SIMILAR PATTERNS OF AMINO ACIDS FOR 1JDV_E_ADNE4260

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.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		5 THR A 326
GLY A 387
GLU A 333
SER A 322
ARG A 342
 None
 1.48A 1jdvE-1i6qA:
undetectable
1jdvF-1i6qA:
undetectable		 1jdvE-1i6qA:
16.19
1jdvF-1i6qA:
16.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jdz 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE

(Sulfolobus
solfataricus) 		PF01048
(PNP_UDP_1) 		8 ARG A  86
THR A  89
GLY A  91
VAL A 179
GLU A 180
MET A 181
GLU A 182
SER A 204
 SO4  A 250 ( 3.1A)
SO4  A 250 ( 3.0A)
FMB  A 270 (-3.3A)
FMB  A 270 (-4.6A)
FMB  A 270 (-4.6A)
FMB  A 270 (-3.8A)
FMB  A 270 (-2.8A)
FMB  A 270 (-3.2A)
 0.59A 1jdvE-1jdzA:
42.3
1jdvF-1jdzA:
42.0		 1jdvE-1jdzA:
100.00
1jdvF-1jdzA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1odi PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermus
thermophilus) 		PF01048
(PNP_UDP_1) 		7 ARG A  87
THR A  90
GLY A  92
GLU A 179
MET A 180
GLU A 181
SER A 203
 SO4  A1236 ( 2.8A)
SO4  A1236 ( 3.0A)
ADN  A1237 (-3.4A)
ADN  A1237 (-4.9A)
ADN  A1237 (-3.7A)
ADN  A1237 (-3.0A)
ADN  A1237 ( 3.7A)
 0.42A 1jdvE-1odiA:
34.7
1jdvF-1odiA:
34.7		 1jdvE-1odiA:
40.42
1jdvF-1odiA:
40.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1odi PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermus
thermophilus) 		PF01048
(PNP_UDP_1) 		5 ARG A  87
THR A  90
MET A  65
GLU A 181
SER A 203
 SO4  A1236 ( 2.8A)
SO4  A1236 ( 3.0A)
ADN  A1237 (-4.1A)
ADN  A1237 (-3.0A)
ADN  A1237 ( 3.7A)
 1.41A 1jdvE-1odiA:
34.7
1jdvF-1odiA:
34.7		 1jdvE-1odiA:
40.42
1jdvF-1odiA:
40.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pk9 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		8 ARG A  87
GLY A  92
VAL A 178
GLU A 179
MET A 180
GLU A 181
SER A 203
ASP A 204
 PO4  A 309 ( 2.8A)
2FA  A 306 (-3.5A)
2FA  A 306 (-4.8A)
2FA  A 306 (-4.7A)
2FA  A 306 (-3.8A)
2FA  A 306 (-2.9A)
2FA  A 306 ( 3.9A)
2FA  A 306 (-3.1A)
 0.36A 1jdvE-1pk9A:
33.6
1jdvF-1pk9A:
34.6		 1jdvE-1pk9A:
32.64
1jdvF-1pk9A:
32.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pk9 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		6 ARG A  87
GLY A 177
VAL A 178
GLU A 179
MET A 180
GLU A 181
 PO4  A 309 ( 2.8A)
None
2FA  A 306 (-4.8A)
2FA  A 306 (-4.7A)
2FA  A 306 (-3.8A)
2FA  A 306 (-2.9A)
 1.38A 1jdvE-1pk9A:
33.6
1jdvF-1pk9A:
34.6		 1jdvE-1pk9A:
32.64
1jdvF-1pk9A:
32.64
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.
1r8g HYPOTHETICAL PROTEIN
YBDK

(Escherichia
coli) 		PF04107
(GCS2) 		5 GLY A  98
VAL A 132
SER A 180
ASP A 242
ARG A 284
 None
 1.49A 1jdvE-1r8gA:
undetectable
1jdvF-1r8gA:
undetectable		 1jdvE-1r8gA:
20.51
1jdvF-1r8gA:
20.51
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.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1)
PF10423
(AMNp_N) 		5 GLY A 307
MET A 404
GLU A 405
SER A 427
ASP A 428
 None
 0.61A 1jdvE-1t8wA:
24.0
1jdvF-1t8wA:
24.1		 1jdvE-1t8wA:
19.92
1jdvF-1t8wA:
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.
1ybf AMP NUCLEOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01048
(PNP_UDP_1) 		5 GLY A  98
VAL A 184
MET A 186
GLU A 187
SER A 209
 None
 0.68A 1jdvE-1ybfA:
25.1
1jdvF-1ybfA:
24.6		 1jdvE-1ybfA:
25.66
1jdvF-1ybfA:
25.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1z34 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Trichomonas
vaginalis) 		PF01048
(PNP_UDP_1) 		8 ARG A  87
THR A  90
GLY A  92
VAL A 178
GLU A 179
MET A 180
GLU A 181
SER A 203
 2FD  A 300 ( 4.5A)
2FD  A 300 (-4.2A)
2FD  A 300 (-3.1A)
2FD  A 300 (-4.7A)
None
2FD  A 300 (-3.7A)
2FD  A 300 (-2.8A)
2FD  A 300 (-3.6A)
 0.49A 1jdvE-1z34A:
21.2
1jdvF-1z34A:
33.7		 1jdvE-1z34A:
34.87
1jdvF-1z34A:
34.87
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.
1zos 5'-METHYLTHIOADENOSI
NE /
S-ADENOSYLHOMOCYSTEI
NE NUCLEOSIDASE

(Streptococcus
pneumoniae) 		PF01048
(PNP_UDP_1) 		7 GLY A  78
VAL A 171
GLU A 172
MET A 173
GLU A 174
SER A 196
ASP A 197
 MTM  A 301 (-3.6A)
None
None
MTM  A 301 (-3.5A)
MTM  A 301 (-2.6A)
MTM  A 301 (-3.4A)
MTM  A 301 (-2.9A)
 0.72A 1jdvE-1zosA:
22.0
1jdvF-1zosA:
21.5		 1jdvE-1zosA:
24.81
1jdvF-1zosA:
24.81
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.
2a8b RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE R

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 ARG A 509
GLY A 513
VAL A 515
GLU A 516
ASP A 474
 None
 1.48A 1jdvE-2a8bA:
undetectable
1jdvF-2a8bA:
undetectable		 1jdvE-2a8bA:
22.62
1jdvF-2a8bA:
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.
2bsx PURINE NUCLEOSIDE
PHOSPHORYLASE

(Plasmodium
falciparum) 		PF01048
(PNP_UDP_1) 		6 ARG A  88
GLY A  93
VAL A 181
GLU A 182
MET A 183
GLU A 184
 NOS  A1248 ( 4.5A)
NOS  A1248 (-4.0A)
NOS  A1248 ( 4.4A)
None
NOS  A1248 (-3.4A)
NOS  A1248 (-3.1A)
 0.41A 1jdvE-2bsxA:
31.9
1jdvF-2bsxA:
31.8		 1jdvE-2bsxA:
29.30
1jdvF-2bsxA:
29.30
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.
2yvp MUTT/NUDIX FAMILY
PROTEIN

(Thermus
thermophilus) 		PF00293
(NUDIX) 		5 THR A 134
GLY A  96
VAL A  95
GLU A  94
GLU A 139
 None
None
None
MG  A 184 (-2.5A)
MG  A 183 (-2.5A)
 1.42A 1jdvE-2yvpA:
undetectable
1jdvF-2yvpA:
undetectable		 1jdvE-2yvpA:
21.43
1jdvF-2yvpA:
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.
3bba INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10) 		5 GLY A 311
VAL A 124
GLU A 123
SER A 319
ASP A 310
 None
 1.29A 1jdvE-3bbaA:
undetectable
1jdvF-3bbaA:
undetectable		 1jdvE-3bbaA:
24.66
1jdvF-3bbaA:
24.66
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.
3bje NUCLEOSIDE
PHOSPHORYLASE,
PUTATIVE

(Trypanosoma
brucei) 		PF01048
(PNP_UDP_1) 		6 ARG A 137
GLY A 142
GLU A 284
MET A 285
GLU A 286
SER A 309
 R1P  A 401 (-3.0A)
URA  A 501 (-3.4A)
R1P  A 401 ( 4.6A)
R1P  A 401 ( 3.9A)
R1P  A 401 (-2.6A)
URA  A 501 (-3.2A)
 1.08A 1jdvE-3bjeA:
28.4
1jdvF-3bjeA:
28.9		 1jdvE-3bjeA:
23.68
1jdvF-3bjeA:
23.68
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.
3bje NUCLEOSIDE
PHOSPHORYLASE,
PUTATIVE

(Trypanosoma
brucei) 		PF01048
(PNP_UDP_1) 		6 ARG A 137
THR A 140
GLY A 142
GLU A 284
MET A 285
GLU A 286
 R1P  A 401 (-3.0A)
R1P  A 401 (-3.0A)
URA  A 501 (-3.4A)
R1P  A 401 ( 4.6A)
R1P  A 401 ( 3.9A)
R1P  A 401 (-2.6A)
 0.42A 1jdvE-3bjeA:
28.4
1jdvF-3bjeA:
28.9		 1jdvE-3bjeA:
23.68
1jdvF-3bjeA:
23.68
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.
3bl6 5'-METHYLTHIOADENOSI
NE
NUCLEOSIDASE/S-ADENO
SYLHOMOCYSTEINE
NUCLEOSIDASE

(Staphylococcus
aureus) 		PF01048
(PNP_UDP_1) 		7 GLY A  77
VAL A 170
GLU A 171
MET A 172
GLU A 173
SER A 195
ASP A 196
 FMC  A 229 (-3.6A)
FMC  A 229 ( 4.7A)
FMC  A 229 (-4.7A)
FMC  A 229 (-3.5A)
FMC  A 229 (-2.5A)
FMC  A 229 (-3.5A)
FMC  A 229 (-3.0A)
 0.55A 1jdvE-3bl6A:
15.1
1jdvF-3bl6A:
24.0		 1jdvE-3bl6A:
27.94
1jdvF-3bl6A:
27.94
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.
3cjd TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Jannaschia sp.
CCS1) 		PF00440
(TetR_N)
PF13305
(WHG) 		5 ARG A  13
GLY A  64
GLU A  21
VAL A  62
GLU A  14
 None
 1.31A 1jdvE-3cjdA:
undetectable
1jdvF-3cjdA:
undetectable		 1jdvE-3cjdA:
21.63
1jdvF-3cjdA:
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.
3dp9 MTA/SAH NUCLEOSIDASE

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		7 GLY A  78
VAL A 172
GLU A 173
MET A 174
GLU A 175
SER A 197
ASP A 198
 BIG  A 301 (-3.7A)
BIG  A 301 (-4.9A)
None
BIG  A 301 (-3.6A)
BIG  A 301 (-2.8A)
BIG  A 301 (-3.3A)
BIG  A 301 (-2.9A)
 0.59A 1jdvE-3dp9A:
23.6
1jdvF-3dp9A:
23.3		 1jdvE-3dp9A:
24.90
1jdvF-3dp9A:
24.90
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.
3eei 5-METHYLTHIOADENOSIN
E
NUCLEOSIDASE/S-ADENO
SYLHOMOCYSTEINE
NUCLEOSIDASE

(Neisseria
meningitidis) 		PF01048
(PNP_UDP_1) 		7 GLY A  81
VAL A 175
GLU A 176
MET A 177
GLU A 178
SER A 200
ASP A 201
 MTM  A 234 (-3.9A)
MTM  A 234 ( 4.9A)
MTM  A 234 (-4.6A)
MTM  A 234 (-3.8A)
MTM  A 234 (-2.6A)
MTM  A 234 (-3.4A)
MTM  A 234 (-3.0A)
 0.59A 1jdvE-3eeiA:
23.3
1jdvF-3eeiA:
22.8		 1jdvE-3eeiA:
25.76
1jdvF-3eeiA:
25.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3emv URIDINE
PHOSPHORYLASE,
PUTATIVE

(Plasmodium
vivax) 		PF01048
(PNP_UDP_1) 		6 ARG A  89
GLY A  94
VAL A 182
GLU A 183
MET A 184
GLU A 185
 SO4  A 254 (-3.2A)
None
None
None
None
None
 0.34A 1jdvE-3emvA:
31.9
1jdvF-3emvA:
32.4		 1jdvE-3emvA:
30.08
1jdvF-3emvA:
30.08
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.
3euf URIDINE
PHOSPHORYLASE 1

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		6 ARG A 138
THR A 141
GLY A 143
GLU A 248
MET A 249
GLU A 250
 PO4  A 401 (-3.0A)
PO4  A 401 ( 3.0A)
BAU  A 400 (-3.3A)
None
BAU  A 400 (-3.8A)
PO4  A 401 ( 4.2A)
 0.32A 1jdvE-3eufA:
24.5
1jdvF-3eufA:
2.1		 1jdvE-3eufA:
23.37
1jdvF-3eufA:
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.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		5 GLY A 469
GLU A 640
VAL A 473
GLU A 474
ASP A 631
 None
 0.83A 1jdvE-3k30A:
undetectable
1jdvF-3k30A:
undetectable		 1jdvE-3k30A:
16.52
1jdvF-3k30A:
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.
3khs PURINE NUCLEOSIDE
PHOSPHORYLASE

(Singapore
grouper
iridovirus) 		PF01048
(PNP_UDP_1) 		5 GLY A 115
GLU A 198
VAL A 214
MET A 216
SER A 239
 None
None
None
TRS  A 294 (-3.7A)
None
 0.68A 1jdvE-3khsA:
23.3
1jdvF-3khsA:
22.5		 1jdvE-3khsA:
25.68
1jdvF-3khsA:
25.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kvy URIDINE
PHOSPHORYLASE

(Bos taurus) 		PF01048
(PNP_UDP_1) 		6 ARG A 137
THR A 140
GLY A 142
GLU A 247
MET A 248
GLU A 249
 SO4  A 311 ( 3.0A)
SO4  A 311 ( 3.1A)
URA  A 312 (-3.3A)
R2B  A 313 ( 4.4A)
URA  A 312 ( 3.7A)
R2B  A 313 (-2.6A)
 0.33A 1jdvE-3kvyA:
24.7
1jdvF-3kvyA:
25.4		 1jdvE-3kvyA:
24.68
1jdvF-3kvyA:
24.68
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.
3lgs 5'-METHYLTHIOADENOSI
NE NUCLEOSIDASES

(Arabidopsis
thaliana) 		PF01048
(PNP_UDP_1) 		5 THR A 116
GLY A 118
MET A 201
GLU A 202
ASP A 225
 SAH  A 268 (-3.8A)
ADE  A 269 ( 3.6A)
SAH  A 268 ( 3.3A)
SAH  A 268 (-3.1A)
ADE  A 269 ( 3.0A)
 0.51A 1jdvE-3lgsA:
20.3
1jdvF-3lgsA:
20.1		 1jdvE-3lgsA:
24.04
1jdvF-3lgsA:
24.04
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.
3mb8 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Toxoplasma
gondii) 		PF01048
(PNP_UDP_1) 		5 ARG A  93
THR A  96
GLY A  98
MET A 187
GLU A 188
 PO4  A 281 ( 3.0A)
PO4  A 281 ( 3.2A)
IMH  A 280 (-3.2A)
IMH  A 280 (-3.8A)
IMH  A 280 (-2.5A)
 0.34A 1jdvE-3mb8A:
31.8
1jdvF-3mb8A:
32.5		 1jdvE-3mb8A:
30.00
1jdvF-3mb8A:
30.00
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.
3ne5 CATION EFFLUX SYSTEM
PROTEIN CUSA

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 ARG A 669
THR A 627
VAL A 624
GLU A 625
ASP A 593
 None
 1.27A 1jdvE-3ne5A:
undetectable
1jdvF-3ne5A:
undetectable		 1jdvE-3ne5A:
12.56
1jdvF-3ne5A:
12.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o4v MTA/SAH NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		7 GLY A  78
VAL A 171
GLU A 172
MET A 173
GLU A 174
SER A 196
ASP A 197
 4CT  A 233 (-3.8A)
4CT  A 233 ( 4.9A)
None
4CT  A 233 (-3.6A)
4CT  A 233 (-3.0A)
4CT  A 233 (-3.3A)
4CT  A 233 (-2.9A)
 0.49A 1jdvE-3o4vA:
23.2
1jdvF-3o4vA:
23.0		 1jdvE-3o4vA:
26.36
1jdvF-3o4vA:
26.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3of3 PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE 1

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		8 ARG A 101
GLY A 106
VAL A 192
GLU A 193
MET A 194
GLU A 195
SER A 217
ASP A 218
 PO4  A 501 (-2.8A)
DIH  A 500 (-4.0A)
DIH  A 500 (-4.8A)
None
DIH  A 500 (-3.8A)
DIH  A 500 (-2.9A)
DIH  A 500 (-3.3A)
DIH  A 500 (-3.1A)
 0.54A 1jdvE-3of3A:
32.6
1jdvF-3of3A:
33.1		 1jdvE-3of3A:
30.77
1jdvF-3of3A:
30.77
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.
3p0f URIDINE
PHOSPHORYLASE 2

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		6 ARG A 144
THR A 147
GLY A 149
GLU A 254
MET A 255
GLU A 256
 None
BAU  A 400 (-4.5A)
BAU  A 400 (-3.5A)
None
BAU  A 400 (-3.9A)
None
 0.30A 1jdvE-3p0fA:
24.1
1jdvF-3p0fA:
24.7		 1jdvE-3p0fA:
26.60
1jdvF-3p0fA:
26.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3qpb URIDINE
PHOSPHORYLASE

(Streptococcus
pyogenes) 		PF01048
(PNP_UDP_1) 		6 ARG A  94
THR A  97
GLY A  99
GLU A 196
MET A 197
GLU A 198
 R1P  A1254 (-3.1A)
R1P  A1254 (-3.0A)
URA  A1255 (-3.2A)
R1P  A1254 ( 4.4A)
R1P  A1254 (-3.9A)
R1P  A1254 (-2.6A)
 0.31A 1jdvE-3qpbA:
31.7
1jdvF-3qpbA:
31.3		 1jdvE-3qpbA:
31.29
1jdvF-3qpbA:
31.29
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.
3qsj NUDIX HYDROLASE

(Alicyclobacillus
acidocaldarius) 		PF00293
(NUDIX) 		5 ARG A  78
GLU A 170
GLU A  82
GLU A  79
ARG A   5
 None
GOL  A 232 (-3.5A)
None
CA  A 230 (-3.3A)
None
 1.31A 1jdvE-3qsjA:
undetectable
1jdvF-3qsjA:
undetectable		 1jdvE-3qsjA:
19.92
1jdvF-3qsjA:
19.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tl6 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Entamoeba
histolytica) 		PF01048
(PNP_UDP_1) 		7 ARG A  92
GLY A  97
GLU A 183
MET A 184
GLU A 185
SER A 207
ASP A 208
 SO4  A 239 (-3.2A)
None
None
None
SO4  A 239 ( 4.4A)
None
None
 0.66A 1jdvE-3tl6A:
33.2
1jdvF-3tl6A:
33.3		 1jdvE-3tl6A:
34.57
1jdvF-3tl6A:
34.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tl6 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Entamoeba
histolytica) 		PF01048
(PNP_UDP_1) 		7 ARG A  92
GLY A  97
VAL A 182
GLU A 183
MET A 184
GLU A 185
SER A 207
 SO4  A 239 (-3.2A)
None
None
None
None
SO4  A 239 ( 4.4A)
None
 0.29A 1jdvE-3tl6A:
33.2
1jdvF-3tl6A:
33.3		 1jdvE-3tl6A:
34.57
1jdvF-3tl6A:
34.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uav PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Bacillus cereus) 		PF01048
(PNP_UDP_1) 		8 ARG A  87
THR A  90
GLY A  92
VAL A 178
GLU A 179
MET A 180
GLU A 181
SER A 203
 SO4  A 236 (-2.7A)
SO4  A 236 (-3.0A)
None
None
None
None
SO4  A 236 ( 4.4A)
None
 0.54A 1jdvE-3uavA:
34.7
1jdvF-3uavA:
34.7		 1jdvE-3uavA:
36.25
1jdvF-3uavA:
36.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dao PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Bacillus
subtilis) 		PF01048
(PNP_UDP_1) 		8 ARG A  87
GLY A  92
VAL A 177
GLU A 178
MET A 179
GLU A 180
SER A 202
ASP A 203
 None
ADE  A 301 (-3.5A)
ADE  A 301 (-4.4A)
None
ADE  A 301 ( 4.3A)
None
ADE  A 301 (-3.5A)
ADE  A 301 (-4.1A)
 0.57A 1jdvE-4daoA:
33.1
1jdvF-4daoA:
33.9		 1jdvE-4daoA:
31.01
1jdvF-4daoA:
31.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dao PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Bacillus
subtilis) 		PF01048
(PNP_UDP_1) 		6 ARG A  87
GLY A 176
VAL A 177
GLU A 178
MET A 179
GLU A 180
 None
None
ADE  A 301 (-4.4A)
None
ADE  A 301 ( 4.3A)
None
 1.40A 1jdvE-4daoA:
33.1
1jdvF-4daoA:
33.9		 1jdvE-4daoA:
31.01
1jdvF-4daoA:
31.01
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.
4fqg TRANSCRIPTION
ELONGATION REGULATOR
1

(Homo sapiens) 		PF01846
(FF) 		5 ARG A  67
THR A  63
GLU A 112
SER A  23
ASP A  24
 None
 1.34A 1jdvE-4fqgA:
undetectable
1jdvF-4fqgA:
undetectable		 1jdvE-4fqgA:
20.56
1jdvF-4fqgA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g41 MTA/SAH NUCLEOSIDASE

(Streptococcus
pyogenes) 		PF01048
(PNP_UDP_1) 		5 GLY A  78
GLU A 172
MET A 173
GLU A 174
SER A 196
 GLY  A  78 ( 0.0A)
GLU  A 172 ( 0.5A)
MET  A 173 ( 0.0A)
GLU  A 174 ( 0.6A)
SER  A 196 ( 0.0A)
 0.69A 1jdvE-4g41A:
23.8
1jdvF-4g41A:
23.7		 1jdvE-4g41A:
24.70
1jdvF-4g41A:
24.70
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.
4g41 MTA/SAH NUCLEOSIDASE

(Streptococcus
pyogenes) 		PF01048
(PNP_UDP_1) 		5 VAL A 171
GLU A 172
MET A 173
GLU A 174
SER A 196
 VAL  A 171 ( 0.6A)
GLU  A 172 ( 0.5A)
MET  A 173 ( 0.0A)
GLU  A 174 ( 0.6A)
SER  A 196 ( 0.0A)
 0.81A 1jdvE-4g41A:
23.8
1jdvF-4g41A:
23.7		 1jdvE-4g41A:
24.70
1jdvF-4g41A:
24.70
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.
4je0 SER-ASP RICH
FIBRINOGEN/BONE
SIALOPROTEIN-BINDING
PROTEIN SDRD

(Staphylococcus
aureus) 		PF10425
(SdrG_C_C) 		5 GLY A 178
GLU A  65
VAL A 168
GLU A 287
ASP A 176
 None
 1.09A 1jdvE-4je0A:
undetectable
1jdvF-4je0A:
undetectable		 1jdvE-4je0A:
20.94
1jdvF-4je0A:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jos ADENOSYLHOMOCYSTEINE
NUCLEOSIDASE

(Francisella
philomiragia) 		PF01048
(PNP_UDP_1) 		6 GLY A  79
GLU A 171
MET A 172
GLU A 173
SER A 195
ASP A 196
 ADE  A 301 (-3.7A)
None
ADE  A 301 (-4.1A)
None
ADE  A 301 (-3.3A)
ADE  A 301 (-2.8A)
 0.51A 1jdvE-4josA:
22.8
1jdvF-4josA:
22.3		 1jdvE-4josA:
23.08
1jdvF-4josA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jwt METHYLTHIOADENOSINE
NUCLEOSIDASE

(Sulfurimonas
denitrificans) 		PF01048
(PNP_UDP_1) 		6 GLY A  78
GLU A 171
MET A 172
GLU A 173
SER A 195
ASP A 196
 ADE  A 305 (-3.6A)
None
ADE  A 305 (-4.1A)
None
ADE  A 305 (-3.2A)
ADE  A 305 (-2.8A)
 0.56A 1jdvE-4jwtA:
22.7
1jdvF-4jwtA:
22.1		 1jdvE-4jwtA:
22.22
1jdvF-4jwtA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kn5 METHYLTHIOADENOSINE
NUCLEOSIDASE

(Weissella
paramesenteroides) 		PF01048
(PNP_UDP_1) 		5 GLY A  78
GLU A 173
MET A 174
GLU A 175
SER A 197
 EDO  A 301 (-3.3A)
None
None
None
None
 0.64A 1jdvE-4kn5A:
23.1
1jdvF-4kn5A:
23.4		 1jdvE-4kn5A:
24.71
1jdvF-4kn5A:
24.71
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.
4l0m PUTATIVE
5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Borreliella
burgdorferi) 		PF01048
(PNP_UDP_1) 		6 GLY A  81
VAL A 178
MET A 180
GLU A 181
SER A 203
ASP A 204
 ADE  A 301 (-3.6A)
None
ADE  A 301 ( 4.2A)
None
ADE  A 301 (-3.1A)
ADE  A 301 (-3.0A)
 0.55A 1jdvE-4l0mA:
22.2
1jdvF-4l0mA:
22.0		 1jdvE-4l0mA:
22.14
1jdvF-4l0mA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lc3 PUTATIVE
UDP-4-AMINO-4-DEOXY-
L-ARABINOSE--OXOGLUT
ARATE
AMINOTRANSFERASE

(Burkholderia
cenocepacia) 		PF01041
(DegT_DnrJ_EryC1) 		5 THR A  64
VAL A  93
GLU A  66
SER A 180
ASP A 158
 None
None
None
None
EDO  A 403 (-3.6A)
 1.20A 1jdvE-4lc3A:
undetectable
1jdvF-4lc3A:
undetectable		 1jdvE-4lc3A:
18.53
1jdvF-4lc3A:
18.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ldn PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Aliivibrio
fischeri) 		PF01048
(PNP_UDP_1) 		5 ARG A  88
GLU A 180
MET A 181
GLU A 182
ASP A 205
 PO4  A 301 (-2.9A)
None
None
PO4  A 301 ( 4.7A)
None
 0.82A 1jdvE-4ldnA:
34.3
1jdvF-4ldnA:
35.0		 1jdvE-4ldnA:
31.00
1jdvF-4ldnA:
31.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ldn PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Aliivibrio
fischeri) 		PF01048
(PNP_UDP_1) 		6 ARG A  88
GLY A  93
VAL A 179
GLU A 180
MET A 181
GLU A 182
 PO4  A 301 (-2.9A)
None
None
None
None
PO4  A 301 ( 4.7A)
 0.40A 1jdvE-4ldnA:
34.3
1jdvF-4ldnA:
35.0		 1jdvE-4ldnA:
31.00
1jdvF-4ldnA:
31.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ldn PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Aliivibrio
fischeri) 		PF01048
(PNP_UDP_1) 		6 ARG A  88
GLY A 178
VAL A 179
GLU A 180
MET A 181
GLU A 182
 PO4  A 301 (-2.9A)
None
None
None
None
PO4  A 301 ( 4.7A)
 1.38A 1jdvE-4ldnA:
34.3
1jdvF-4ldnA:
35.0		 1jdvE-4ldnA:
31.00
1jdvF-4ldnA:
31.00
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.
4lkr PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		5 ARG A  87
GLY A  92
MET A 180
GLU A 181
SER A 203
 None
 0.37A 1jdvE-4lkrA:
34.2
1jdvF-4lkrA:
35.4		 1jdvE-4lkrA:
28.52
1jdvF-4lkrA:
28.52
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.
4lna PURINE NUCLEOSIDE
PHOSPHORYLASE

(Spirosoma
linguale) 		PF01048
(PNP_UDP_1) 		5 GLY A 113
GLU A 192
VAL A 208
MET A 210
ASP A 234
 ADE  A 502 (-3.6A)
ADE  A 502 (-2.9A)
ADE  A 502 (-4.5A)
MPD  A 503 ( 3.2A)
ADE  A 502 (-2.9A)
 0.61A 1jdvE-4lnaA:
22.3
1jdvF-4lnaA:
21.8		 1jdvE-4lnaA:
21.61
1jdvF-4lnaA:
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.
4m1e PURINE NUCLEOSIDE
PHOSPHORYLASE

(Planctopirus
limnophila) 		PF01048
(PNP_UDP_1) 		5 GLY A 116
GLU A 194
VAL A 210
MET A 212
ASP A 236
 ADE  A 401 (-3.7A)
ADE  A 401 (-2.7A)
ADE  A 401 (-4.4A)
ADE  A 401 (-4.2A)
ADE  A 401 (-3.0A)
 0.55A 1jdvE-4m1eA:
12.8
1jdvF-4m1eA:
21.0		 1jdvE-4m1eA:
21.29
1jdvF-4m1eA:
21.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4m3n PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Meiothermus
ruber) 		PF01048
(PNP_UDP_1) 		7 THR A  90
GLY A  92
VAL A 178
GLU A 179
MET A 180
GLU A 181
SER A 203
 None
 0.51A 1jdvE-4m3nA:
34.5
1jdvF-4m3nA:
35.5		 1jdvE-4m3nA:
32.57
1jdvF-4m3nA:
32.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4m3n PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Meiothermus
ruber) 		PF01048
(PNP_UDP_1) 		5 THR A  90
MET A 180
GLU A 181
SER A 203
ASP A 204
 None
 0.91A 1jdvE-4m3nA:
34.5
1jdvF-4m3nA:
35.5		 1jdvE-4m3nA:
32.57
1jdvF-4m3nA:
32.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4m7w PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Leptotrichia
buccalis) 		PF01048
(PNP_UDP_1) 		9 ARG A  88
THR A  91
GLY A  93
VAL A 179
GLU A 180
MET A 181
GLU A 182
SER A 204
ASP A 205
 PO4  A 400 (-3.0A)
PO4  A 400 (-3.5A)
None
None
None
None
PO4  A 400 ( 4.4A)
None
None
 0.35A 1jdvE-4m7wA:
34.5
1jdvF-4m7wA:
35.7		 1jdvE-4m7wA:
32.21
1jdvF-4m7wA:
32.21
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.
4nx9 FLAGELLIN

(Pseudomonas
aeruginosa) 		PF00669
(Flagellin_N)
PF00700
(Flagellin_C) 		5 THR A 253
GLY A 251
GLU A 280
SER A 248
ASP A 250
 None
 1.40A 1jdvE-4nx9A:
undetectable
1jdvF-4nx9A:
undetectable		 1jdvE-4nx9A:
23.86
1jdvF-4nx9A:
23.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o7h GLUTATHIONE
S-TRANSFERASE

(Rhodospirillum
rubrum) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 GLY A 133
VAL A 106
GLU A 105
HIS A 184
ARG A 142
 None
 1.21A 1jdvE-4o7hA:
undetectable
1jdvF-4o7hA:
undetectable		 1jdvE-4o7hA:
23.66
1jdvF-4o7hA:
23.66
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.
4pr3 5'-METHYLTHIOADENOSI
NE NUCLEOSIDASE /
S-ADENOSYLHOMOCYSTEI
NE NUCLEOSIDASE

(Brucella
melitensis) 		PF01048
(PNP_UDP_1) 		6 GLY A  67
VAL A 142
MET A 144
GLU A 145
SER A 167
ASP A 168
 ADE  A 501 (-3.7A)
ADE  A 501 (-4.7A)
ADE  A 501 (-4.0A)
None
ADE  A 501 (-3.5A)
ADE  A 501 (-2.8A)
 0.66A 1jdvE-4pr3A:
9.5
1jdvF-4pr3A:
9.3		 1jdvE-4pr3A:
26.79
1jdvF-4pr3A:
26.79
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.
4qez 5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Bacillus
anthracis) 		no annotation 7 GLY B  78
VAL B 172
GLU B 173
MET B 174
GLU B 175
SER B 197
ASP B 198
 ADE  B 301 (-3.2A)
None
TRS  B 302 ( 4.8A)
TRS  B 302 (-4.2A)
TRS  B 302 (-2.7A)
ADE  B 301 (-3.0A)
ADE  B 301 (-2.4A)
 0.68A 1jdvE-4qezB:
22.3
1jdvF-4qezB:
22.0		 1jdvE-4qezB:
23.91
1jdvF-4qezB:
23.91
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.
4qfb CT263

(Chlamydia
trachomatis) 		no annotation 6 GLY A  74
VAL A 135
MET A 137
GLU A 138
SER A 160
ASP A 161
 None
 0.67A 1jdvE-4qfbA:
17.4
1jdvF-4qfbA:
17.4		 1jdvE-4qfbA:
25.10
1jdvF-4qfbA:
25.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r2w URIDINE
PHOSPHORYLASE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		5 ARG A  88
GLY A  93
GLU A 193
GLU A 195
ARG A  27
 SO4  A 302 ( 2.8A)
None
GOL  A 303 (-4.9A)
GOL  A 303 (-2.9A)
SO4  A 302 (-3.0A)
 1.28A 1jdvE-4r2wA:
31.2
1jdvF-4r2wA:
30.7		 1jdvE-4r2wA:
33.85
1jdvF-4r2wA:
33.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r2w URIDINE
PHOSPHORYLASE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		6 ARG A  88
THR A  91
GLY A  93
GLU A 193
MET A 194
GLU A 195
 SO4  A 302 ( 2.8A)
SO4  A 302 ( 3.0A)
None
GOL  A 303 (-4.9A)
GOL  A 303 (-3.5A)
GOL  A 303 (-2.9A)
 0.29A 1jdvE-4r2wA:
31.2
1jdvF-4r2wA:
30.7		 1jdvE-4r2wA:
33.85
1jdvF-4r2wA:
33.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4tym PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Streptococcus
agalactiae) 		PF01048
(PNP_UDP_1) 		7 ARG A 109
THR A 112
GLY A 114
GLU A 201
MET A 202
GLU A 203
SER A 225
 SO4  A 301 (-2.8A)
SO4  A 301 (-3.7A)
None
None
None
SO4  A 301 ( 4.4A)
None
 0.48A 1jdvE-4tymA:
33.9
1jdvF-4tymA:
35.3		 1jdvE-4tymA:
30.38
1jdvF-4tymA:
30.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4tym PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Streptococcus
agalactiae) 		PF01048
(PNP_UDP_1) 		6 ARG A 109
THR A 112
MET A 202
GLU A 203
SER A 225
ASP A 226
 SO4  A 301 (-2.8A)
SO4  A 301 (-3.7A)
None
SO4  A 301 ( 4.4A)
None
None
 0.81A 1jdvE-4tymA:
33.9
1jdvF-4tymA:
35.3		 1jdvE-4tymA:
30.38
1jdvF-4tymA:
30.38
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.
4urn DNA TOPOISOMERASE
IV, B SUBUNIT

(Staphylococcus
aureus) 		PF02518
(HATPase_c) 		5 ARG A 193
GLY A  38
GLU A 192
SER A  33
ASP A  35
 None
 1.44A 1jdvE-4urnA:
undetectable
1jdvF-4urnA:
undetectable		 1jdvE-4urnA:
23.13
1jdvF-4urnA:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y0w YEAZ

(Pseudomonas
aeruginosa) 		PF00814
(Peptidase_M22) 		5 GLY A  63
VAL A  93
GLU A 141
SER A  10
ASP A   8
 None
None
None
NA  A 302 (-3.5A)
NA  A 302 (-3.6A)
 0.91A 1jdvE-4y0wA:
undetectable
1jdvF-4y0wA:
undetectable		 1jdvE-4y0wA:
21.43
1jdvF-4y0wA:
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.
4ywl CELL DIVISION
CONTROL PROTEIN 21

(Pyrococcus
furiosus) 		PF14551
(MCM_N)
PF17207
(MCM_OB) 		5 ARG A 228
GLY A  67
GLU A  72
GLU A  65
GLU A 245
 None
 1.44A 1jdvE-4ywlA:
undetectable
1jdvF-4ywlA:
undetectable		 1jdvE-4ywlA:
21.11
1jdvF-4ywlA:
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.
4z3l MAJOR POLLEN
ALLERGEN BET V 1-A

(Betula pendula) 		PF00407
(Bet_v_1) 		5 ARG A 145
THR A  10
GLY A 111
GLU A 148
ASP A 109
 None
 1.27A 1jdvE-4z3lA:
undetectable
1jdvF-4z3lA:
undetectable		 1jdvE-4z3lA:
22.13
1jdvF-4z3lA:
22.13
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.
5b7n MTA/SAH NUCLEOSIDASE

(Aeromonas
hydrophila) 		PF01048
(PNP_UDP_1) 		6 THR A 104
GLY A 106
GLU A 219
MET A 220
GLU A 221
SER A 243
 SAH  A 301 (-4.3A)
SAH  A 301 (-3.2A)
SAH  A 301 (-4.9A)
SAH  A 301 (-3.6A)
SAH  A 301 (-2.6A)
SAH  A 301 ( 4.0A)
 0.40A 1jdvE-5b7nA:
23.1
1jdvF-5b7nA:
22.4		 1jdvE-5b7nA:
25.09
1jdvF-5b7nA:
25.09
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.
5cyf PUTATIVE URIDINE
PHOSPHORYLASE

(Schistosoma
mansoni) 		PF01048
(PNP_UDP_1) 		5 ARG A 121
THR A 124
GLU A 232
MET A 233
GLU A 234
 FLC  A 301 (-3.0A)
FLC  A 301 (-3.7A)
None
None
FLC  A 301 (-2.8A)
 0.32A 1jdvE-5cyfA:
23.5
1jdvF-5cyfA:
24.1		 1jdvE-5cyfA:
25.58
1jdvF-5cyfA:
25.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dk6 5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Colwellia
psychrerythraea) 		PF01048
(PNP_UDP_1) 		7 GLY A  78
VAL A 177
GLU A 178
MET A 179
GLU A 180
SER A 202
ASP A 203
 ADE  A 302 (-3.6A)
ADE  A 302 (-4.6A)
None
ADE  A 302 (-4.1A)
None
ADE  A 302 (-3.2A)
ADE  A 302 (-2.9A)
 0.53A 1jdvE-5dk6A:
22.1
1jdvF-5dk6A:
21.8		 1jdvE-5dk6A:
23.90
1jdvF-5dk6A:
23.90
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.
5dlc PYRIDOXINE
5'-PHOSPHATE
SYNTHASE

(Pseudomonas
aeruginosa) 		PF03740
(PdxJ) 		5 GLY A  85
GLU A  83
VAL A 105
HIS A  63
ARG A  62
 None
 1.12A 1jdvE-5dlcA:
undetectable
1jdvF-5dlcA:
undetectable		 1jdvE-5dlcA:
22.14
1jdvF-5dlcA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fhx ANTIBODY FRAGMENT
HEAVY-CHAIN
INTERLEUKIN-4

(Homo sapiens) 		PF00727
(IL4)
PF07654
(C1-set)
PF07686
(V-set) 		5 GLY H  56
MET H  50
SER H  54
ASP H  55
HIS A  74
 None
None
PO4  H 401 ( 4.2A)
None
None
 1.07A 1jdvE-5fhxH:
undetectable
1jdvF-5fhxH:
undetectable		 1jdvE-5fhxH:
22.19
1jdvF-5fhxH:
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.
5fjn L-AMINO ACID
DEAMINASE

(Cosenzaea
myxofaciens) 		PF01266
(DAO) 		5 ARG A  41
VAL A 405
GLU A 406
GLU A 205
ARG A 304
 None
 1.12A 1jdvE-5fjnA:
undetectable
1jdvF-5fjnA:
undetectable		 1jdvE-5fjnA:
20.61
1jdvF-5fjnA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h8a YTH
DOMAIN-CONTAINING
PROTEIN MMI1

(Schizosaccharomyces
pombe) 		PF04146
(YTH) 		5 ARG A 381
GLY A 345
GLU A 468
GLU A 463
HIS A 454
 None
 1.29A 1jdvE-5h8aA:
undetectable
1jdvF-5h8aA:
undetectable		 1jdvE-5h8aA:
22.96
1jdvF-5h8aA:
22.96
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.
5iz1 FRUCTOSE-1,6-BISPHOS
PHATASE

(Physcomitrella
patens) 		PF00316
(FBPase) 		5 THR A 278
GLY A 276
VAL A 267
MET A 259
SER A 289
 None
 0.65A 1jdvE-5iz1A:
undetectable
1jdvF-5iz1A:
undetectable		 1jdvE-5iz1A:
21.75
1jdvF-5iz1A:
21.75
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.
5k1z AMINODEOXYFUTALOSINE
NUCLEOSIDASE

(Helicobacter
pylori) 		PF01048
(PNP_UDP_1) 		7 GLY A  80
VAL A 172
GLU A 173
MET A 174
GLU A 175
SER A 197
ASP A 198
 4CT  A 301 (-3.4A)
4CT  A 301 ( 4.5A)
None
4CT  A 301 (-3.0A)
4CT  A 301 (-2.2A)
4CT  A 301 ( 2.8A)
4CT  A 301 (-2.2A)
 0.44A 1jdvE-5k1zA:
23.9
1jdvF-5k1zA:
23.4		 1jdvE-5k1zA:
23.27
1jdvF-5k1zA:
23.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5lhv URIDINE
PHOSPHORYLASE

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		6 ARG A  90
THR A  93
GLY A  95
GLU A 195
MET A 196
GLU A 197
 SO4  A 301 ( 3.0A)
SO4  A 301 ( 2.9A)
URI  A 303 ( 3.4A)
URI  A 303 ( 4.6A)
URI  A 303 ( 3.7A)
URI  A 303 (-2.7A)
 0.28A 1jdvE-5lhvA:
31.4
1jdvF-5lhvA:
31.9		 1jdvE-5lhvA:
31.27
1jdvF-5lhvA:
31.27
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.
5of4 GENERAL
TRANSCRIPTION FACTOR
IIH SUBUNIT 2

(Homo sapiens) 		PF04056
(Ssl1) 		5 THR E  70
GLY E  67
GLU E  72
SER E 172
ASP E  66
 None
 1.14A 1jdvE-5of4E:
undetectable
1jdvF-5of4E:
undetectable		 1jdvE-5of4E:
19.30
1jdvF-5of4E:
19.30
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.
5ue1 5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Aliivibrio
fischeri) 		PF01048
(PNP_UDP_1) 		7 GLY A  78
VAL A 172
GLU A 173
MET A 174
GLU A 175
SER A 197
ASP A 198
 9DA  A 301 (-3.5A)
None
TRS  A 302 ( 4.6A)
TRS  A 302 (-3.9A)
TRS  A 302 (-2.7A)
9DA  A 301 (-3.2A)
9DA  A 301 (-2.8A)
 0.65A 1jdvE-5ue1A:
23.8
1jdvF-5ue1A:
23.5		 1jdvE-5ue1A:
26.79
1jdvF-5ue1A:
26.79
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.
5ui3 DIHYDRODIPICOLINATE
SYNTHASE

(Chlamydomonas
reinhardtii) 		no annotation 5 THR D 112
GLY D 149
GLU D 113
SER D 123
HIS D 141
 None
 1.42A 1jdvE-5ui3D:
undetectable
1jdvF-5ui3D:
undetectable		 1jdvE-5ui3D:
18.31
1jdvF-5ui3D:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y83 MEMBRANE PROTEIN
INSERTASE YIDC

(Thermotoga
maritima) 		no annotation 5 THR A 117
GLY A  91
VAL A  92
SER A 104
ARG A 189
 None
 1.47A 1jdvE-5y83A:
undetectable
1jdvF-5y83A:
undetectable		 1jdvE-5y83A:
18.22
1jdvF-5y83A:
18.22
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.
5ze4 DIHYDROXY-ACID
DEHYDRATASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 5 THR A 216
GLY A 286
VAL A 281
HIS A 499
ARG A 487
 MG  A 606 ( 4.7A)
None
None
None
None
 1.35A 1jdvE-5ze4A:
4.9
1jdvF-5ze4A:
3.4		 1jdvE-5ze4A:
undetectable
1jdvF-5ze4A:
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.
6fay ODZ3 PROTEIN

(Mus musculus) 		no annotation 5 ARG A2475
GLY A1141
GLU A1114
GLU A1144
SER A1014
 None
 1.44A 1jdvE-6fayA:
undetectable
1jdvF-6fayA:
undetectable		 1jdvE-6fayA:
16.03
1jdvF-6fayA:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6g7x -

(-) 		no annotation 5 ARG A  87
GLY A  92
GLU A 179
SER A 203
ARG A  24
 PO4  A 304 ( 4.4A)
IMD  A 302 ( 4.2A)
None
None
PO4  A 304 (-3.0A)
 1.46A 1jdvE-6g7xA:
34.6
1jdvF-6g7xA:
35.5		 1jdvE-6g7xA:
undetectable
1jdvF-6g7xA:
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.
6g7x -

(-) 		no annotation 5 ARG A  87
THR A  90
GLU A 181
SER A 203
ASP A 204
 PO4  A 304 ( 4.4A)
PO4  A 304 (-2.8A)
PO4  A 304 ( 4.7A)
None
None
 0.93A 1jdvE-6g7xA:
34.6
1jdvF-6g7xA:
35.5		 1jdvE-6g7xA:
undetectable
1jdvF-6g7xA:
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.
6g7x -

(-) 		no annotation 7 ARG A  87
THR A  90
GLY A  92
GLU A 179
MET A 180
GLU A 181
SER A 203
 PO4  A 304 ( 4.4A)
PO4  A 304 (-2.8A)
IMD  A 302 ( 4.2A)
None
IMD  A 302 (-4.6A)
PO4  A 304 ( 4.7A)
None
 0.45A 1jdvE-6g7xA:
34.6
1jdvF-6g7xA:
35.5		 1jdvE-6g7xA:
undetectable
1jdvF-6g7xA:
undetectable