5A)
FAD  A 480 (-3.4A)
None
 0.83A 5a06F-1v59A:
undetectable		 5a06F-1v59A:
20.52
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.
5AAB_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 10 VAL A  90
ALA A 103
LYS A 105
MET A 156
GLY A 159
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 1.01A 5aabA-2v55A:
19.6		 5aabA-2v55A:
23.47
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.
5AAC_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 10 VAL A  90
ALA A 103
LYS A 105
MET A 156
GLY A 159
LEU A 205
ASP A 216
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
ANP  A1480 ( 4.7A)
ANP  A1480 (-3.5A)
 1.11A 5aacA-2v55A:
19.4		 5aacA-2v55A:
23.47
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.
5B1A_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.72A 5b1aA-3hpaA:
undetectable		 5b1aA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1A_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5b1aN-3hpaA:
undetectable		 5b1aN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1B_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 5b1bA-3hpaA:
undetectable		 5b1bA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1B_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 5b1bN-3hpaA:
undetectable		 5b1bN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B3S_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.69A 5b3sA-3hpaA:
undetectable		 5b3sA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B3S_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 5b3sN-3hpaA:
0.0		 5b3sN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B8H_A_PAUA302_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 VAL A 288
THR A 140
ILE A   8
LEU A 281
THR A 144
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
 1.10A 5b8hA-2qaeA:
undetectable
5b8hB-2qaeA:
undetectable		 5b8hA-2qaeA:
19.59
5b8hB-2qaeA:
19.59
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.
5B8H_B_PAUB302_0
(TYPE III
PANTOTHENATE KINASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 LEU A 281
THR A 144
VAL A 288
THR A 140
ILE A   8
 FAD  A 480 ( 4.6A)
FAD  A 480 (-3.9A)
None
None
FAD  A 480 (-4.7A)
 1.09A 5b8hA-2qaeA:
undetectable
5b8hB-2qaeA:
undetectable		 5b8hA-2qaeA:
19.59
5b8hB-2qaeA:
19.59
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.
5DV4_A_NMYA601_1
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		5 / 12 LEU A 447
PRO A 220
ASP A 262
ILE A 338
HIS A 331
 None
None
ZN  A 479 (-2.2A)
MED  A 601 ( 4.7A)
ZN  A 480 ( 3.4A)
 1.39A 5dv4A-1kq0A:
undetectable		 5dv4A-1kq0A:
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.
5DV4_A_NMYA601_2
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)		 1wch PROTEIN TYROSINE
PHOSPHATASE,
NON-RECEPTOR TYPE 13
(Homo
sapiens) 		3 / 3 GLU A2313
TRP A2376
ASN A2372
 None
None
PO4  A3480 (-2.8A)
 1.06A 5dv4A-1wchA:
undetectable		 5dv4A-1wchA:
21.52
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.
5EQB_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 ILE A 185
GLY A 186
GLY A 181
LEU A 151
THR A 243
 FAD  A 480 (-4.3A)
None
None
None
None
 1.11A 5eqbA-2qaeA:
undetectable		 5eqbA-2qaeA:
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.
5ESL_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 5 ALA A 175
TYR A 178
GLY A  85
LEU A 205
 None
None
ANP  A1480 ( 3.8A)
ANP  A1480 ( 4.7A)
 0.99A 5eslA-2v55A:
undetectable		 5eslA-2v55A:
21.61
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.
5FHR_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		4 / 5 SER A  63
GLU A 194
TYR A 357
SER A 170
 None
None
FAD  A 480 ( 4.7A)
FAD  A 480 ( 3.7A)
 1.25A 5fhrA-1lpfA:
2.6		 5fhrA-1lpfA:
17.54
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.
5FHR_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		4 / 5 SER A  59
GLU A 197
TYR A 364
SER A 173
 None
FAD  A 480 ( 4.8A)
FAD  A 480 (-4.4A)
FAD  A 480 (-3.9A)
 1.18A 5fhrA-1v59A:
3.2		 5fhrA-1v59A:
17.05
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.
5FHR_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 SER A  63
GLU A 194
TYR A 357
SER A 170
 None
None
FAD  A 480 (-4.7A)
FAD  A 480 ( 4.1A)
 1.17A 5fhrA-3ladA:
undetectable		 5fhrA-3ladA:
17.01
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.
5HIE_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 7 GLY A  85
LEU A 139
ASP A 216
PHE A 217
 ANP  A1480 ( 3.8A)
None
ANP  A1480 (-3.5A)
None
 0.74A 5hieB-2v55A:
7.8		 5hieB-2v55A:
23.26
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.
5I3A_A_HQEA303_1
(TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.88A 5i3aA-1fwxA:
undetectable		 5i3aA-1fwxA:
17.47
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.
5I3A_B_HQEB304_1
(TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.90A 5i3aB-1fwxA:
undetectable		 5i3aB-1fwxA:
17.47
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.
5I3B_A_HQEA303_1
(TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.87A 5i3bA-1fwxA:
undetectable		 5i3bA-1fwxA:
17.47
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.
5I9Y_A_1N1A1001_1
(EPHRIN TYPE-A
RECEPTOR 2)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
ALA A 103
LYS A 105
GLU A 124
MET A 128
TYR A 155
GLY A 159
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
None
ANP  A1480 ( 4.9A)
None
 0.87A 5i9yA-2v55A:
19.0		 5i9yA-2v55A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I9Y_A_1N1A1001_1
(EPHRIN TYPE-A
RECEPTOR 2)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
ALA A 103
LYS A 105
MET A 128
TYR A 155
GLY A 159
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 ( 4.9A)
None
ANP  A1480 ( 4.7A)
 0.82A 5i9yA-2v55A:
19.0		 5i9yA-2v55A:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IAO_C_URFC301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		3 / 3 ARG A 432
HIS A 425
ARG A 429
 ANP  A 480 (-2.8A)
None
ANP  A 480 (-2.8A)
 1.03A 5iaoC-3fhtA:
3.7		 5iaoC-3fhtA:
19.17
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.
5IAO_F_URFF301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 3fht ATP-DEPENDENT RNA
HELICASE DDX19B
(Homo
sapiens) 		3 / 3 ARG A 432
HIS A 425
ARG A 429
 ANP  A 480 (-2.8A)
None
ANP  A 480 (-2.8A)
 1.08A 5iaoF-3fhtA:
4.4		 5iaoF-3fhtA:
19.17
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.
5IH0_A_ERYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE
(Arabidopsis
thaliana) 		4 / 6 TYR A 315
ASP A 117
HIS A  19
ILE A  21
 EDO  A1480 (-4.8A)
None
EDO  A1480 ( 3.8A)
UDP  A1477 (-3.7A)
 1.20A 5ih0A-2vg8A:
undetectable		 5ih0A-2vg8A:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IY5_A_CUA601_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 5iy5A-3hpaA:
undetectable		 5iy5A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IY5_N_CUN602_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 5iy5N-3hpaA:
undetectable		 5iy5N-3hpaA:
22.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5IZF_E_AZ1E2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
6J9-ZEU-DAR-ACA-DAR-
NH2)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 7 GLY A  83
GLY A  85
LYS A 105
LEU A 107
 ANP  A1480 ( 4.3A)
ANP  A1480 ( 3.8A)
ANP  A1480 (-3.4A)
None
 0.53A 5izfA-2v55A:
35.0		 5izfA-2v55A:
35.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5IZJ_G_AZ1G2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAR-DAR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 7 GLY A  83
GLY A  85
VAL A  90
LYS A 105
LEU A 107
 ANP  A1480 ( 4.3A)
ANP  A1480 ( 3.8A)
None
ANP  A1480 (-3.4A)
None
 0.47A 5izjA-2v55A:
27.0		 5izjA-2v55A:
35.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5J5X_B_AZ1B2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAL-DAR-DAR-
DAR-DAR)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		4 / 7 GLY A  83
GLY A  85
VAL A  90
LYS A 105
 ANP  A1480 ( 4.3A)
ANP  A1480 ( 3.8A)
None
ANP  A1480 (-3.4A)
 0.41A 5j5xA-2v55A:
25.0		 5j5xA-2v55A:
35.34
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.
5JVZ_B_FLPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 12 SER A  53
GLY A 169
ALA A 170
SER A 166
LEU A 272
 FAD  A 480 ( 4.8A)
None
None
None
None
 1.10A 5jvzB-1dxlA:
0.0		 5jvzB-1dxlA:
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.
5JVZ_B_FLPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		5 / 12 SER A  52
GLY A 175
ALA A 176
SER A 172
LEU A 280
 FAD  A 480 ( 3.7A)
None
None
None
None
 1.11A 5jvzB-1v59A:
undetectable		 5jvzB-1v59A:
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.
5JVZ_B_FLPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 SER A  49
GLY A 166
ALA A 167
SER A 163
LEU A 269
 FAD  A 480 ( 3.8A)
None
None
None
None
 1.10A 5jvzB-2qaeA:
undetectable		 5jvzB-2qaeA:
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.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 SER A  49
GLY A 166
ALA A 167
SER A 163
LEU A 269
 FAD  A 480 ( 3.8A)
None
None
None
None
 1.12A 5kirB-2qaeA:
undetectable		 5kirB-2qaeA:
20.69
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.
5KIR_B_RCXB601_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		4 / 4 LEU A2723
ARG A2684
ILE A2680
PHE A2727
 None
ATP  A4802 (-3.7A)
None
None
 1.18A 5kirB-5nugA:
undetectable		 5kirB-5nugA:
7.70
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.
5KQX_A_ROCA101_2
(PROTEASE E35D-SQV)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 9 VAL A 197
ILE A 199
GLY A 183
ILE A 182
ILE A 174
 None
None
None
FAD  A 480 (-4.2A)
None
 1.14A 5kqxB-2a8xA:
undetectable		 5kqxB-2a8xA:
11.73
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.
5L2I_A_LQQA900_1
(CYCLIN-DEPENDENT
KINASE 6)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 GLY A  83
VAL A  90
ALA A 103
VAL A 137
ASP A 160
LEU A 205
ALA A 215
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.65A 5l2iA-2v55A:
7.5		 5l2iA-2v55A:
26.20
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.
5L2T_A_6ZZA900_1
(CYCLIN-DEPENDENT
KINASE 6)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 GLY A  83
VAL A  90
ALA A 103
VAL A 137
ASP A 160
LEU A 205
ALA A 215
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
ANP  A1480 ( 4.1A)
 0.92A 5l2tA-2v55A:
7.5		 5l2tA-2v55A:
26.20
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.
5L2T_A_6ZZA900_1
(CYCLIN-DEPENDENT
KINASE 6)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 ILE A  82
GLY A  83
VAL A  90
ALA A 103
VAL A 137
ASP A 160
LEU A 205
 None
ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.0A)
ANP  A1480 ( 4.7A)
 1.21A 5l2tA-2v55A:
7.5		 5l2tA-2v55A:
26.20
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.
5LF3_H_BO2H306_1
(PROTEASOME SUBUNIT
BETA TYPE-7
PROTEASOME SUBUNIT
BETA TYPE-3)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		5 / 10 ALA A  18
GLU A 332
ALA A  11
GLY A  12
ALA A 149
 None
None
None
FAD  A 480 (-3.5A)
FAD  A 480 (-4.8A)
 1.21A 5lf3H-1lpfA:
undetectable
5lf3I-1lpfA:
undetectable		 5lf3H-1lpfA:
18.83
5lf3I-1lpfA:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF3_H_BO2H306_1
(PROTEASOME SUBUNIT
BETA TYPE-7
PROTEASOME SUBUNIT
BETA TYPE-3)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 10 ALA A  18
GLU A 332
ALA A  11
GLY A  12
ALA A 149
 None
None
None
FAD  A 480 (-3.1A)
FAD  A 480 (-4.6A)
 1.19A 5lf3H-3ladA:
undetectable
5lf3I-3ladA:
undetectable		 5lf3H-3ladA:
19.79
5lf3I-3ladA:
17.47
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.
5LF3_V_BO2V303_1
(PROTEASOME SUBUNIT
BETA TYPE-7
PROTEASOME SUBUNIT
BETA TYPE-3)		 1lpf DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pseudomonas
fluorescens) 		5 / 10 ALA A  18
GLU A 332
ALA A  11
GLY A  12
ALA A 149
 None
None
None
FAD  A 480 (-3.5A)
FAD  A 480 (-4.8A)
 1.22A 5lf3V-1lpfA:
undetectable
5lf3W-1lpfA:
undetectable		 5lf3V-1lpfA:
18.83
5lf3W-1lpfA:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF3_V_BO2V303_1
(PROTEASOME SUBUNIT
BETA TYPE-7
PROTEASOME SUBUNIT
BETA TYPE-3)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 10 ALA A  18
GLU A 332
ALA A  11
GLY A  12
ALA A 149
 None
None
None
FAD  A 480 (-3.1A)
FAD  A 480 (-4.6A)
 1.20A 5lf3V-3ladA:
2.3
5lf3W-3ladA:
undetectable		 5lf3V-3ladA:
19.79
5lf3W-3ladA:
17.47
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.
5LVN_A_ADNA402_1
(3-PHOSPHOINOSITIDE-D
EPENDENT PROTEIN
KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 11 GLY A  83
VAL A  90
ALA A 103
VAL A 137
TYR A 155
LEU A 205
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
 0.54A 5lvnA-2v55A:
31.7		 5lvnA-2v55A:
29.28
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.
5LW1_B_ADNB401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 9 GLY A  83
VAL A  90
ALA A 103
MET A 153
MET A 156
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
None
 0.64A 5lw1B-2v55A:
22.6		 5lw1B-2v55A:
9.85
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.
5LW1_B_ADNB401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 9 ILE A  82
GLY A  83
VAL A  90
ALA A 103
MET A 156
 None
ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
None
 0.67A 5lw1B-2v55A:
22.6		 5lw1B-2v55A:
9.85
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.
5LW1_E_ADNE401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 10 GLY A  83
VAL A  90
ALA A 103
MET A 153
MET A 156
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
None
 0.65A 5lw1E-2v55A:
22.6		 5lw1E-2v55A:
9.85
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.
5LW1_H_ADNH401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		5 / 9 GLY A  83
VAL A  90
ALA A 103
MET A 153
MET A 156
 ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.1A)
None
 0.52A 5lw1H-2v55A:
22.7		 5lw1H-2v55A:
9.85
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.
5M8R_A_MMSA511_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.94A 5m8rA-1fwxA:
0.0		 5m8rA-1fwxA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M8R_B_MMSB514_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 8 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.95A 5m8rB-1fwxA:
0.0		 5m8rB-1fwxA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M8R_D_MMSD509_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 8 HIS A 437
HIS A  80
ASN A  98
HIS A 128
 CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.3A)
None
CUZ  A4801 (-3.2A)
 0.94A 5m8rD-1fwxA:
undetectable		 5m8rD-1fwxA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MAF_A_XINA403_1
(MATERNAL EMBRYONIC
LEUCINE ZIPPER
KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 ILE A  82
GLY A  83
VAL A  90
ALA A 103
LYS A 105
GLU A 124
TYR A 155
GLY A 159
 None
ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 ( 4.9A)
None
 0.58A 5mafA-2v55A:
26.9		 5mafA-2v55A:
11.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MHW_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.96A 5mhwA-3hpaA:
undetectable		 5mhwA-3hpaA:
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.
5MHX_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mhxA-3hpaA:
undetectable		 5mhxA-3hpaA:
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.
5MHY_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mhyA-3hpaA:
undetectable		 5mhyA-3hpaA:
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.
5MHZ_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mhzA-3hpaA:
undetectable		 5mhzA-3hpaA:
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.
5MI1_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mi1A-3hpaA:
undetectable		 5mi1A-3hpaA:
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.
5MI2_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mi2A-3hpaA:
undetectable		 5mi2A-3hpaA:
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.
5MIA_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5miaA-3hpaA:
undetectable		 5miaA-3hpaA:
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.
5MIB_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mibA-3hpaA:
undetectable		 5mibA-3hpaA:
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.
5MIC_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5micA-3hpaA:
undetectable		 5micA-3hpaA:
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.
5MID_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.96A 5midA-3hpaA:
undetectable		 5midA-3hpaA:
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.
5MIE_A_CUA601_0
(LACCASE 2)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 257
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 0.95A 5mieA-3hpaA:
undetectable		 5mieA-3hpaA:
22.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5N3H_A_NCAA401_0
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 10 VAL A  90
ALA A 103
VAL A 137
MET A 153
TYR A 155
LEU A 205
PHE A 368
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-4.7A)
ANP  A1480 (-4.1A)
ANP  A1480 ( 4.9A)
ANP  A1480 ( 4.7A)
ANP  A1480 (-4.5A)
 0.72A 5n3hA-2v55A:
35.2		 5n3hA-2v55A:
34.59
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.
5NNW_D_GCSD302_1
(25 KDA PROTEIN
ELICITOR)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		4 / 7 GLY A 330
HIS A 331
ASP A 262
HIS A 231
 None
ZN  A 480 ( 3.4A)
ZN  A 479 (-2.2A)
MED  A 601 (-4.2A)
 0.81A 5nnwD-1kq0A:
0.0		 5nnwD-1kq0A:
10.06
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.
5NO9_D_95ZD302_1
(25 KDA PROTEIN
ELICITOR)		 1kq0 METHIONINE
AMINOPEPTIDASE 2
(Homo
sapiens) 		4 / 7 GLY A 330
HIS A 331
ASP A 262
HIS A 231
 None
ZN  A 480 ( 3.4A)
ZN  A 479 (-2.2A)
MED  A 601 (-4.2A)
 0.82A 5no9D-1kq0A:
0.0		 5no9D-1kq0A:
10.06
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.
5O96_D_SAMD501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 10 LEU A 148
ILE A   9
GLY A  10
GLY A  15
VAL A   6
 None
FAD  A 480 ( 4.9A)
FAD  A 480 (-3.2A)
None
None
 0.99A 5o96C-3ladA:
undetectable
5o96D-3ladA:
undetectable		 5o96C-3ladA:
20.08
5o96D-3ladA:
20.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 128
ASP A 188
HIS A 270
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.71A 5oexA-1fwxA:
26.8		 5oexA-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 270
ASP A 188
HIS A 128
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.72A 5oexA-1fwxA:
26.8		 5oexA-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA602_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 LYS A 100
HIS A 128
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 0.84A 5oexA-1fwxA:
26.8		 5oexA-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA603_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 4 LYS A 100
HIS A 128
HIS A  80
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 (-3.2A)
 1.17A 5oexA-1fwxA:
26.8		 5oexA-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA604_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 376
HIS A 437
HIS A  79
 CUZ  A4801 (-3.3A)
CUZ  A4801 (-3.0A)
CUZ  A4801 (-3.2A)
 0.50A 5oexA-1fwxA:
26.8		 5oexA-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_B_CUB601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 128
ASP A 188
HIS A 270
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.63A 5oexB-1fwxA:
8.0		 5oexB-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_B_CUB601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 270
ASP A 188
HIS A 128
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.77A 5oexB-1fwxA:
8.0		 5oexB-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_B_CUB602_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 LYS A 100
HIS A 128
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 0.95A 5oexB-1fwxA:
8.0		 5oexB-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_B_CUB603_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 4 LYS A 100
HIS A 128
HIS A  80
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 (-3.2A)
 1.20A 5oexB-1fwxA:
8.0		 5oexB-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_C_CUC601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 128
ASP A 188
HIS A 270
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.59A 5oexC-1fwxA:
11.3		 5oexC-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_C_CUC601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 270
ASP A 188
HIS A 128
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.73A 5oexC-1fwxA:
11.3		 5oexC-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_C_CUC602_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 4 LYS A 100
HIS A 128
HIS A  80
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 (-3.2A)
 1.20A 5oexC-1fwxA:
11.3		 5oexC-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_C_CUC603_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 LYS A 100
HIS A 128
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 0.91A 5oexC-1fwxA:
11.3		 5oexC-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_D_CUD601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 128
ASP A 188
HIS A 270
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.59A 5oexD-1fwxA:
19.3		 5oexD-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_D_CUD601_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 HIS A 270
ASP A 188
HIS A 128
 CUZ  A4801 (-3.2A)
None
CUZ  A4801 (-3.2A)
 0.74A 5oexD-1fwxA:
19.3		 5oexD-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_D_CUD603_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		3 / 3 LYS A 100
HIS A 128
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.2A)
 0.84A 5oexD-1fwxA:
19.3		 5oexD-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_D_CUD604_0
(THIOCYANATE
DEHYDROGENASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 4 LYS A 100
HIS A 128
HIS A  80
HIS A  79
 None
CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 (-3.2A)
 1.15A 5oexD-1fwxA:
19.3		 5oexD-1fwxA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TE0_A_XINA401_1
(AP2-ASSOCIATED
PROTEIN KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 LEU A  92
ALA A 103
GLU A 124
MET A 128
GLY A 158
LEU A 205
 None
ANP  A1480 ( 3.9A)
None
None
None
ANP  A1480 ( 4.7A)
 1.13A 5te0A-2v55A:
23.8		 5te0A-2v55A:
25.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TE0_A_XINA401_1
(AP2-ASSOCIATED
PROTEIN KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 LEU A  92
ALA A 103
GLU A 124
MET A 128
GLY A 159
ASN A 163
LEU A 205
 None
ANP  A1480 ( 3.9A)
None
None
None
None
ANP  A1480 ( 4.7A)
 1.05A 5te0A-2v55A:
23.8		 5te0A-2v55A:
25.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TE0_A_XINA401_1
(AP2-ASSOCIATED
PROTEIN KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 LEU A  92
ALA A 103
GLU A 124
VAL A 137
GLY A 158
LEU A 205
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
None
ANP  A1480 ( 4.7A)
 1.02A 5te0A-2v55A:
23.8		 5te0A-2v55A:
25.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TE0_A_XINA401_1
(AP2-ASSOCIATED
PROTEIN KINASE 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		7 / 12 LEU A  92
ALA A 103
GLU A 124
VAL A 137
GLY A 159
ASN A 163
LEU A 205
 None
ANP  A1480 ( 3.9A)
None
ANP  A1480 (-4.7A)
None
None
ANP  A1480 ( 4.7A)
 1.00A 5te0A-2v55A:
23.8		 5te0A-2v55A:
25.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TJY_A_BEZA304_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		3 / 3 MET A 331
GLU A 156
ARG A 285
 None
None
FAD  A 480 (-3.8A)
 1.10A 5tjyA-1v59A:
undetectable		 5tjyA-1v59A:
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.
5TJY_A_BEZA304_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		3 / 3 MET A 321
GLU A 147
ARG A 274
 None
None
FAD  A 480 (-3.9A)
 0.96A 5tjyA-2qaeA:
4.4		 5tjyA-2qaeA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TJZ_A_BEZA302_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		3 / 3 MET A 331
GLU A 156
ARG A 285
 None
None
FAD  A 480 (-3.8A)
 1.11A 5tjzA-1v59A:
4.1		 5tjzA-1v59A:
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.
5TJZ_A_BEZA302_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		3 / 3 MET A 321
GLU A 147
ARG A 274
 None
None
FAD  A 480 (-3.9A)
 0.98A 5tjzA-2qaeA:
3.3		 5tjzA-2qaeA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UL4_A_SAMA803_0
(OXSB PROTEIN)		 1v59 DIHYDROLIPOAMIDE
DEHYDROGENASE
(Saccharomyces
cerevisiae) 		5 / 12 PHE A 106
ALA A 152
GLY A  13
GLY A  41
ILE A 102
 None
None
FAD  A 480 ( 4.8A)
None
None
 1.17A 5ul4A-1v59A:
undetectable		 5ul4A-1v59A:
21.29
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.
5VC3_A_DB8A601_1
(WEE1-LIKE PROTEIN
KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 ILE A  82
GLY A  83
ALA A 103
GLU A 124
TYR A 155
ASP A 216
 None
ANP  A1480 ( 4.3A)
ANP  A1480 ( 3.9A)
None
ANP  A1480 ( 4.9A)
ANP  A1480 (-3.5A)
 0.92A 5vc3A-2v55A:
22.3		 5vc3A-2v55A:
24.40
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.
5VC3_A_DB8A601_1
(WEE1-LIKE PROTEIN
KINASE)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		6 / 12 ILE A  82
GLY A  83
GLU A 124
TYR A 155
GLY A 159
ASP A 216
 None
ANP  A1480 ( 4.3A)
None
ANP  A1480 ( 4.9A)
None
ANP  A1480 (-3.5A)
 0.82A 5vc3A-2v55A:
22.3		 5vc3A-2v55A:
24.40
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.
5VLM_H_CVIH301_1
(REGULATORY PROTEIN
TETR)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		4 / 8 GLN A 265
GLY A 268
ILE A 182
ASP A 309
 None
None
FAD  A 480 (-4.2A)
FAD  A 480 (-2.8A)
 0.93A 5vlmH-2a8xA:
0.0		 5vlmH-2a8xA:
17.89
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.
5VW9_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		4 / 8 THR A  44
GLY A  43
GLY A  15
GLU A 329
 FAD  A 480 (-3.9A)
FAD  A 480 (-3.2A)
FAD  A 480 (-3.9A)
None
 0.68A 5vw9A-1dxlA:
3.5		 5vw9A-1dxlA:
21.99
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.
5WAU_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.75A 5waua-3hpaA:
undetectable		 5waua-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X19_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.72A 5x19A-3hpaA:
undetectable		 5x19A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5xdxA-3hpaA:
undetectable		 5xdxA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5xdxN-3hpaA:
undetectable		 5xdxN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XIW_D_LOCD503_2
(TUBULIN BETA CHAIN)		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		5 / 12 LEU A1896
ALA A1895
THR A1913
ILE A2014
ALA A2013
 None
None
ADP  A4801 (-3.8A)
None
None
 1.24A 5xiwD-5nugA:
undetectable		 5xiwD-5nugA:
1.62
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.
5Y2T_B_8LXB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1
(Homo
sapiens) 		4 / 8 GLU A2344
HIS A2689
PHE A2682
LEU A2632
 MG  A4803 ( 3.1A)
None
None
None
 1.02A 5y2tB-5nugA:
undetectable		 5y2tB-5nugA:
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.
5YF0_A_SAMA505_0
(CARNOSINE
N-METHYLTRANSFERASE)		 2qae DIHYDROLIPOYL
DEHYDROGENASE
(Trypanosoma
cruzi) 		5 / 12 GLY A 115
GLY A 113
PHE A 117
CYH A  30
THR A 144
 FAD  A 480 (-3.8A)
None
None
None
FAD  A 480 (-3.9A)
 1.47A 5yf0A-2qaeA:
3.1		 5yf0A-2qaeA:
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.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.18A 5z0fA-1fwxA:
undetectable
5z0fB-1fwxA:
0.8		 5z0fA-1fwxA:
9.59
5z0fB-1fwxA:
9.81
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.
5Z0G_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.19A 5z0gA-1fwxA:
0.0
5z0gB-1fwxA:
0.8		 5z0gA-1fwxA:
9.59
5z0gB-1fwxA:
9.81
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.
5Z0H_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.21A 5z0hA-1fwxA:
0.0
5z0hB-1fwxA:
1.1		 5z0hA-1fwxA:
9.59
5z0hB-1fwxA:
9.81
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.
5Z0I_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.20A 5z0iA-1fwxA:
undetectable
5z0iB-1fwxA:
0.9		 5z0iA-1fwxA:
9.59
5z0iB-1fwxA:
9.81
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.
5Z0J_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.19A 5z0jA-1fwxA:
undetectable
5z0jB-1fwxA:
0.6		 5z0jA-1fwxA:
9.59
5z0jB-1fwxA:
9.81
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.
5Z0K_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.19A 5z0kA-1fwxA:
undetectable
5z0kB-1fwxA:
0.6		 5z0kA-1fwxA:
9.59
5z0kB-1fwxA:
9.81
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.
5Z0L_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.21A 5z0lA-1fwxA:
0.0
5z0lB-1fwxA:
0.7		 5z0lA-1fwxA:
9.59
5z0lB-1fwxA:
9.81
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.
5Z0M_B_DAHB98_0
(MELC
TYROSINASE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 11 HIS A 128
HIS A  80
HIS A 325
ASN A 273
VAL A 283
 CUZ  A4801 (-3.2A)
CUZ  A4801 (-3.3A)
CUZ  A4801 ( 3.3A)
CL  A4901 (-3.5A)
None
 1.26A 5z0mA-1fwxA:
0.0
5z0mB-1fwxA:
0.6		 5z0mA-1fwxA:
9.77
5z0mB-1fwxA:
9.81
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.
5Z84_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5z84A-3hpaA:
undetectable		 5z84A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z84_N_CUN604_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 5z84N-3hpaA:
undetectable		 5z84N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z85_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 5z85A-3hpaA:
undetectable		 5z85A-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z85_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.76A 5z85N-3hpaA:
0.6		 5z85N-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5zcoA-3hpaA:
undetectable		 5zcoA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_N_CUN604_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.71A 5zcoN-3hpaA:
0.6		 5zcoN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCP_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.75A 5zcpA-3hpaA:
undetectable		 5zcpA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCP_N_CUN604_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.77A 5zcpN-3hpaA:
undetectable		 5zcpN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCQ_A_CUA603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5zcqA-3hpaA:
undetectable		 5zcqA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCQ_N_CUN603_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 5zcqN-3hpaA:
undetectable		 5zcqN-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZRD_B_CUB606_0
(TYROSINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 5 HIS A 153
HIS A 259
HIS A  93
HIS A  95
 None
ZN  A 480 (-3.5A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.95A 5zrdB-3hpaA:
undetectable		 5zrdB-3hpaA:
22.63
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.
5ZRD_C_CUC604_0
(TYROSINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 153
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 1.18A 5zrdC-3hpaA:
undetectable		 5zrdC-3hpaA:
22.63
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.
5ZRD_C_CUC604_0
(TYROSINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A 153
HIS A 259
HIS A  93
HIS A  95
 None
ZN  A 480 (-3.5A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.99A 5zrdC-3hpaA:
undetectable		 5zrdC-3hpaA:
22.63
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.
5ZRD_D_CUD607_0
(TYROSINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A  95
HIS A 153
HIS A  93
HIS A 259
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
 1.15A 5zrdD-3hpaA:
undetectable		 5zrdD-3hpaA:
22.63
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.
5ZRD_D_CUD607_0
(TYROSINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		4 / 4 HIS A 153
HIS A 259
HIS A  93
HIS A  95
 None
ZN  A 480 (-3.5A)
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.98A 5zrdD-3hpaA:
undetectable		 5zrdD-3hpaA:
22.63
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.
5ZV2_A_LEVA801_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1)		 3sag EXOSOME COMPONENT 10
(Homo
sapiens) 		3 / 3 LYS A 480
LEU A 216
ASP A 252
 LYS  A 480 ( 0.0A)
LEU  A 216 ( 0.6A)
ASP  A 252 ( 0.6A)
 0.84A 5zv2A-3sagA:
undetectable		 5zv2A-3sagA:
12.02
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.
6AG0_A_ACRA606_0
(ALPHA-AMYLASE)		 1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE
(Pisum
sativum) 		5 / 7 GLY A  42
GLY A  15
PRO A  16
GLY A  17
GLY A  18
 None
FAD  A 480 (-3.9A)
FAD  A 480 (-3.8A)
FAD  A 480 (-3.2A)
None
 0.97A 6ag0A-1dxlA:
undetectable		 6ag0A-1dxlA:
10.73
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.
6BQG_A_ERMA1201_2
(5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562)		 3lad DIHYDROLIPOAMIDE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 VAL A   6
THR A  29
VAL A 319
LEU A 285
 None
None
None
FAD  A 480 (-4.8A)
 1.01A 6bqgA-3ladA:
2.6		 6bqgA-3ladA:
10.92
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.
6BSD_A_1N1A901_0
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 2v55 RHO-ASSOCIATED
PROTEIN KINASE 1
(Homo
sapiens) 		8 / 12 VAL A  90
ALA A 103
LYS A 105
GLU A 124
TYR A 155
MET A 156
GLY A 159
LEU A 205
 None
ANP  A1480 ( 3.9A)
ANP  A1480 (-3.4A)
None
ANP  A1480 ( 4.9A)
None
None
ANP  A1480 ( 4.7A)
 0.86A 6bsdA-2v55A:
17.9		 6bsdA-2v55A:
10.83
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.
6EMU_C_SAMC301_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 307
GLY A  14
ILE A 331
VAL A   6
ILE A 139
 None
FAD  A 480 (-4.0A)
None
None
None
 1.07A 6emuC-2a8xA:
3.4		 6emuC-2a8xA:
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.
6EXI_A_ADNA502_0
(ADENOSYLHOMOCYSTEINA
SE)		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		5 / 12 THR A 202
HIS A  82
ASN A 273
GLY A 271
HIS A 325
 None
None
CL  A4901 (-3.5A)
CL  A4901 ( 3.7A)
CUZ  A4801 ( 3.3A)
 1.48A 6exiA-1fwxA:
undetectable		 6exiA-1fwxA:
8.83
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.
6EXI_A_ADNA503_0
(ADENOSYLHOMOCYSTEINA
SE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 10 GLY A  10
GLY A  12
GLU A  33
THR A 142
ASN A 272
 FAD  A 480 (-3.2A)
FAD  A 480 (-3.5A)
FAD  A 480 (-2.6A)
FAD  A 480 (-3.9A)
None
 0.89A 6exiA-2a8xA:
2.5		 6exiA-2a8xA:
11.33
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.
6EXI_B_ADNB503_1
(ADENOSYLHOMOCYSTEINA
SE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 10 GLY A  10
GLY A  12
GLU A  33
THR A 142
ASN A 272
 FAD  A 480 (-3.2A)
FAD  A 480 (-3.5A)
FAD  A 480 (-2.6A)
FAD  A 480 (-3.9A)
None
 0.91A 6exiB-2a8xA:
2.5		 6exiB-2a8xA:
11.33
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.
6EXI_C_ADNC503_0
(ADENOSYLHOMOCYSTEINA
SE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  10
GLY A  12
GLU A  33
THR A 142
ASN A 272
 FAD  A 480 (-3.2A)
FAD  A 480 (-3.5A)
FAD  A 480 (-2.6A)
FAD  A 480 (-3.9A)
None
 0.92A 6exiC-2a8xA:
2.7
6exiD-2a8xA:
2.6		 6exiC-2a8xA:
11.33
6exiD-2a8xA:
11.33
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.
6EXI_D_ADND503_0
(ADENOSYLHOMOCYSTEINA
SE)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  10
GLY A  12
GLU A  33
THR A 142
ASN A 272
 FAD  A 480 (-3.2A)
FAD  A 480 (-3.5A)
FAD  A 480 (-2.6A)
FAD  A 480 (-3.9A)
None
 0.89A 6exiC-2a8xA:
2.7
6exiD-2a8xA:
2.6		 6exiC-2a8xA:
11.33
6exiD-2a8xA:
11.33
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.
6HU9_Q_PCFQ202_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL
CYTOCHROME C OXIDASE
SUBUNIT 1)		 1qd1 FORMIMINOTRANSFERASE
-CYCLODEAMINASE
(Sus
scrofa) 		4 / 6 ILE A 222
ALA A 196
ARG A 193
ASP A 227
 GOL  A 480 (-4.3A)
None
None
None
 1.11A 6hu9m-1qd1A:
0.0
6hu9q-1qd1A:
undetectable		 6hu9m-1qd1A:
20.19
6hu9q-1qd1A:
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.
6HWD_H_BO2H301_0
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-3)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 12 GLN A 323
ALA A 327
ALA A  11
GLY A  12
ALA A 141
 None
None
None
FAD  A 480 (-3.5A)
FAD  A 480 (-4.6A)
 1.03A 6hwdH-2a8xA:
undetectable
6hwdI-2a8xA:
undetectable		 6hwdH-2a8xA:
11.11
6hwdI-2a8xA:
12.15
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.
6HWD_V_BO2V301_0
(PROTEASOME SUBUNIT
BETA TYPE-2)		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		5 / 11 GLN A 323
ALA A 327
ALA A  11
GLY A  12
ALA A 141
 None
None
None
FAD  A 480 (-3.5A)
FAD  A 480 (-4.6A)
 1.03A 6hwdV-2a8xA:
undetectable		 6hwdV-2a8xA:
11.11
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.
6N7F_A_RBFA502_0
(PUTATIVE GLUTATHIONE
REDUCTASE (GR))		 1fwx NITROUS OXIDE
REDUCTASE
(Paracoccus
denitrificans) 		4 / 7 GLY A  76
HIS A  80
ASN A  98
GLY A 126
 None
CUZ  A4801 (-3.3A)
None
None
 0.97A 6n7fA-1fwxA:
undetectable		 6n7fA-1fwxA:
9.08
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.
6N7F_A_RBFA502_0
(PUTATIVE GLUTATHIONE
REDUCTASE (GR))		 2a8x DIHYDROLIPOYL
DEHYDROGENASE
(Mycobacterium
tuberculosis) 		4 / 7 TYR A 112
ASN A 272
GLU A 274
GLY A 275
 FAD  A 480 (-3.4A)
None
None
None
 0.83A 6n7fA-2a8xA:
44.1		 6n7fA-2a8xA:
15.59
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.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
HIS A 259
GLU A 262
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.86A 6n91A-3hpaA:
23.1		 6n91A-3hpaA:
10.27
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.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.70A 6n91A-3hpaA:
23.1		 6n91A-3hpaA:
10.27
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.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
HIS A 259
GLU A 262
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
ZN  A 480 (-3.5A)
None
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.85A 6n91B-3hpaA:
23.2		 6n91B-3hpaA:
10.27
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.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)		 3hpa AMIDOHYDROLASE
(unidentified) 		5 / 12 HIS A  95
LEU A 112
HIS A 259
HIS A 296
ASP A 347
 ZN  A 480 (-3.3A)
None
ZN  A 480 (-3.5A)
ZN  A 480 ( 4.8A)
ZN  A 480 (-3.2A)
 0.61A 6n91B-3hpaA:
23.2		 6n91B-3hpaA:
10.27
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.
6NKN_A_CUA601_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.74A 6nknA-3hpaA:
undetectable		 6nknA-3hpaA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_N_CUN602_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 3hpa AMIDOHYDROLASE
(unidentified) 		3 / 3 HIS A 153
HIS A  95
HIS A  93
 None
ZN  A 480 (-3.3A)
ZN  A 480 (-3.3A)
 0.75A 6nknN-3hpaA:
undetectable		 6nknN-3hpaA:
22.36