SIMILAR PATTERNS OF AMINO ACIDS FOR 6EKU_A_ZMRA901

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1g0i INOSITOL
MONOPHOSPHATASE

(Methanocaldococcus
jannaschii) 		PF00459
(Inositol_P) 		5 ILE A 171
ASN A  88
GLU A 178
ASP A  84
TYR A 152
 None
None
None
MN  A 290 ( 3.3A)
None
 1.08A 6ekuA-1g0iA:
undetectable		 6ekuA-1g0iA:
14.51
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.
1ms8 TRANS-SIALIDASE

(Trypanosoma
cruzi) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		6 ARG A  35
ARG A  53
ASP A  96
ARG A 245
ASP A 247
TYR A 342
 DAN  A 700 (-3.0A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
None
DAN  A 700 (-3.5A)
 0.91A 6ekuA-1ms8A:
38.0		 6ekuA-1ms8A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ms8 TRANS-SIALIDASE

(Trypanosoma
cruzi) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		7 ARG A  35
ARG A  53
ASP A  96
GLU A 230
ARG A 245
ARG A 314
TYR A 342
 DAN  A 700 (-3.0A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
 0.85A 6ekuA-1ms8A:
38.0		 6ekuA-1ms8A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mz5 SIALIDASE

(Trypanosoma
rangeli) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		6 ARG A  36
ILE A  37
ARG A  54
ARG A 246
ASP A 248
TYR A 343
 None
 1.05A 6ekuA-1mz5A:
38.7		 6ekuA-1mz5A:
21.78
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.
1mz5 SIALIDASE

(Trypanosoma
rangeli) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		7 ARG A  36
ILE A  37
ARG A  54
GLU A 231
ARG A 246
ARG A 315
TYR A 343
 None
 0.54A 6ekuA-1mz5A:
38.7		 6ekuA-1mz5A:
21.78
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.
1mz5 SIALIDASE

(Trypanosoma
rangeli) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		6 ARG A  36
ILE A  37
ASP A  97
ARG A 246
ASP A 248
TYR A 343
 None
 1.20A 6ekuA-1mz5A:
38.7		 6ekuA-1mz5A:
21.78
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.
1mz5 SIALIDASE

(Trypanosoma
rangeli) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		7 ARG A  36
ILE A  37
ASP A  97
GLU A 231
ARG A 246
ARG A 315
TYR A 343
 None
 0.79A 6ekuA-1mz5A:
38.7		 6ekuA-1mz5A:
21.78
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.
1nmb N9 NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG N 118
GLU N 277
ARG N 292
ARG N 371
TYR N 406
 None
 0.58A 6ekuA-1nmbN:
11.4		 6ekuA-1nmbN:
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.
1v0z NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 124
GLU A 284
ARG A 299
ARG A 378
TYR A 412
 None
 0.41A 6ekuA-1v0zA:
11.8		 6ekuA-1v0zA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vcj NEURAMINIDASE

(Influenza B
virus) 		PF00064
(Neur) 		5 ARG A 116
GLU A 276
ARG A 292
ARG A 374
TYR A 409
 IBA  A   1 (-3.3A)
IBA  A   1 (-3.9A)
IBA  A   1 (-3.5A)
IBA  A   1 (-3.2A)
None
 0.44A 6ekuA-1vcjA:
14.0		 6ekuA-1vcjA:
19.06
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		7 ARG A  68
ILE A  69
ARG A  87
ARG A 276
ASP A 259
ARG A 342
TYR A 370
 CIT  A1649 ( 2.6A)
None
CIT  A1649 (-3.0A)
CIT  A1649 ( 2.7A)
GOL  A1651 (-2.8A)
CIT  A1649 ( 2.9A)
CIT  A1649 (-4.5A)
 0.79A 6ekuA-1w8oA:
43.3		 6ekuA-1w8oA:
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		7 ARG A  68
ILE A  69
ARG A  87
GLU A 260
ARG A 276
ARG A 342
TYR A 370
 CIT  A1649 ( 2.6A)
None
CIT  A1649 (-3.0A)
GOL  A1651 (-3.6A)
CIT  A1649 ( 2.7A)
CIT  A1649 ( 2.9A)
CIT  A1649 (-4.5A)
 0.41A 6ekuA-1w8oA:
43.3		 6ekuA-1w8oA:
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		7 ARG A  68
ILE A  69
ASP A 131
ARG A 276
ASP A 259
ARG A 342
TYR A 370
 CIT  A1649 ( 2.6A)
None
GOL  A1650 (-2.7A)
CIT  A1649 ( 2.7A)
GOL  A1651 (-2.8A)
CIT  A1649 ( 2.9A)
CIT  A1649 (-4.5A)
 1.01A 6ekuA-1w8oA:
43.3		 6ekuA-1w8oA:
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		7 ARG A  68
ILE A  69
ASP A 131
GLU A 260
ARG A 276
ARG A 342
TYR A 370
 CIT  A1649 ( 2.6A)
None
GOL  A1650 (-2.7A)
GOL  A1651 (-3.6A)
CIT  A1649 ( 2.7A)
CIT  A1649 ( 2.9A)
CIT  A1649 (-4.5A)
 0.68A 6ekuA-1w8oA:
43.3		 6ekuA-1w8oA:
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.
1xog NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 119
GLU A 279
ARG A 294
ARG A 372
TYR A 406
 ABW  A1000 (-3.2A)
ABW  A1000 (-4.5A)
ABW  A1000 (-3.4A)
ABW  A1000 (-2.8A)
ABW  A1000 (-4.9A)
 0.50A 6ekuA-1xogA:
11.7		 6ekuA-1xogA:
17.48
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.
2b0v NUDIX HYDROLASE

(Nitrosomonas
europaea) 		PF00293
(NUDIX) 		5 ARG A 139
GLU A  65
GLU A  14
ASP A  17
TYR A 134
 None
 1.34A 6ekuA-2b0vA:
undetectable		 6ekuA-2b0vA:
11.51
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.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		7 ARG A 266
ILE A 267
ARG A 285
GLU A 539
ARG A 555
ARG A 615
TYR A 655
 SIA  A1692 (-2.7A)
SIA  A1692 (-4.5A)
SIA  A1692 (-3.6A)
SIA  A1692 ( 3.9A)
SIA  A1692 (-2.9A)
SIA  A1692 (-3.1A)
SIA  A1692 (-4.2A)
 0.39A 6ekuA-2bf6A:
44.2		 6ekuA-2bf6A:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		7 ARG A 266
ILE A 267
ASP A 328
GLU A 539
ARG A 555
ARG A 615
TYR A 655
 SIA  A1692 (-2.7A)
SIA  A1692 (-4.5A)
SIA  A1692 (-2.9A)
SIA  A1692 ( 3.9A)
SIA  A1692 (-2.9A)
SIA  A1692 (-3.1A)
SIA  A1692 (-4.2A)
 0.67A 6ekuA-2bf6A:
44.2		 6ekuA-2bf6A:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f28 SIALIDASE 2

(Homo sapiens) 		PF13088
(BNR_2) 		7 ARG A  21
ILE A  22
GLU A  39
GLU A 218
ARG A 237
ARG A 304
TYR A 334
 None
 0.44A 6ekuA-2f28A:
39.8		 6ekuA-2f28A:
19.74
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.
2htv NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 None
 0.47A 6ekuA-2htvA:
20.9		 6ekuA-2htvA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iyo 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING

(Lactococcus
lactis) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 ARG A 401
ILE A 398
GLU A 227
ARG A 324
TYR A 402
 None
 1.32A 6ekuA-2iyoA:
undetectable		 6ekuA-2iyoA:
22.02
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.
2jir PERIPLASMIC NITRATE
REDUCTASE

(Desulfovibrio
desulfuricans) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 ILE A 715
GLU A 712
ARG A 313
ARG A 221
TYR A 612
 None
None
MGD  A 812 (-3.7A)
None
None
 1.40A 6ekuA-2jirA:
undetectable		 6ekuA-2jirA:
22.54
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.
2w20 SIALIDASE A

(Streptococcus
pneumoniae) 		PF13088
(BNR_2) 		7 ARG A 347
ILE A 348
ARG A 366
GLU A 647
ARG A 663
ARG A 721
TYR A 752
 None
 0.45A 6ekuA-2w20A:
40.3		 6ekuA-2w20A:
22.83
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.
2w20 SIALIDASE A

(Streptococcus
pneumoniae) 		PF13088
(BNR_2) 		7 ARG A 347
ILE A 348
ASP A 417
GLU A 647
ARG A 663
ARG A 721
TYR A 752
 None
 0.72A 6ekuA-2w20A:
40.3		 6ekuA-2w20A:
22.83
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.
2xzi EXTRACELLULAR
SIALIDASE/NEURAMINID
ASE, PUTATIVE

(Aspergillus
fumigatus) 		PF13088
(BNR_2) 		8 ARG A  59
ILE A  60
GLU A  76
ARG A  78
GLU A 249
ARG A 265
ARG A 322
TYR A 358
 KDM  A 500 (-2.7A)
None
KDM  A 500 ( 4.7A)
KDM  A 500 (-3.5A)
KDM  A 500 (-3.6A)
KDM  A 500 (-2.7A)
KDM  A 500 ( 3.0A)
KDM  A 500 (-4.5A)
 0.39A 6ekuA-2xziA:
36.8		 6ekuA-2xziA:
19.40
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.
2y0h PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 ARG A 365
ILE A 367
GLU A 379
ARG A 381
ARG A 323
 None
 1.33A 6ekuA-2y0hA:
undetectable		 6ekuA-2y0hA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ckz NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 ZMR  A 469 (-2.9A)
ZMR  A 469 (-3.7A)
ZMR  A 469 (-3.0A)
ZMR  A 469 (-2.9A)
ZMR  A 469 (-4.7A)
 0.31A 6ekuA-3ckzA:
11.7		 6ekuA-3ckzA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nzt GLUTAMATE--CYSTEINE
LIGASE

(Francisella
tularensis) 		PF04262
(Glu_cys_ligase) 		5 ILE A 276
GLU A 277
ARG A 295
GLU A 279
ARG A 125
 None
 1.25A 6ekuA-3nztA:
undetectable		 6ekuA-3nztA:
20.80
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.
3sil SIALIDASE

(Salmonella
enterica) 		PF13859
(BNR_3) 		7 ARG A  37
ILE A  38
ARG A  56
GLU A 231
ARG A 246
ARG A 309
TYR A 342
 PO4  A 499 (-2.7A)
None
None
GOL  A 402 (-3.3A)
PO4  A 499 (-2.7A)
PO4  A 499 (-3.0A)
PO4  A 499 (-4.6A)
 0.46A 6ekuA-3silA:
36.6		 6ekuA-3silA:
19.90
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.
3sil SIALIDASE

(Salmonella
enterica) 		PF13859
(BNR_3) 		6 ILE A  38
ASP A 100
GLU A 231
ARG A 246
ARG A 309
TYR A 342
 None
GOL  A 403 (-3.4A)
GOL  A 402 (-3.3A)
PO4  A 499 (-2.7A)
PO4  A 499 (-3.0A)
PO4  A 499 (-4.6A)
 0.74A 6ekuA-3silA:
36.6		 6ekuA-3silA:
19.90
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.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 ARG A 120
ILE A 117
ASN A  23
ARG A 397
ASP A  49
 EPZ  A 501 (-4.1A)
QPA  A 115 ( 4.4A)
EPZ  A 501 (-3.1A)
QPA  A 115 ( 2.9A)
None
 1.28A 6ekuA-3swdA:
undetectable		 6ekuA-3swdA:
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.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 ARG A 120
ILE A 117
ASP A 369
ASN A  23
ASP A  49
 EPZ  A 501 (-4.1A)
QPA  A 115 ( 4.4A)
None
EPZ  A 501 (-3.1A)
None
 1.28A 6ekuA-3swdA:
undetectable		 6ekuA-3swdA:
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.
3swe UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Haemophilus
influenzae) 		PF00275
(EPSP_synthase) 		5 ARG A 122
ILE A 119
ASN A  23
ARG A 399
ASP A  49
 EPZ  A 508 (-3.9A)
QPA  A 117 ( 4.4A)
EPZ  A 508 (-3.1A)
QPA  A 117 (-3.1A)
None
 1.27A 6ekuA-3sweA:
undetectable		 6ekuA-3sweA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3swe UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Haemophilus
influenzae) 		PF00275
(EPSP_synthase) 		5 ARG A 122
ILE A 119
ASP A 371
ASN A  23
ASP A  49
 EPZ  A 508 (-3.9A)
QPA  A 117 ( 4.4A)
None
EPZ  A 508 (-3.1A)
None
 1.37A 6ekuA-3sweA:
undetectable		 6ekuA-3sweA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ti8 NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 LNV  A 901 (-3.0A)
LNV  A 901 ( 3.8A)
LNV  A 901 (-2.8A)
LNV  A 901 (-2.9A)
LNV  A 901 (-4.8A)
 0.33A 6ekuA-3ti8A:
12.2		 6ekuA-3ti8A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tia NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 LNV  A 801 (-2.8A)
LNV  A 801 (-3.8A)
LNV  A 801 (-3.0A)
LNV  A 801 (-2.9A)
LNV  A 801 (-4.4A)
 0.34A 6ekuA-3tiaA:
5.7		 6ekuA-3tiaA:
20.91
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.
3vcy UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Aliivibrio
fischeri) 		PF00275
(EPSP_synthase) 		5 ARG A 121
ILE A 118
ASN A  24
ARG A 398
ASP A  50
 PO4  A 502 (-3.0A)
None
UD1  A 501 (-3.3A)
FFQ  A 500 ( 3.0A)
None
 1.31A 6ekuA-3vcyA:
undetectable		 6ekuA-3vcyA:
19.74
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.
3w0l GLUCOKINASE
REGULATORY PROTEIN

(Xenopus laevis) 		no annotation 5 GLU B 347
PRO B 350
ASN B 510
GLU B 153
ASP B 154
 F6R  B 701 (-3.2A)
None
None
F6R  B 701 (-3.8A)
None
 1.31A 6ekuA-3w0lB:
undetectable		 6ekuA-3w0lB:
22.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b7j NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 278
ARG A 293
ARG A 368
TYR A 402
 G39  A1470 (-3.1A)
G39  A1470 (-4.2A)
G39  A1470 (-2.9A)
G39  A1470 (-3.0A)
G39  A1470 (-4.5A)
 0.33A 6ekuA-4b7jA:
12.0		 6ekuA-4b7jA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bbw SIALIDASE
(NEURAMINIDASE)

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2)
PF14873
(BNR_assoc_N) 		7 ARG A 204
ILE A 205
ARG A 223
GLU A 399
ARG A 415
ARG A 479
TYR A 510
 None
 0.49A 6ekuA-4bbwA:
43.0		 6ekuA-4bbwA:
23.37
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.
4bbw SIALIDASE
(NEURAMINIDASE)

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2)
PF14873
(BNR_assoc_N) 		7 ARG A 204
ILE A 205
ASP A 272
GLU A 399
ARG A 415
ARG A 479
TYR A 510
 None
 0.74A 6ekuA-4bbwA:
43.0		 6ekuA-4bbwA:
23.37
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.
4cpn NEURAMINIDASE

(Influenza B
virus) 		PF00064
(Neur) 		5 ARG A 115
GLU A 275
ARG A 291
ARG A 373
TYR A 408
 ZMR  A 700 (-2.9A)
ZMR  A 700 (-3.4A)
ZMR  A 700 (-2.8A)
ZMR  A 700 (-3.0A)
ZMR  A 700 (-4.6A)
 0.37A 6ekuA-4cpnA:
14.0		 6ekuA-4cpnA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fj6 GLYCOSIDE HYDROLASE
FAMILY 33, CANDIDATE
SIALIDASE

(Parabacteroides
distasonis) 		PF13859
(BNR_3)
PF14873
(BNR_assoc_N) 		7 ARG A 200
ILE A 201
ARG A 219
GLU A 395
ARG A 411
ARG A 475
TYR A 506
 PO4  A 607 ( 2.6A)
None
GOL  A 604 ( 4.7A)
PO4  A 607 ( 4.8A)
PO4  A 607 (-2.7A)
PO4  A 607 (-2.8A)
PO4  A 607 (-4.6A)
 0.33A 6ekuA-4fj6A:
43.0		 6ekuA-4fj6A:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fj6 GLYCOSIDE HYDROLASE
FAMILY 33, CANDIDATE
SIALIDASE

(Parabacteroides
distasonis) 		PF13859
(BNR_3)
PF14873
(BNR_assoc_N) 		7 ARG A 200
ILE A 201
ASP A 268
GLU A 395
ARG A 411
ARG A 475
TYR A 506
 PO4  A 607 ( 2.6A)
None
None
PO4  A 607 ( 4.8A)
PO4  A 607 (-2.7A)
PO4  A 607 (-2.8A)
PO4  A 607 (-4.6A)
 0.72A 6ekuA-4fj6A:
43.0		 6ekuA-4fj6A:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fzh HEMAGGLUTININ-NEURAM
INIDASE

(Avian
avulavirus 1) 		PF00423
(HN) 		6 ARG A 174
ILE A 175
GLU A 401
ARG A 416
ARG A 498
TYR A 526
 None
 0.91A 6ekuA-4fzhA:
24.5		 6ekuA-4fzhA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hzz NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 G39  A 509 (-3.0A)
G39  A 509 ( 4.0A)
G39  A 509 (-2.8A)
G39  A 509 (-2.9A)
G39  A 509 (-4.6A)
 0.33A 6ekuA-4hzzA:
11.7		 6ekuA-4hzzA:
19.47
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.
4jf7 HEMAGGLUTININ-NEURAM
INIDASE

(Mammalian
rubulavirus 5) 		no annotation 6 ARG D 163
ILE D 164
GLU D 390
ARG D 405
ARG D 495
TYR D 523
 SO4  D 608 ( 4.1A)
None
None
SO4  D 608 (-2.6A)
SO4  D 608 (-3.3A)
None
 0.68A 6ekuA-4jf7D:
24.1		 6ekuA-4jf7D:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mju NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 27S  A 501 (-3.0A)
27S  A 501 (-3.4A)
27S  A 501 (-3.1A)
27S  A 501 (-3.1A)
27S  A 501 (-4.6A)
 0.40A 6ekuA-4mjuA:
12.2		 6ekuA-4mjuA:
19.63
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.
4q6k BNR/ASP-BOX REPEAT
PROTEIN

(Bacteroides
caccae) 		PF13088
(BNR_2)
PF14873
(BNR_assoc_N) 		7 ARG A 220
ILE A 221
ARG A 239
GLU A 415
ARG A 431
ARG A 495
TYR A 526
 EDO  A 604 (-4.0A)
None
EDO  A 604 (-4.3A)
None
None
None
None
 0.29A 6ekuA-4q6kA:
43.4		 6ekuA-4q6kA:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q6k BNR/ASP-BOX REPEAT
PROTEIN

(Bacteroides
caccae) 		PF13088
(BNR_2)
PF14873
(BNR_assoc_N) 		7 ARG A 220
ILE A 221
ASP A 288
GLU A 415
ARG A 431
ARG A 495
TYR A 526
 EDO  A 604 (-4.0A)
None
EDO  A 607 (-3.1A)
None
None
None
None
 0.65A 6ekuA-4q6kA:
43.4		 6ekuA-4q6kA:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qn3 NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ARG A  36
GLU A 196
ARG A 211
ARG A 290
TYR A 324
 None
 0.39A 6ekuA-4qn3A:
11.9		 6ekuA-4qn3A:
19.56
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		7 ARG A 293
ILE A 294
ARG A 312
GLU A 595
ARG A 611
ARG A 673
TYR A 713
 CNP  A 760 (-3.0A)
CNP  A 760 (-4.5A)
CNP  A 760 (-3.6A)
CNP  A 760 ( 4.5A)
CNP  A 760 (-3.0A)
CNP  A 760 (-3.0A)
CNP  A 760 (-4.0A)
 0.58A 6ekuA-4sliA:
39.7		 6ekuA-4sliA:
25.18
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		6 ILE A 294
ASP A 375
GLU A 595
ARG A 611
ARG A 673
TYR A 713
 CNP  A 760 (-4.5A)
CNP  A 760 (-2.8A)
CNP  A 760 ( 4.5A)
CNP  A 760 (-3.0A)
CNP  A 760 (-3.0A)
CNP  A 760 (-4.0A)
 0.77A 6ekuA-4sliA:
39.7		 6ekuA-4sliA:
25.18
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.
4uxi THYMIDINE KINASE

(Leishmania
major) 		PF00265
(TK) 		5 ARG A  27
GLU A  20
ARG A  23
GLU A   7
ARG A   5
 None
 1.20A 6ekuA-4uxiA:
undetectable		 6ekuA-4uxiA:
12.38
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.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		7 ARG A 257
ILE A 258
ARG A 276
GLU A 559
ARG A 575
ARG A 637
TYR A 677
 3XR  A 802 (-3.0A)
None
3XR  A 802 (-3.4A)
3XR  A 802 ( 4.7A)
3XR  A 802 (-2.6A)
3XR  A 802 (-3.0A)
3XR  A 802 (-4.2A)
 0.44A 6ekuA-4x6kA:
35.2		 6ekuA-4x6kA:
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.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		5 ILE A 258
ASP A 339
GLU A 559
ARG A 575
TYR A 677
 None
3XR  A 802 (-2.8A)
3XR  A 802 ( 4.7A)
3XR  A 802 (-2.6A)
3XR  A 802 (-4.2A)
 0.82A 6ekuA-4x6kA:
35.2		 6ekuA-4x6kA:
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		7 ARG A 245
ILE A 246
ARG A 264
GLU A 541
ARG A 557
ARG A 619
TYR A 653
 NHE  A 702 (-2.7A)
None
None
None
NHE  A 702 (-2.8A)
NHE  A 702 (-2.9A)
NHE  A 702 (-4.8A)
 0.43A 6ekuA-4xhbA:
21.0		 6ekuA-4xhbA:
24.44
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		7 ARG A 245
ILE A 246
ASP A 327
GLU A 541
ARG A 557
ARG A 619
TYR A 653
 NHE  A 702 (-2.7A)
None
NHE  A 702 (-3.6A)
None
NHE  A 702 (-2.8A)
NHE  A 702 (-2.9A)
NHE  A 702 (-4.8A)
 0.69A 6ekuA-4xhbA:
21.0		 6ekuA-4xhbA:
24.44
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.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		7 ARG A 290
ILE A 291
ARG A 309
GLU A 584
ARG A 600
ARG A 662
TYR A 695
 G39  A 801 (-2.6A)
None
G39  A 801 (-4.3A)
G39  A 801 ( 4.7A)
G39  A 801 (-2.9A)
G39  A 801 (-2.9A)
G39  A 801 (-4.4A)
 0.48A 6ekuA-4yw5A:
37.1		 6ekuA-4yw5A:
25.52
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.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		6 ILE A 291
ASP A 372
GLU A 584
ARG A 600
ARG A 662
TYR A 695
 None
G39  A 801 (-2.6A)
G39  A 801 ( 4.7A)
G39  A 801 (-2.9A)
G39  A 801 (-2.9A)
G39  A 801 (-4.4A)
 0.74A 6ekuA-4yw5A:
37.1		 6ekuA-4yw5A:
25.52
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.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		6 ARG A 180
ILE A 181
GLU A 407
ARG A 422
ARG A 512
TYR A 540
 SLT  A 606 (-2.6A)
None
SLT  A 606 (-3.8A)
SLT  A 606 (-3.0A)
SLT  A 606 (-2.8A)
SLT  A 606 (-4.7A)
 0.53A 6ekuA-5b2dA:
24.6		 6ekuA-5b2dA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bq2 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Pseudomonas
aeruginosa) 		PF00275
(EPSP_synthase) 		5 ARG A 122
ILE A 119
ASN A  23
ARG A 400
ASP A  49
 EPU  A 501 (-3.9A)
QPA  A 117 ( 3.9A)
EPU  A 501 (-3.1A)
QPA  A 117 ( 3.0A)
None
 1.34A 6ekuA-5bq2A:
undetectable		 6ekuA-5bq2A:
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.
5fux THYMDINE KINASE

(Trypanosoma
brucei) 		PF00265
(TK) 		5 ARG A 228
GLU A 221
ARG A 224
GLU A 208
ARG A 206
 None
 1.09A 6ekuA-5fuxA:
undetectable		 6ekuA-5fuxA:
14.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ol2 ELECTRON TRANSFER
FLAVOPROTEIN LARGE
SUBUNIT
ELECTRON TRANSFER
FLAVOPROTEIN SMALL
SUBUNIT

(Clostridioides
difficile) 		no annotation 5 ARG A 265
GLU B  20
ASP B  17
ASN A 142
ASP B 128
 None
 1.25A 6ekuA-5ol2A:
undetectable		 6ekuA-5ol2A:
18.37
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		5 ILE C2933
ARG C2922
PRO C2918
ASP C2937
ARG C3901
 None
 1.19A 6ekuA-5y3rC:
undetectable		 6ekuA-5y3rC:
10.75
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.
6br6 NEURAMINIDASE

(Influenza A
virus) 		no annotation 5 ARG A 118
GLU A 277
ARG A 292
ARG A 371
TYR A 406
 E3M  A 511 (-3.0A)
E3M  A 511 ( 3.6A)
E3M  A 511 (-2.9A)
E3M  A 511 (-2.9A)
E3M  A 511 (-4.5A)
 0.29A 6ekuA-6br6A:
21.0		 6ekuA-6br6A:
7.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6eks SIALIDASE

(Vibrio cholerae) 		no annotation 12 ARG A 250
ILE A 251
GLU A 269
ARG A 271
PRO A 277
ASP A 318
ASN A 344
GLU A 645
ARG A 661
ASP A 663
ARG A 738
TYR A 766
 G39  A 908 (-2.8A)
G39  A 908 (-4.7A)
G39  A 908 ( 4.7A)
G39  A 908 (-4.2A)
G39  A 908 ( 4.4A)
G39  A 908 ( 4.2A)
G39  A 908 (-3.5A)
G39  A 908 (-4.0A)
G39  A 908 (-2.8A)
G39  A 908 (-3.8A)
G39  A 908 (-3.0A)
G39  A 908 (-4.6A)
 0.30A 6ekuA-6eksA:
71.0		 6ekuA-6eksA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6exv DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Sus scrofa) 		no annotation 5 ARG B 157
ASN B 739
GLU B 191
ASP B 745
TYR B 184
 None
 1.18A 6ekuA-6exvB:
undetectable		 6ekuA-6exvB:
6.67
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.
6f42 DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC2

(Saccharomyces
cerevisiae) 		no annotation 5 ILE B 186
ASN B 716
GLU B 191
ARG B 460
TYR B 184
 None
 1.47A 6ekuA-6f42B:
undetectable		 6ekuA-6f42B:
6.92
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.
1a44 PHOSPHATIDYLETHANOLA
MINE-BINDING PROTEIN

(Bos taurus) 		PF01161
(PBP) 		4 ASP A 133
LEU A  87
SER A 103
PHE A 148
 None
 1.15A 6ekuA-1a44A:
0.0		 6ekuA-1a44A:
12.57
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.
1b97 RESTRICTION
ENDONUCLEASE ECORV

(Escherichia
coli) 		PF09233
(Endonuc-EcoRV) 		4 ASP A  90
ASN A 188
SER A 112
PHE A 125
 None
 1.15A 6ekuA-1b97A:
0.0		 6ekuA-1b97A:
16.31
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.
1bw0 PROTEIN (TYROSINE
AMINOTRANSFERASE)

(Trypanosoma
cruzi) 		PF00155
(Aminotran_1_2) 		4 ASP A  24
LEU A 377
SER A  39
PHE A 365
 None
 1.09A 6ekuA-1bw0A:
0.0		 6ekuA-1bw0A:
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.
1cbg CYANOGENIC
BETA-GLUCOSIDASE

(Trifolium
repens) 		PF00232
(Glyco_hydro_1) 		4 ASP A 347
GLN A 345
LEU A 206
SER A 203
 None
 0.81A 6ekuA-1cbgA:
0.0		 6ekuA-1cbgA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		4 ASP A 138
ASN A 230
LEU A 226
PHE A 204
 None
 1.25A 6ekuA-1jnfA:
0.0		 6ekuA-1jnfA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kn3 PHOSPHATIDYLETHANOLA
MINE BINDING
PROTEIN-2

(Mus musculus) 		PF01161
(PBP) 		4 ASP A 134
LEU A  88
SER A 104
PHE A 149
 None
 1.16A 6ekuA-1kn3A:
0.0		 6ekuA-1kn3A:
13.59
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.
1lla HEMOCYANIN (SUBUNIT
TYPE II)

(Limulus
polyphemus) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 ASP A 350
ASN A  85
LEU A  16
SER A  17
 None
 1.05A 6ekuA-1llaA:
0.0		 6ekuA-1llaA:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lw3 MYOTUBULARIN-RELATED
PROTEIN 2

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		4 ASN A 545
LEU A 540
SER A 539
PHE A 520
 None
 1.10A 6ekuA-1lw3A:
0.0		 6ekuA-1lw3A:
20.85
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.
1ryo SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		4 ASP A 138
ASN A 230
LEU A 226
PHE A 204
 None
 1.10A 6ekuA-1ryoA:
0.0		 6ekuA-1ryoA:
17.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zb1 BRO1 PROTEIN

(Saccharomyces
cerevisiae) 		PF03097
(BRO1) 		4 ASP A  96
ASN A 123
LEU A 157
SER A 118
 None
 1.17A 6ekuA-1zb1A:
undetectable		 6ekuA-1zb1A:
20.22
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.
1zsq MYOTUBULARIN-RELATED
PROTEIN 2

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		4 ASN A 545
LEU A 540
SER A 539
PHE A 520
 None
 1.13A 6ekuA-1zsqA:
undetectable		 6ekuA-1zsqA:
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.
1zvf 3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE

(Saccharomyces
cerevisiae) 		PF06052
(3-HAO) 		4 ASP A 120
ASN A  94
LEU A  91
PHE A  57
 None
 1.20A 6ekuA-1zvfA:
undetectable		 6ekuA-1zvfA:
12.81
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.
2b2n TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		no annotation 4 ASP A 146
GLN A 144
LEU A 136
PHE A 184
 None
 1.27A 6ekuA-2b2nA:
undetectable		 6ekuA-2b2nA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dh3 4F2 CELL-SURFACE
ANTIGEN HEAVY CHAIN

(Homo sapiens) 		PF00128
(Alpha-amylase) 		4 ASP A 439
LEU A 488
SER A 487
PHE A 525
 ZN  A 601 (-2.2A)
None
None
None
 1.02A 6ekuA-2dh3A:
undetectable		 6ekuA-2dh3A:
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.
2erv HYPOTHETICAL PROTEIN
PAER03002360

(Pseudomonas
aeruginosa) 		PF09411
(PagL) 		4 ASP A 106
LEU A  98
SER A 100
PHE A  88
 CA  A 195 ( 2.5A)
None
None
None
 1.17A 6ekuA-2ervA:
undetectable		 6ekuA-2ervA:
12.83
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.
2fgy CARBOXYSOME SHELL
POLYPEPTIDE

(Halothiobacillus
neapolitanus) 		PF08936
(CsoSCA) 		4 ASP A 488
ASN A 478
LEU A 497
SER A 513
 None
 1.24A 6ekuA-2fgyA:
undetectable		 6ekuA-2fgyA:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fuv PHOSPHOGLUCOMUTASE

(Salmonella
enterica) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ASP A 306
ASN A 158
SER A 406
PHE A 211
 MG  A 901 (-2.1A)
None
None
None
 1.27A 6ekuA-2fuvA:
undetectable		 6ekuA-2fuvA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g9h EXTRACELLULAR
ENTEROTOXIN TYPE I

(Staphylococcus
aureus) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		4 GLN D 134
ASN D 143
SER D 159
PHE D 181
 None
 1.22A 6ekuA-2g9hD:
undetectable		 6ekuA-2g9hD:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ge5 TYPE II RESTRICTION
ENZYME ECORV

(Escherichia
coli) 		PF09233
(Endonuc-EcoRV) 		4 ASP A  90
ASN A 188
SER A 112
PHE A 125
 CA  A 283 (-2.9A)
None
None
None
 1.20A 6ekuA-2ge5A:
undetectable		 6ekuA-2ge5A:
14.62
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.
2i4n PROLINE-TRNA LIGASE

(Rhodopseudomonas
palustris) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		4 ASP A 308
LEU A 128
SER A 127
PHE A 118
 None
 0.99A 6ekuA-2i4nA:
undetectable		 6ekuA-2i4nA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iqx PHOSPHATIDYLETHANOLA
MINE-BINDING PROTEIN
1

(Rattus
norvegicus) 		PF01161
(PBP) 		4 ASP A 134
LEU A  88
SER A 104
PHE A 149
 None
 1.09A 6ekuA-2iqxA:
undetectable		 6ekuA-2iqxA:
13.74
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.
2j63 AP-ENDONUCLEASE

(Leishmania
major) 		PF03372
(Exo_endo_phos) 		4 ASP A 411
ASN A 274
LEU A 163
PHE A 154
 None
 1.03A 6ekuA-2j63A:
undetectable		 6ekuA-2j63A:
20.88
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.
2ntt STAPHYLOCOCCAL
ENTEROTOXIN K

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C) 		4 GLN A 134
ASN A 143
SER A 159
PHE A 181
 None
EDO  A7010 (-4.2A)
None
None
 1.25A 6ekuA-2nttA:
undetectable		 6ekuA-2nttA:
15.47
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.
2oz8 MLL7089 PROTEIN

(Mesorhizobium
japonicum) 		PF13378
(MR_MLE_C) 		4 ASP A  57
GLN A  12
ASN A  30
LEU A 367
 None
 1.27A 6ekuA-2oz8A:
undetectable		 6ekuA-2oz8A:
19.73
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.
2p12 HYPOTHETICAL PROTEIN
DUF402

(Rhodococcus
jostii) 		PF04167
(DUF402) 		4 ASN A  23
LEU A  57
SER A  49
PHE A  72
 None
None
ACY  A 601 (-2.5A)
GOL  A 603 (-4.0A)
 1.15A 6ekuA-2p12A:
undetectable		 6ekuA-2p12A:
12.91
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.
2paf LACTOSE OPERON
REPRESSOR

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		4 ASP A 274
ASN A 125
LEU A  71
SER A  70
 NPF  A 902 (-2.6A)
NPF  A 902 (-2.6A)
None
None
 1.11A 6ekuA-2pafA:
undetectable		 6ekuA-2pafA:
17.62
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.
2ph0 UNCHARACTERIZED
PROTEIN

(Pectobacterium
carotovorum) 		PF06228
(ChuX_HutX) 		4 ASP A  46
GLN A  50
LEU A 157
PHE A 110
 None
 0.93A 6ekuA-2ph0A:
2.0		 6ekuA-2ph0A:
14.74
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		4 GLN A1494
LEU A1493
SER A1489
PHE A1415
 None
 1.03A 6ekuA-2vz9A:
undetectable		 6ekuA-2vz9A:
14.56
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.
2ynp COATOMER SUBUNIT
BETA'

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF04053
(Coatomer_WDAD) 		4 ASP A 292
ASN A 267
LEU A 252
PHE A 233
 None
 1.02A 6ekuA-2ynpA:
8.5		 6ekuA-2ynpA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3buj CALO2

(Micromonospora
echinospora) 		PF00067
(p450) 		4 GLN A 241
ASN A 244
LEU A 274
PHE A 336
 None
None
None
HEM  A 398 (-4.8A)
 0.99A 6ekuA-3bujA:
undetectable		 6ekuA-3bujA:
19.53
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.
3fj4 MUCONATE
CYCLOISOMERASE

(Pseudomonas
protegens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLN A 157
LEU A 191
SER A 194
PHE A 168
 None
 1.21A 6ekuA-3fj4A:
undetectable		 6ekuA-3fj4A:
18.98
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.
3gre SERINE/THREONINE-PRO
TEIN KINASE VPS15

(Saccharomyces
cerevisiae) 		no annotation 4 ASN A1375
LEU A1377
SER A1380
PHE A1316
 None
 1.21A 6ekuA-3greA:
9.8		 6ekuA-3greA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3guw UNCHARACTERIZED
PROTEIN AF_1765

(Archaeoglobus
fulgidus) 		PF01026
(TatD_DNase) 		4 ASP A 167
ASN A 162
LEU A 178
PHE A 202
 None
 1.20A 6ekuA-3guwA:
undetectable		 6ekuA-3guwA:
15.34
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.
3gyr PHENOXAZINONE
SYNTHASE

(Streptomyces
antibioticus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASP A 339
GLN A 335
ASN A 570
LEU A 368
 None
None
GOL  A5001 (-2.9A)
None
 1.11A 6ekuA-3gyrA:
undetectable		 6ekuA-3gyrA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h77 PQS BIOSYNTHETIC
ENZYME

(Pseudomonas
aeruginosa) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 ASP A 161
LEU A 155
SER A 156
PHE A 218
 None
None
None
CSJ  A 112 ( 4.0A)
 1.19A 6ekuA-3h77A:
undetectable		 6ekuA-3h77A:
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.
3h9c METHIONYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF09334
(tRNA-synt_1g) 		4 ASP A  83
ASN A 348
LEU A 542
SER A 546
 None
 1.19A 6ekuA-3h9cA:
undetectable		 6ekuA-3h9cA:
19.97
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.
3hdx SUSD SUPERFAMILY
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 GLN A 244
ASN A 246
LEU A 190
SER A 191
 None
 1.26A 6ekuA-3hdxA:
undetectable		 6ekuA-3hdxA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hvm AGMATINE DEIMINASE

(Helicobacter
pylori) 		PF04371
(PAD_porph) 		4 ASP A 245
GLN A 185
LEU A 187
PHE A 209
 None
 1.20A 6ekuA-3hvmA:
undetectable		 6ekuA-3hvmA:
17.11
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.
3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Escherichia
coli) 		PF04561
(RNA_pol_Rpb2_2) 		4 ASP A 427
ASN A 406
LEU A 397
SER A 417
 None
 1.12A 6ekuA-3ltiA:
undetectable		 6ekuA-3ltiA:
18.29
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.
3lzk FUMARYLACETOACETATE
HYDROLASE FAMILY
PROTEIN

(Sinorhizobium
meliloti) 		PF01557
(FAA_hydrolase) 		4 ASP A  83
ASN A 169
LEU A 219
SER A 285
 CA  A 339 (-3.0A)
None
None
None
 1.27A 6ekuA-3lzkA:
0.9		 6ekuA-3lzkA:
18.83
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.
3mkq COATOMER
BETA'-SUBUNIT

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF04053
(Coatomer_WDAD) 		4 ASP A 292
ASN A 267
LEU A 252
PHE A 233
 None
 1.03A 6ekuA-3mkqA:
4.0		 6ekuA-3mkqA:
24.08
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.
3pdi NITROGENASE MOFE
COFACTOR
BIOSYNTHESIS PROTEIN
NIFN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		4 ASP B 184
LEU B 247
SER B 246
PHE B 146
 None
 1.14A 6ekuA-3pdiB:
undetectable		 6ekuA-3pdiB:
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.
3qqz PUTATIVE
UNCHARACTERIZED
PROTEIN YJIK

(Escherichia
coli) 		PF06977
(SdiA-regulated) 		4 ASN A 290
LEU A 287
SER A 284
PHE A 317
 None
 1.21A 6ekuA-3qqzA:
8.9		 6ekuA-3qqzA:
16.64
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.
3qvf FOMA PROTEIN

(Streptomyces
wedmorensis) 		PF00696
(AA_kinase) 		4 ASP A 173
LEU A 241
SER A 239
PHE A 243
 None
 1.20A 6ekuA-3qvfA:
undetectable		 6ekuA-3qvfA:
17.15
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.
3v44 TOLL-LIKE RECEPTOR
5B AND VARIABLE
LYMPHOCYTE RECEPTOR
B.61 CHIMERIC
PROTEIN

(Danio rerio;
Eptatretus
burgeri) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 ASP A 348
ASN A 326
LEU A 307
PHE A 336
 None
 1.20A 6ekuA-3v44A:
undetectable		 6ekuA-3v44A:
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.
3zri CLPB PROTEIN

(Vibrio cholerae) 		PF02861
(Clp_N) 		4 ASP A  43
LEU A 128
SER A 129
PHE A 136
 None
 1.08A 6ekuA-3zriA:
undetectable		 6ekuA-3zriA:
13.10
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.
4buc UDP-N-ACETYLMURAMOYL
ALANINE--D-GLUTAMATE
LIGASE

(Thermotoga
maritima) 		PF08245
(Mur_ligase_M) 		4 ASP A 131
ASN A 231
LEU A 237
PHE A 208
 None
PO4  A1002 (-3.1A)
None
None
 1.11A 6ekuA-4bucA:
undetectable		 6ekuA-4bucA:
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.
4e37 CATALASE

(Pseudomonas
aeruginosa) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 ASP A 164
GLN A 458
LEU A 176
SER A 172
 None
 1.26A 6ekuA-4e37A:
undetectable		 6ekuA-4e37A:
19.97
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.
4e5v PUTATIVE THUA-LIKE
PROTEIN

(Parabacteroides
merdae) 		PF06283
(ThuA) 		4 ASP A 119
LEU A  48
SER A  44
PHE A 265
 None
 1.21A 6ekuA-4e5vA:
undetectable		 6ekuA-4e5vA:
16.88
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.
4ecn LEUCINE-RICH REPEAT
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF14660
(DUF4458) 		4 ASP A 448
GLN A 424
ASN A 427
SER A 655
 None
 1.24A 6ekuA-4ecnA:
undetectable		 6ekuA-4ecnA:
23.14
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.
4efc ADENYLOSUCCINATE
LYASE

(Trypanosoma
brucei) 		PF00206
(Lyase_1)
PF08328
(ASL_C) 		4 ASP A  76
GLN A  78
LEU A 125
PHE A  58
 None
 1.26A 6ekuA-4efcA:
undetectable		 6ekuA-4efcA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eo9 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Mycobacterium
leprae) 		PF00300
(His_Phos_1) 		4 ASP A 173
LEU A  90
SER A  87
PHE A 162
 None
 1.05A 6ekuA-4eo9A:
undetectable		 6ekuA-4eo9A:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4evi CONIFERYL ALCOHOL
9-O-METHYLTRANSFERAS
E

(Linum
nodiflorum) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 ASP A 272
LEU A 127
SER A 122
PHE A 171
 C9M  A 402 ( 2.3A)
None
C9M  A 402 (-2.6A)
None
 1.09A 6ekuA-4eviA:
undetectable		 6ekuA-4eviA:
19.16
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.
4fmv GLUCURONOARABINOXYLA
N
ENDO-1,4-BETA-XYLANA
SE

([Clostridium]
papyrosolvens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		4 GLN A  14
ASN A 258
SER A 253
PHE A  19
 None
 0.91A 6ekuA-4fmvA:
undetectable		 6ekuA-4fmvA:
18.98
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.
4fo0 ACTIN-RELATED
PROTEIN 8

(Homo sapiens) 		PF00022
(Actin) 		4 ASP A 520
ASN A 302
LEU A 408
PHE A 504
 None
 1.11A 6ekuA-4fo0A:
undetectable		 6ekuA-4fo0A:
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.
4ihq FLAI ATPASE

(Sulfolobus
acidocaldarius) 		PF00437
(T2SSE) 		4 ASN A 273
LEU A 234
SER A 230
PHE A 237
 None
ADP  A 601 (-4.5A)
None
ADP  A 601 (-4.7A)
 1.19A 6ekuA-4ihqA:
undetectable		 6ekuA-4ihqA:
20.23
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.
4inq OXYSTEROL-BINDING
PROTEIN HOMOLOG 3

(Saccharomyces
cerevisiae) 		PF01237
(Oxysterol_BP) 		4 GLN A 799
ASN A 780
LEU A 784
PHE A 700
 None
PIF  A1001 (-3.7A)
None
None
 1.26A 6ekuA-4inqA:
undetectable		 6ekuA-4inqA:
19.56
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.
4iug BETA-GALACTOSIDASE A

(Aspergillus
oryzae) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 ASP A 803
GLN A 153
ASN A 705
SER A 718
 CD  A1103 (-2.3A)
None
None
None
 0.93A 6ekuA-4iugA:
undetectable		 6ekuA-4iugA:
23.14
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.
4j73 COATOMER SUBUNIT
BETA'

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 ASP A 292
ASN A 267
LEU A 252
PHE A 233
 None
 0.99A 6ekuA-4j73A:
5.6		 6ekuA-4j73A:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l52 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 7,
TGF-BETA-ACTIVATED
KINASE 1 AND
MAP3K7-BINDING
PROTEIN 1 CHIMERA

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 GLN A 139
ASN A  88
LEU A 135
SER A 132
 None
 1.15A 6ekuA-4l52A:
undetectable		 6ekuA-4l52A:
15.18
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.
4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		4 ASP D 377
GLN D 219
ASN D 223
SER D 235
 None
 1.26A 6ekuA-4ngeD:
undetectable		 6ekuA-4ngeD:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o3m BLOOM SYNDROME
PROTEIN

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF00570
(HRDC)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind) 		4 GLN A 838
LEU A 688
SER A 854
PHE A 686
 None
 1.15A 6ekuA-4o3mA:
undetectable		 6ekuA-4o3mA:
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.
4o5p UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF09994
(DUF2235) 		4 ASP A 379
GLN A 389
LEU A 573
PHE A 495
 None
 1.25A 6ekuA-4o5pA:
undetectable		 6ekuA-4o5pA:
20.43
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.
4pbv NT-3 GROWTH FACTOR
RECEPTOR

(Gallus gallus) 		PF00047
(ig)
PF13855
(LRR_8)
PF16920
(TPKR_C2) 		4 ASP A 133
GLN A 185
LEU A 187
PHE A 162
 None
 1.26A 6ekuA-4pbvA:
undetectable		 6ekuA-4pbvA:
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.
4qam X-LINKED RETINITIS
PIGMENTOSA GTPASE
REGULATOR-INTERACTIN
G PROTEIN 1

(Homo sapiens) 		no annotation 4 ASP B1242
GLN B1246
LEU B1248
PHE B1209
 None
 1.06A 6ekuA-4qamB:
undetectable		 6ekuA-4qamB:
14.90
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.
4qtb MITOGEN-ACTIVATED
PROTEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		4 GLN A 136
LEU A 138
SER A 139
PHE A 146
 None
 0.91A 6ekuA-4qtbA:
2.0		 6ekuA-4qtbA:
19.16
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.
4rgg PUTATIVE PHAGE
STRUCTURAL PROTEIN

(Lactococcus
phage 1358) 		no annotation 4 ASP A 133
ASN A 170
LEU A  57
SER A  30
 None
 1.27A 6ekuA-4rggA:
undetectable		 6ekuA-4rggA:
20.93
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.
4rl3 CHITINASE A

(Pteris
ryukyuensis) 		PF00704
(Glyco_hydro_18) 		4 GLN A 388
LEU A 353
SER A 350
PHE A 340
 None
 1.02A 6ekuA-4rl3A:
undetectable		 6ekuA-4rl3A:
18.80
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.
4rt6 HEME/HEMOPEXIN-BINDI
NG PROTEIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		4 ASP A 309
ASN A 364
LEU A 321
SER A 389
 None
 1.18A 6ekuA-4rt6A:
undetectable		 6ekuA-4rt6A:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rv1 ENGINEERED PROTEIN
OR497

(synthetic
construct) 		PF00514
(Arm) 		4 ASP A  15
GLN A  19
LEU A  52
SER A  55
 None
 1.25A 6ekuA-4rv1A:
undetectable		 6ekuA-4rv1A:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uad IMPORTIN SUBUNIT
ALPHA-7

(Homo sapiens) 		PF00514
(Arm)
PF16186
(Arm_3) 		4 ASP A 182
GLN A 184
LEU A 217
SER A 221
 None
 0.84A 6ekuA-4uadA:
undetectable		 6ekuA-4uadA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ut1 FLAGELLAR
HOOK-ASSOCIATED
PROTEIN

(Burkholderia
pseudomallei) 		PF06429
(Flg_bbr_C) 		4 GLN A  95
LEU A 155
SER A 158
PHE A 289
 None
 1.25A 6ekuA-4ut1A:
undetectable		 6ekuA-4ut1A:
22.87
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.
4wl2 PUTATIVE EXPORTED
CHOLOYLGLYCINE
HYDROLASE

(Pectobacterium
atrosepticum) 		PF02275
(CBAH) 		4 ASP A 116
LEU A 128
SER A 127
PHE A 133
 None
 1.16A 6ekuA-4wl2A:
undetectable		 6ekuA-4wl2A:
19.47
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.
4wu0 SIMILAR TO YTER
(BACILUS SUBTILIS)

(Clostridium
acetobutylicum) 		PF07470
(Glyco_hydro_88) 		4 ASP A  21
ASN A  79
LEU A  31
PHE A  49
 None
 1.25A 6ekuA-4wu0A:
undetectable		 6ekuA-4wu0A:
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.
4x33 PROTEIN ATS1

(Saccharomyces
cerevisiae) 		PF00415
(RCC1) 		4 ASP B 260
ASN B 288
LEU B 275
PHE B 254
 None
 0.92A 6ekuA-4x33B:
9.3		 6ekuA-4x33B:
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.
4zfm PUTATIVE
6-PHOSPHO-BETA-GALAC
TOBIOSIDASE

(Geobacillus
stearothermophilus) 		PF00232
(Glyco_hydro_1) 		4 ASP A 126
GLN A  23
LEU A 430
SER A  19
 None
BG6  A 501 (-3.1A)
None
None
 1.22A 6ekuA-4zfmA:
undetectable		 6ekuA-4zfmA:
21.97
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		4 ASP A1154
ASN A1192
LEU A1176
PHE A1175
 None
 1.08A 6ekuA-5a31A:
8.4		 6ekuA-5a31A:
19.94
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.
5c16 MYOTUBULARIN-RELATED
PROTEIN 1

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		4 ASN A 566
LEU A 561
SER A 560
PHE A 541
 None
 1.18A 6ekuA-5c16A:
undetectable		 6ekuA-5c16A:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cov NAEGLERIA GRUBERI
RNA LIGASE

(Naegleria
gruberi) 		PF09414
(RNA_ligase) 		4 GLN A 202
ASN A 200
LEU A 130
SER A 131
 None
 1.25A 6ekuA-5covA:
undetectable		 6ekuA-5covA:
20.40
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.
5dlq EXPORTIN-4

(Mus musculus) 		no annotation 4 GLN B 907
LEU B 970
SER B 967
PHE B 973
 None
 1.27A 6ekuA-5dlqB:
undetectable		 6ekuA-5dlqB:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ex1 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
CYCLOPHILIN TYPE

(Hirschia
baltica) 		PF00160
(Pro_isomerase) 		4 GLN A  64
ASN A  36
LEU A 222
SER A 224
 None
 1.26A 6ekuA-5ex1A:
undetectable		 6ekuA-5ex1A:
17.22
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.
5fp2 FERRIC ENTEROBACTIN
RECEPTOR PIRA

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 ASP A 315
ASN A 373
LEU A 350
SER A 351
 None
 1.13A 6ekuA-5fp2A:
undetectable		 6ekuA-5fp2A:
23.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gu5 TRANSMEMBRANE EMP24
DOMAIN-CONTAINING
PROTEIN 5

(Mus musculus) 		PF01105
(EMP24_GP25L) 		4 GLN A  50
LEU A 124
SER A  34
PHE A 122
 None
 1.19A 6ekuA-5gu5A:
undetectable		 6ekuA-5gu5A:
8.81
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.
5ir3 IG LAMBDA CHAIN V-VI
REGION AR

(Homo sapiens) 		PF07686
(V-set) 		4 ASP A  69
LEU A   4
SER A  93
PHE A   2
 None
 1.26A 6ekuA-5ir3A:
undetectable		 6ekuA-5ir3A:
10.50
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.
5irm UNCHARACTERIZED
PROTEIN

(Oryctolagus
cuniculus) 		PF05729
(NACHT)
PF13516
(LRR_6) 		4 ASP A 359
GLN A 290
LEU A 217
SER A 218
 None
 1.13A 6ekuA-5irmA:
undetectable		 6ekuA-5irmA:
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.
5it9 RIBOSOMAL PROTEIN
ES24

(Kluyveromyces
lactis) 		PF01282
(Ribosomal_S24e) 		4 GLN Y  22
ASN Y  15
LEU Y  74
PHE Y  58
 None
 0.90A 6ekuA-5it9Y:
undetectable		 6ekuA-5it9Y:
11.81
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.
5jp3 XANTHOMONAS OUTER
PROTEIN D

(Xanthomonas
euvesicatoria) 		PF02902
(Peptidase_C48) 		4 ASP A 491
ASN A 360
LEU A 364
PHE A 400
 None
 1.00A 6ekuA-5jp3A:
undetectable		 6ekuA-5jp3A:
14.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5liy ALDO-KETO REDUCTASE
FAMILY 1 MEMBER B10

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		4 ASP X  99
GLN X  50
LEU X 122
PHE X  83
 MLY  X  95 ( 2.7A)
None
None
None
 1.26A 6ekuA-5liyX:
undetectable		 6ekuA-5liyX:
18.50
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.
5mvo FOXE

(Rhodobacter sp.
SW2) 		no annotation 4 ASP A 239
GLN A 246
LEU A  32
SER A  28
 None
 1.26A 6ekuA-5mvoA:
undetectable		 6ekuA-5mvoA:
8.27
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.
5n1t FLAVIN-BINDING
SUBUNIT OF SULFIDE
DEHYDROGENASE

(Thioalkalivibrio
paradoxus) 		no annotation 4 ASP A 354
GLN A 306
ASN A 304
LEU A 382
 None
 1.25A 6ekuA-5n1tA:
undetectable		 6ekuA-5n1tA:
8.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n4w CULLIN-2

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		4 ASP A 675
GLN A 432
LEU A 473
SER A 471
 None
 1.10A 6ekuA-5n4wA:
undetectable		 6ekuA-5n4wA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n7f MEMBRANE-ASSOCIATED
GUANYLATE KINASE, WW
AND PDZ
DOMAIN-CONTAINING
PROTEIN 1,ANNEXIN A2

(Homo sapiens) 		no annotation 4 ASP A 815
GLN A 800
ASN A 797
LEU A 780
 None
 1.13A 6ekuA-5n7fA:
undetectable		 6ekuA-5n7fA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oas MALATE SYNTHASE G

(Pseudomonas
aeruginosa) 		no annotation 4 ASP A 557
GLN A 562
ASN A 536
LEU A 499
 None
 1.21A 6ekuA-5oasA:
undetectable		 6ekuA-5oasA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ohs -

(-) 		no annotation 4 ASP A 292
ASN A 376
LEU A 382
PHE A 312
 None
 1.19A 6ekuA-5ohsA:
undetectable		 6ekuA-5ohsA:
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.
5sv9 BOR1P BORON
TRANSPORTER

(Saccharomyces
mikatae) 		PF00955
(HCO3_cotransp) 		4 ASP A  38
GLN A 381
ASN A  44
LEU A 366
 None
 0.99A 6ekuA-5sv9A:
undetectable		 6ekuA-5sv9A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tvd TM16

(Trichuris muris) 		PF01161
(PBP) 		4 ASP A 137
LEU A  90
SER A 106
PHE A 152
 None
 1.11A 6ekuA-5tvdA:
undetectable		 6ekuA-5tvdA:
13.00
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.
5wgg RADICAL SAM DOMAIN
PROTEIN

(Ruminiclostridium
thermocellum) 		PF04055
(Radical_SAM)
PF13186
(SPASM)
PF13353
(Fer4_12) 		4 GLN A 386
ASN A 387
LEU A 381
PHE A 136
 None
 1.24A 6ekuA-5wggA:
undetectable		 6ekuA-5wggA:
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.
5wy3 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 4 ASN A  45
LEU A  43
SER A  40
PHE A  80
 None
 1.23A 6ekuA-5wy3A:
undetectable		 6ekuA-5wy3A:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dex SUPPRESSOR OF
HYDROXYUREA
SENSITIVITY PROTEIN
2

(Eremothecium
gossypii) 		no annotation 4 ASP B 134
ASN B  14
LEU B  30
PHE B  34
 None
 1.16A 6ekuA-6dexB:
undetectable		 6ekuA-6dexB:
7.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6eks SIALIDASE

(Vibrio cholerae) 		no annotation 6 ASP A 276
GLN A 343
ASN A 571
LEU A 606
SER A 644
PHE A 664
 G39  A 908 (-3.3A)
G39  A 908 (-3.8A)
G39  A 908 (-4.5A)
None
G39  A 908 ( 3.8A)
None
 0.34A 6ekuA-6eksA:
71.0		 6ekuA-6eksA:
100.00