SIMILAR PATTERNS OF AMINO ACIDS FOR 3KO0_P_TFPP201

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.
1buc BUTYRYL-COA
DEHYDROGENASE

(Megasphaera
elsdenii) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 GLY A 165
GLY A 193
CYH A  97
PHE A 126
 None
None
None
CAA  A 384 ( 4.7A)
 0.92A 3ko0M-1bucA:
1.5
3ko0P-1bucA:
1.5		 3ko0M-1bucA:
14.96
3ko0P-1bucA:
14.96
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.
1c7g TYROSINE
PHENOL-LYASE

(Pantoea
agglomerans) 		PF01212
(Beta_elim_lyase) 		4 GLY A 101
GLY A 292
CYH A 251
PHE A 212
 None
 0.94A 3ko0M-1c7gA:
0.0
3ko0P-1c7gA:
undetectable		 3ko0M-1c7gA:
12.00
3ko0P-1c7gA:
12.00
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.
1cx1 ENDOGLUCANASE C

(Cellulomonas
fimi) 		PF02018
(CBM_4_9) 		4 GLY A  85
GLY A  61
PHE A  70
PHE A 131
 None
 0.93A 3ko0M-1cx1A:
undetectable
3ko0P-1cx1A:
undetectable		 3ko0M-1cx1A:
17.61
3ko0P-1cx1A:
17.61
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.
1d0n HORSE PLASMA
GELSOLIN

(Equus caballus) 		PF00626
(Gelsolin) 		4 PHE A 305
GLY A 320
PHE A 294
PHE A 366
 None
 0.90A 3ko0M-1d0nA:
0.7
3ko0P-1d0nA:
0.5		 3ko0M-1d0nA:
11.02
3ko0P-1d0nA:
11.02
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.
1f89 32.5 KDA PROTEIN
YLR351C

(Saccharomyces
cerevisiae) 		PF00795
(CN_hydrolase) 		4 GLY A 167
GLY A 151
CYH A  54
PHE A  55
 None
 0.81A 3ko0M-1f89A:
undetectable
3ko0P-1f89A:
undetectable		 3ko0M-1f89A:
18.02
3ko0P-1f89A:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fzd FIBRINOGEN-420

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE A 666
GLY A 800
GLY A 662
PHE A 766
 None
 0.84A 3ko0M-1fzdA:
undetectable
3ko0P-1fzdA:
undetectable		 3ko0M-1fzdA:
18.56
3ko0P-1fzdA:
18.56
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.
1ipf TROPINONE
REDUCTASE-II

(Datura
stramonium) 		PF13561
(adh_short_C2) 		4 GLY A 186
GLY A 149
CYH A 172
PHE A 175
 None
 0.96A 3ko0M-1ipfA:
undetectable
3ko0P-1ipfA:
undetectable		 3ko0M-1ipfA:
16.34
3ko0P-1ipfA:
16.34
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		4 GLY A 612
GLY A 668
CYH A 604
PHE A 606
 None
None
HEC  A 802 (-1.8A)
None
 0.96A 3ko0M-1kb0A:
undetectable
3ko0P-1kb0A:
undetectable		 3ko0M-1kb0A:
9.17
3ko0P-1kb0A:
9.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lwu FIBRINOGEN BETA
CHAIN

(Petromyzon
marinus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		4 PHE B 283
GLY B 434
GLY B 279
PHE B 395
 None
 0.91A 3ko0M-1lwuB:
undetectable
3ko0P-1lwuB:
undetectable		 3ko0M-1lwuB:
13.40
3ko0P-1lwuB:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m1j FIBRINOGEN BETA
CHAIN

(Gallus gallus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		4 PHE B 267
GLY B 418
GLY B 263
PHE B 379
 None
 0.89A 3ko0M-1m1jB:
undetectable
3ko0P-1m1jB:
undetectable		 3ko0M-1m1jB:
11.65
3ko0P-1m1jB:
11.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m1j FIBRINOGEN GAMMA
CHAIN

(Gallus gallus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		4 PHE C 204
GLY C 346
GLY C 200
PHE C 312
 None
 0.86A 3ko0M-1m1jC:
undetectable
3ko0P-1m1jC:
undetectable		 3ko0M-1m1jC:
12.47
3ko0P-1m1jC:
12.47
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.
1m56 CYTOCHROME C OXIDASE

(Rhodobacter
sphaeroides) 		PF00510
(COX3) 		4 GLY C 210
GLY C 175
PHE C 128
PHE C 202
 None
 0.94A 3ko0M-1m56C:
undetectable
3ko0P-1m56C:
undetectable		 3ko0M-1m56C:
17.30
3ko0P-1m56C:
17.30
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 GLY A 970
CYH A 871
PHE A 870
PHE A1174
 None
 0.91A 3ko0M-1ofeA:
0.0
3ko0P-1ofeA:
1.4		 3ko0M-1ofeA:
6.25
3ko0P-1ofeA:
6.25
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.
1php 3-PHOSPHOGLYCERATE
KINASE

(Geobacillus
stearothermophilus) 		PF00162
(PGK) 		4 GLY A 195
GLY A 350
PHE A 249
PHE A 225
 ADP  A 396 (-3.3A)
ADP  A 396 (-3.6A)
None
None
 0.83A 3ko0M-1phpA:
undetectable
3ko0P-1phpA:
undetectable		 3ko0M-1phpA:
13.10
3ko0P-1phpA:
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.
1rgi GELSOLIN

(Equus caballus) 		PF00626
(Gelsolin) 		4 PHE G 305
GLY G 320
PHE G 294
PHE G 366
 None
 0.96A 3ko0M-1rgiG:
undetectable
3ko0P-1rgiG:
undetectable		 3ko0M-1rgiG:
16.33
3ko0P-1rgiG:
16.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tuh HYPOTHETICAL PROTEIN
EGC068

(uncultured
bacterium) 		PF12680
(SnoaL_2) 		4 PHE A  35
GLY A  38
GLY A  84
PHE A  47
 None
 0.96A 3ko0M-1tuhA:
undetectable
3ko0P-1tuhA:
undetectable		 3ko0M-1tuhA:
20.78
3ko0P-1tuhA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1un1 XYLOGLUCAN
ENDOTRANSGLYCOSYLASE

(Populus tremula) 		PF00722
(Glyco_hydro_16)
PF06955
(XET_C) 		4 PHE A 202
GLY A  12
GLY A  29
PHE A  74
 None
 0.96A 3ko0M-1un1A:
undetectable
3ko0P-1un1A:
undetectable		 3ko0M-1un1A:
17.96
3ko0P-1un1A:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wdn GLUTAMINE BINDING
PROTEIN

(Escherichia
coli) 		PF00497
(SBP_bac_3) 		4 GLY A  89
GLY A 119
PHE A  27
PHE A 221
 None
GLN  A 227 (-3.9A)
None
None
 0.85A 3ko0M-1wdnA:
undetectable
3ko0P-1wdnA:
undetectable		 3ko0M-1wdnA:
20.09
3ko0P-1wdnA:
20.09
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.
1x2b PROLINE
IMINOPEPTIDASE

(Serratia
marcescens) 		PF00561
(Abhydrolase_1) 		4 PHE A 224
GLY A 220
GLY A 205
CYH A  74
 None
 0.97A 3ko0M-1x2bA:
undetectable
3ko0P-1x2bA:
undetectable		 3ko0M-1x2bA:
15.41
3ko0P-1x2bA:
15.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xfd DIPEPTIDYL
AMINOPEPTIDASE-LIKE
PROTEIN 6

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 PHE A 460
GLY A 483
GLY A 456
PHE A 667
 None
 0.79A 3ko0M-1xfdA:
undetectable
3ko0P-1xfdA:
undetectable		 3ko0M-1xfdA:
8.70
3ko0P-1xfdA:
8.70
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.
1zmr PHOSPHOGLYCERATE
KINASE

(Escherichia
coli) 		PF00162
(PGK) 		4 GLY A 340
GLY A 190
PHE A 369
PHE A 141
 None
 0.88A 3ko0M-1zmrA:
undetectable
3ko0P-1zmrA:
undetectable		 3ko0M-1zmrA:
14.14
3ko0P-1zmrA:
14.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zmr PHOSPHOGLYCERATE
KINASE

(Escherichia
coli) 		PF00162
(PGK) 		4 GLY A 340
GLY A 191
PHE A 369
PHE A 141
 None
 0.81A 3ko0M-1zmrA:
undetectable
3ko0P-1zmrA:
undetectable		 3ko0M-1zmrA:
14.14
3ko0P-1zmrA:
14.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2btd PTS-DEPENDENT
DIHYDROXYACETONE
KINASE

(Escherichia
coli) 		PF02734
(Dak2) 		4 PHE A  88
GLY A  85
GLY A 113
CYH A  15
 None
 0.91A 3ko0M-2btdA:
0.0
3ko0P-2btdA:
undetectable		 3ko0M-2btdA:
19.43
3ko0P-2btdA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bwg GMP REDUCTASE I

(Homo sapiens) 		PF00478
(IMPDH) 		4 PHE A 266
GLY A 268
GLY A 183
CYH A 251
 None
5GP  A1340 (-3.3A)
5GP  A1340 ( 3.2A)
None
 0.84A 3ko0M-2bwgA:
undetectable
3ko0P-2bwgA:
undetectable		 3ko0M-2bwgA:
13.22
3ko0P-2bwgA:
13.22
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.
2c9j GREEN FLUORESCENT
PROTEIN FP512

(Cerianthus
membranaceus) 		PF01353
(GFP) 		4 PHE A  65
GLY A  30
GLY A  27
PHE A  79
 CRQ  A  62 ( 3.7A)
None
None
None
 0.91A 3ko0M-2c9jA:
undetectable
3ko0P-2c9jA:
undetectable		 3ko0M-2c9jA:
20.90
3ko0P-2c9jA:
20.90
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.
2d39 FICOLIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE A 168
GLY A 290
GLY A 164
PHE A 256
 None
 0.89A 3ko0M-2d39A:
undetectable
3ko0P-2d39A:
undetectable		 3ko0M-2d39A:
16.88
3ko0P-2d39A:
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.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		4 GLY A 211
GLY A 154
CYH A 199
PHE A 196
 None
 0.95A 3ko0M-2fpgA:
undetectable
3ko0P-2fpgA:
undetectable		 3ko0M-2fpgA:
15.13
3ko0P-2fpgA:
15.13
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.
2fqd BLUE COPPER OXIDASE
CUEO

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 PHE A 190
GLY A 194
GLY A  60
MET A 154
 None
 0.89A 3ko0M-2fqdA:
undetectable
3ko0P-2fqdA:
undetectable		 3ko0M-2fqdA:
12.11
3ko0P-2fqdA:
12.11
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.
2fqd BLUE COPPER OXIDASE
CUEO

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 PHE A 190
GLY A 194
GLY A  61
MET A 154
 None
 0.92A 3ko0M-2fqdA:
undetectable
3ko0P-2fqdA:
undetectable		 3ko0M-2fqdA:
12.11
3ko0P-2fqdA:
12.11
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.
2g8g CAPSID

(Adeno-associated
dependoparvovirus
A) 		PF00740
(Parvo_coat) 		4 PHE A 646
GLY A 271
GLY A 367
PHE A 403
 None
 0.81A 3ko0M-2g8gA:
undetectable
3ko0P-2g8gA:
undetectable		 3ko0M-2g8gA:
10.10
3ko0P-2g8gA:
10.10
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.
2gy7 ANGIOPOIETIN-2

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE A 335
GLY A 457
GLY A 331
PHE A 423
 None
 0.79A 3ko0M-2gy7A:
undetectable
3ko0P-2gy7A:
undetectable		 3ko0M-2gy7A:
17.62
3ko0P-2gy7A:
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.
2ie8 PHOSPHOGLYCERATE
KINASE

(Thermus
caldophilus) 		PF00162
(PGK) 		4 GLY A 347
GLY A 191
PHE A 376
PHE A 143
 None
 0.76A 3ko0M-2ie8A:
0.0
3ko0P-2ie8A:
undetectable		 3ko0M-2ie8A:
11.79
3ko0P-2ie8A:
11.79
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.
2j64 FICOLIN-3

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE A  65
GLY A 187
GLY A  61
PHE A 153
 None
 0.97A 3ko0M-2j64A:
undetectable
3ko0P-2j64A:
undetectable		 3ko0M-2j64A:
18.26
3ko0P-2j64A:
18.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE
BETA-ASPARTATE
METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF01135
(PCMT) 		4 GLY A  88
MET A  98
CYH A  97
PHE A 142
 SAH  A 301 (-3.1A)
None
None
None
 0.88A 3ko0M-2pbfA:
0.0
3ko0P-2pbfA:
undetectable		 3ko0M-2pbfA:
16.37
3ko0P-2pbfA:
16.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2po3 4-DEHYDRASE

(Streptomyces
venezuelae) 		PF01041
(DegT_DnrJ_EryC1) 		4 GLY A1149
GLY A1186
PHE A1100
PHE A1330
 None
None
T4K  A1500 ( 4.0A)
None
 0.92A 3ko0M-2po3A:
undetectable
3ko0P-2po3A:
undetectable		 3ko0M-2po3A:
12.29
3ko0P-2po3A:
12.29
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.
2r7m 5-FORMAMINOIMIDAZOLE
-4-CARBOXAMIDE-1-(BE
TA)-D-RIBOFURANOSYL
5'-MONOPHOSPHATE
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF06849
(DUF1246)
PF06973
(DUF1297) 		4 GLY A 340
GLY A 325
CYH A 295
PHE A 294
 None
 0.85A 3ko0M-2r7mA:
undetectable
3ko0P-2r7mA:
undetectable		 3ko0M-2r7mA:
15.26
3ko0P-2r7mA:
15.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vy0 ENDO-BETA-1,3-GLUCAN
ASE

(Pyrococcus
furiosus) 		PF00722
(Glyco_hydro_16) 		4 PHE A 219
GLY A 220
GLY A 186
PHE A 216
 None
 0.92A 3ko0M-2vy0A:
undetectable
3ko0P-2vy0A:
undetectable		 3ko0M-2vy0A:
17.32
3ko0P-2vy0A:
17.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w1v NITRILASE HOMOLOG 2

(Mus musculus) 		PF00795
(CN_hydrolase) 		4 GLY A 189
GLY A 173
CYH A  82
PHE A  83
 None
 0.86A 3ko0M-2w1vA:
undetectable
3ko0P-2w1vA:
undetectable		 3ko0M-2w1vA:
18.91
3ko0P-2w1vA:
18.91
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.
2wnp FICOLIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE F 139
GLY F 261
GLY F 135
PHE F 227
 None
 0.92A 3ko0M-2wnpF:
undetectable
3ko0P-2wnpF:
undetectable		 3ko0M-2wnpF:
19.25
3ko0P-2wnpF:
19.25
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 GLY A  86
GLY A 397
PHE A  80
PHE A 117
 None
 0.95A 3ko0M-2yevA:
undetectable
3ko0P-2yevA:
undetectable		 3ko0M-2yevA:
7.26
3ko0P-2yevA:
7.26
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.
2yv5 YJEQ PROTEIN

(Aquifex
aeolicus) 		PF03193
(RsgA_GTPase) 		4 PHE A  24
GLY A  27
GLY A 217
PHE A  60
 None
 0.88A 3ko0M-2yv5A:
0.0
3ko0P-2yv5A:
undetectable		 3ko0M-2yv5A:
17.54
3ko0P-2yv5A:
17.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bvh FIBRINOGEN BETA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		4 PHE B 262
GLY B 414
GLY B 258
PHE B 375
 None
 0.89A 3ko0M-3bvhB:
undetectable
3ko0P-3bvhB:
undetectable		 3ko0M-3bvhB:
16.38
3ko0P-3bvhB:
16.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bvh FIBRINOGEN GAMMA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		4 PHE C 204
GLY C 346
GLY C 200
PHE C 312
 None
 0.89A 3ko0M-3bvhC:
undetectable
3ko0P-3bvhC:
undetectable		 3ko0M-3bvhC:
15.66
3ko0P-3bvhC:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cih PUTATIVE
ALPHA-RHAMNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		4 GLY A  25
GLY A 371
PHE A 174
PHE A 164
 None
 0.97A 3ko0M-3cihA:
0.3
3ko0P-3cihA:
0.4		 3ko0M-3cihA:
9.74
3ko0P-3cihA:
9.74
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.
3clk TRANSCRIPTION
REGULATOR

(Lactobacillus
plantarum) 		PF13377
(Peripla_BP_3) 		4 GLY A 252
GLY A 185
MET A 278
CYH A 279
 None
 0.95A 3ko0M-3clkA:
0.0
3ko0P-3clkA:
undetectable		 3ko0M-3clkA:
17.44
3ko0P-3clkA:
17.44
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.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		4 GLY A 301
GLY A 263
CYH A  75
PHE A 101
 None
 0.93A 3ko0M-3d3aA:
undetectable
3ko0P-3d3aA:
undetectable		 3ko0M-3d3aA:
10.45
3ko0P-3d3aA:
10.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		4 GLY A 301
GLY A 263
CYH A 121
PHE A  79
 None
 0.93A 3ko0M-3d3aA:
undetectable
3ko0P-3d3aA:
undetectable		 3ko0M-3d3aA:
10.45
3ko0P-3d3aA:
10.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fib FIBRINOGEN GAMMA
CHAIN RESIDUES

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE A 204
GLY A 346
GLY A 200
PHE A 312
 None
 0.84A 3ko0M-3fibA:
undetectable
3ko0P-3fibA:
undetectable		 3ko0M-3fibA:
18.33
3ko0P-3fibA:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gwq D-SERINE DEAMINASE

(Paraburkholderia
xenovorans) 		PF01168
(Ala_racemase_N)
PF14031
(D-ser_dehydrat) 		4 PHE A 222
GLY A 211
GLY A 177
PHE A 261
 None
 0.91A 3ko0M-3gwqA:
undetectable
3ko0P-3gwqA:
undetectable		 3ko0M-3gwqA:
12.68
3ko0P-3gwqA:
12.68
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.
3hbz PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13201
(PCMD) 		4 GLY A 199
GLY A 345
CYH A 177
PHE A 133
 None
 0.84A 3ko0M-3hbzA:
undetectable
3ko0P-3hbzA:
undetectable		 3ko0M-3hbzA:
14.96
3ko0P-3hbzA:
14.96
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.
3ju7 PUTATIVE
PLP-DEPENDENT
AMINOTRANSFERASE

(Bacillus cereus) 		PF01041
(DegT_DnrJ_EryC1) 		4 GLY A  98
GLY A  77
MET A 228
PHE A 230
 None
 0.89A 3ko0M-3ju7A:
0.0
3ko0P-3ju7A:
undetectable		 3ko0M-3ju7A:
16.29
3ko0P-3ju7A:
16.29
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.
3kst ENDO-1,4-BETA-XYLANA
SE

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		4 GLY A  64
GLY A 276
PHE A 117
PHE A 139
 None
 0.86A 3ko0M-3kstA:
undetectable
3ko0P-3kstA:
undetectable		 3ko0M-3kstA:
15.03
3ko0P-3kstA:
15.03
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.
3nyo G PROTEIN-COUPLED
RECEPTOR KINASE 6

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		4 GLY A 269
GLY A 193
MET A 278
PHE A 283
 None
AMP  A 577 ( 3.7A)
None
None
 0.72A 3ko0M-3nyoA:
2.5
3ko0P-3nyoA:
2.5		 3ko0M-3nyoA:
13.49
3ko0P-3nyoA:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r0z D-SERINE DEHYDRATASE

(Salmonella
enterica) 		PF00291
(PALP) 		4 GLY A 181
GLY A 204
CYH A 231
PHE A 232
 None
 0.72A 3ko0M-3r0zA:
undetectable
3ko0P-3r0zA:
undetectable		 3ko0M-3r0zA:
12.10
3ko0P-3r0zA:
12.10
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.
3ss7 D-SERINE DEHYDRATASE

(Escherichia
coli) 		PF00291
(PALP) 		4 GLY X 183
GLY X 206
CYH X 233
PHE X 234
 None
 0.82A 3ko0M-3ss7X:
undetectable
3ko0P-3ss7X:
undetectable		 3ko0M-3ss7X:
12.95
3ko0P-3ss7X:
12.95
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.
3t5v NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 PHE B  16
CYH B  65
PHE B  68
PHE B  90
 None
 0.85A 3ko0M-3t5vB:
undetectable
3ko0P-3t5vB:
undetectable		 3ko0M-3t5vB:
13.08
3ko0P-3t5vB:
13.08
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.
3uai H/ACA
RIBONUCLEOPROTEIN
COMPLEX SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF04410
(Gar1) 		4 PHE C 109
GLY C  41
GLY C 106
CYH C  94
 None
 0.78A 3ko0M-3uaiC:
undetectable
3ko0P-3uaiC:
undetectable		 3ko0M-3uaiC:
18.42
3ko0P-3uaiC:
18.42
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.
3va7 KLLA0E08119P

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 GLY A1309
GLY A1622
PHE A1331
PHE A1271
 None
 0.97A 3ko0M-3va7A:
undetectable
3ko0P-3va7A:
undetectable		 3ko0M-3va7A:
5.82
3ko0P-3va7A:
5.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aq2 HOMOGENTISATE
1,2-DIOXYGENASE

(Pseudomonas
putida) 		PF04209
(HgmA) 		4 PHE A 278
GLY A 218
GLY A 282
PHE A 225
 None
 0.96A 3ko0M-4aq2A:
undetectable
3ko0P-4aq2A:
undetectable		 3ko0M-4aq2A:
12.24
3ko0P-4aq2A:
12.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aw2 SERINE/THREONINE-PRO
TEIN KINASE MRCK
ALPHA

(Rattus
norvegicus) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		4 PHE A  88
GLY A  86
CYH A 121
PHE A 122
 EDO  A1419 ( 4.8A)
None
None
None
 0.93A 3ko0M-4aw2A:
1.3
3ko0P-4aw2A:
1.1		 3ko0M-4aw2A:
16.27
3ko0P-4aw2A:
16.27
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.
4bqm GLUTAMINASE LIVER
ISOFORM,
MITOCHONDRIAL

(Homo sapiens) 		PF04960
(Glutaminase) 		4 GLY A 430
GLY A 203
PHE A 168
PHE A 450
 None
 0.88A 3ko0M-4bqmA:
undetectable
3ko0P-4bqmA:
undetectable		 3ko0M-4bqmA:
14.58
3ko0P-4bqmA:
14.58
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.
4cp8 ALLOPHANATE
HYDROLASE

(Pseudomonas sp.
ADP) 		PF01425
(Amidase) 		4 PHE A 196
GLY A 164
GLY A 412
PHE A 156
 None
 0.96A 3ko0M-4cp8A:
undetectable
3ko0P-4cp8A:
undetectable		 3ko0M-4cp8A:
9.92
3ko0P-4cp8A:
9.92
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.
4cw5 DFNA

(Bacillus
velezensis) 		PF03060
(NMO) 		4 GLY A 382
GLY A 355
CYH A 493
PHE A 317
 None
 0.88A 3ko0M-4cw5A:
undetectable
3ko0P-4cw5A:
undetectable		 3ko0M-4cw5A:
12.31
3ko0P-4cw5A:
12.31
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.
4doe 1,4-BETA-GLUCANASE

(Caldicellulosiruptor
bescii) 		PF00759
(Glyco_hydro_9) 		4 PHE A 383
GLY A 424
GLY A 427
PHE A 387
 None
 0.97A 3ko0M-4doeA:
undetectable
3ko0P-4doeA:
undetectable		 3ko0M-4doeA:
10.38
3ko0P-4doeA:
10.38
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.
4e4j ARGININE DEIMINASE

(Mycoplasma
penetrans) 		PF02274
(Amidinotransf) 		4 PHE A 262
GLY A 272
GLY A 258
PHE A 326
 None
 0.97A 3ko0M-4e4jA:
undetectable
3ko0P-4e4jA:
undetectable		 3ko0M-4e4jA:
12.47
3ko0P-4e4jA:
12.47
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.
4ehj PHOSPHOGLYCERATE
KINASE

(Francisella
tularensis) 		PF00162
(PGK) 		4 GLY A 345
GLY A 190
PHE A 374
PHE A 141
 None
 0.93A 3ko0M-4ehjA:
undetectable
3ko0P-4ehjA:
undetectable		 3ko0M-4ehjA:
13.62
3ko0P-4ehjA:
13.62
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.
4ehj PHOSPHOGLYCERATE
KINASE

(Francisella
tularensis) 		PF00162
(PGK) 		4 GLY A 345
GLY A 191
PHE A 374
PHE A 141
 None
 0.86A 3ko0M-4ehjA:
undetectable
3ko0P-4ehjA:
undetectable		 3ko0M-4ehjA:
13.62
3ko0P-4ehjA:
13.62
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.
4epu ANGIOPOIETIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 PHE A 337
GLY A 459
GLY A 333
PHE A 425
 None
 0.84A 3ko0M-4epuA:
undetectable
3ko0P-4epuA:
undetectable		 3ko0M-4epuA:
16.11
3ko0P-4epuA:
16.11
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.
4fzw 1,2-EPOXYPHENYLACETY
L-COA ISOMERASE

(Escherichia
coli) 		PF00378
(ECH_1) 		4 PHE C  27
GLY C 114
GLY C  55
PHE C  87
 None
 0.82A 3ko0M-4fzwC:
undetectable
3ko0P-4fzwC:
undetectable		 3ko0M-4fzwC:
14.39
3ko0P-4fzwC:
14.39
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.
4gt6 CELL SURFACE PROTEIN

(Faecalibacterium
prausnitzii) 		PF13306
(LRR_5) 		4 GLY A 132
GLY A  81
CYH A 139
PHE A 138
 None
 0.93A 3ko0M-4gt6A:
undetectable
3ko0P-4gt6A:
undetectable		 3ko0M-4gt6A:
14.72
3ko0P-4gt6A:
14.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gys ALLOPHANATE
HYDROLASE

(Granulibacter
bethesdensis) 		PF01425
(Amidase) 		4 PHE A 179
GLY A 147
GLY A 391
PHE A 139
 None
 0.96A 3ko0M-4gysA:
undetectable
3ko0P-4gysA:
undetectable		 3ko0M-4gysA:
9.26
3ko0P-4gysA:
9.26
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.
4gz7 DIHYDROPYRIMIDINASE

(Tetraodon
nigroviridis) 		PF01979
(Amidohydro_1) 		4 GLY A  58
GLY A  89
PHE A 382
PHE A 384
 None
 0.94A 3ko0M-4gz7A:
undetectable
3ko0P-4gz7A:
undetectable		 3ko0M-4gz7A:
11.25
3ko0P-4gz7A:
11.25
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.
4hrt GLOBIN-2 A CHAIN

(Scapharca
inaequivalvis) 		PF00042
(Globin) 		4 PHE A 111
GLY A 112
GLY A 143
PHE A  51
 HEM  A 201 (-3.8A)
None
None
HEM  A 201 (-4.1A)
 0.93A 3ko0M-4hrtA:
undetectable
3ko0P-4hrtA:
undetectable		 3ko0M-4hrtA:
22.88
3ko0P-4hrtA:
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.
4iov CAPSID PROTEIN VP1

(Adeno-associated
virus) 		PF00740
(Parvo_coat) 		4 PHE A 645
GLY A 271
GLY A 367
PHE A 402
 None
 0.90A 3ko0M-4iovA:
undetectable
3ko0P-4iovA:
undetectable		 3ko0M-4iovA:
9.57
3ko0P-4iovA:
9.57
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.
4ng4 PHOSPHOGLYCERATE
KINASE

(Coxiella
burnetii) 		PF00162
(PGK) 		4 GLY A 348
GLY A 193
PHE A 377
PHE A 144
 ADP  A 402 ( 3.7A)
None
None
None
 0.80A 3ko0M-4ng4A:
undetectable
3ko0P-4ng4A:
undetectable		 3ko0M-4ng4A:
13.93
3ko0P-4ng4A:
13.93
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.
4o4x TBPB

(Glaesserella
parasuis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 PHE A 529
GLY A 530
GLY A 501
PHE A 457
 None
 0.97A 3ko0M-4o4xA:
undetectable
3ko0P-4o4xA:
undetectable		 3ko0M-4o4xA:
11.09
3ko0P-4o4xA:
11.09
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.
4p8b TRAP-TYPE
TRANSPORTER,
PERIPLASMIC
COMPONENT

(Cupriavidus
necator) 		PF03480
(DctP) 		4 PHE A 246
GLY A  96
GLY A  46
PHE A 136
 None
 0.67A 3ko0M-4p8bA:
undetectable
3ko0P-4p8bA:
undetectable		 3ko0M-4p8bA:
15.50
3ko0P-4p8bA:
15.50
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.
4r72 ABC-TYPE FE3+
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Actinobacillus
pleuropneumoniae) 		PF13343
(SBP_bac_6) 		4 GLY A  59
GLY A 105
PHE A 251
PHE A 248
 None
 0.94A 3ko0M-4r72A:
undetectable
3ko0P-4r72A:
undetectable		 3ko0M-4r72A:
16.67
3ko0P-4r72A:
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.
4r9j FICOLIN-2

(Homo sapiens) 		no annotation 4 PHE G 130
GLY G 252
GLY G 126
PHE G 218
 None
 0.91A 3ko0M-4r9jG:
undetectable
3ko0P-4r9jG:
undetectable		 3ko0M-4r9jG:
16.59
3ko0P-4r9jG:
16.59
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.
4uw2 CSM1

(Thermococcus
onnurineus) 		PF01966
(HD) 		4 GLY A 587
GLY A 293
PHE A 544
PHE A 123
 None
 0.90A 3ko0M-4uw2A:
undetectable
3ko0P-4uw2A:
undetectable		 3ko0M-4uw2A:
9.22
3ko0P-4uw2A:
9.22
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.
4wjl INACTIVE DIPEPTIDYL
PEPTIDASE 10

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 PHE A 398
GLY A 421
GLY A 393
PHE A 606
 None
 0.95A 3ko0M-4wjlA:
undetectable
3ko0P-4wjlA:
undetectable		 3ko0M-4wjlA:
8.90
3ko0P-4wjlA:
8.90
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.
4zox RIBOSOME ASSEMBLY
PROTEIN SQT1

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A 117
GLY A 122
GLY A 142
CYH A 115
 None
 0.91A 3ko0M-4zoxA:
undetectable
3ko0P-4zoxA:
undetectable		 3ko0M-4zoxA:
14.79
3ko0P-4zoxA:
14.79
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.
5a1k ADSEVERIN

(Homo sapiens) 		PF00626
(Gelsolin) 		4 PHE A 283
GLY A 298
PHE A 272
PHE A 344
 None
 0.80A 3ko0M-5a1kA:
0.9
3ko0P-5a1kA:
0.9		 3ko0M-5a1kA:
17.30
3ko0P-5a1kA:
17.30
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.
5a1m ADSEVERIN

(Homo sapiens) 		PF00626
(Gelsolin) 		4 PHE A 283
GLY A 298
PHE A 272
PHE A 344
 None
 0.87A 3ko0M-5a1mA:
undetectable
3ko0P-5a1mA:
undetectable		 3ko0M-5a1mA:
22.41
3ko0P-5a1mA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ail POLY [ADP-RIBOSE]
POLYMERASE 9

(Homo sapiens) 		PF01661
(Macro) 		4 GLY A 398
GLY A 311
PHE A 431
PHE A 444
 None
 0.88A 3ko0M-5ailA:
undetectable
3ko0P-5ailA:
undetectable		 3ko0M-5ailA:
19.13
3ko0P-5ailA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bt8 PHOSPHOGLYCERATE
KINASE

(Acinetobacter
baumannii) 		PF00162
(PGK) 		4 GLY A 350
GLY A 191
PHE A 379
PHE A 141
 None
 0.91A 3ko0M-5bt8A:
undetectable
3ko0P-5bt8A:
undetectable		 3ko0M-5bt8A:
14.96
3ko0P-5bt8A:
14.96
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.
5by6 THYMIDYLATE SYNTHASE

(Trichinella
spiralis) 		PF00303
(Thymidylat_synt) 		4 GLY A 130
GLY A 126
CYH A 191
PHE A 192
 None
 0.96A 3ko0M-5by6A:
undetectable
3ko0P-5by6A:
0.6		 3ko0M-5by6A:
15.28
3ko0P-5by6A:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cow PUTATIVE
UNCHARACTERIZED
PROTEIN

(Caenorhabditis
remanei) 		no annotation 4 PHE A 309
GLY A 347
PHE A 340
PHE A 442
 None
 0.90A 3ko0M-5cowA:
undetectable
3ko0P-5cowA:
undetectable		 3ko0M-5cowA:
17.81
3ko0P-5cowA:
17.81
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.
5h4e BETA 1-3 GLUCANASE

(Clostridium
beijerinckii) 		no annotation 4 PHE A 507
GLY A 505
GLY A 493
PHE A 567
 None
 0.94A 3ko0M-5h4eA:
undetectable
3ko0P-5h4eA:
undetectable		 3ko0M-5h4eA:
14.04
3ko0P-5h4eA:
14.04
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 PHE A 319
GLY A 320
GLY A 282
PHE A  22
 None
 0.97A 3ko0M-5i2tA:
undetectable
3ko0P-5i2tA:
undetectable		 3ko0M-5i2tA:
6.74
3ko0P-5i2tA:
6.74
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 GLY A1309
GLY A1622
PHE A1331
PHE A1271
 None
 0.96A 3ko0M-5i8iA:
undetectable
3ko0P-5i8iA:
undetectable		 3ko0M-5i8iA:
4.13
3ko0P-5i8iA:
4.13
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.
5jpe SERINE/THREONINE-PRO
TEIN PHOSPHATASE

(Candida
albicans) 		PF00149
(Metallophos)
PF16891
(STPPase_N) 		4 GLY A 339
GLY A 228
PHE A 406
PHE A 400
 None
 0.86A 3ko0M-5jpeA:
undetectable
3ko0P-5jpeA:
undetectable		 3ko0M-5jpeA:
18.95
3ko0P-5jpeA:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5knn ALANINE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF01411
(tRNA-synt_2c) 		4 PHE A  41
GLY A  79
GLY A 319
PHE A  97
 None
 0.80A 3ko0M-5knnA:
undetectable
3ko0P-5knnA:
undetectable		 3ko0M-5knnA:
13.11
3ko0P-5knnA:
13.11
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.
5nks DIHYDROPYRIMIDINASE-
RELATED PROTEIN 4

(Homo sapiens) 		no annotation 4 GLY A  68
GLY A  99
PHE A 392
PHE A 394
 GLY  A  68 ( 0.0A)
GLY  A  99 ( 0.0A)
PHE  A 392 ( 1.3A)
PHE  A 394 ( 1.3A)
 0.96A 3ko0M-5nksA:
undetectable
3ko0P-5nksA:
undetectable		 3ko0M-5nksA:
11.01
3ko0P-5nksA:
11.01
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.
5nri D-ALANINE--D-ALANINE
LIGASE

(Burkholderia
pseudomallei) 		no annotation 4 PHE A 250
GLY A 254
GLY A  92
PHE A 273
 None
 0.85A 3ko0M-5nriA:
undetectable
3ko0P-5nriA:
undetectable		 3ko0M-5nriA:
18.81
3ko0P-5nriA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o27 NEUROGLOBIN

(Mus musculus) 		no annotation 4 GLY A 110
GLY A 138
MET A  69
PHE A  28
 None
 0.97A 3ko0M-5o27A:
undetectable
3ko0P-5o27A:
undetectable		 3ko0M-5o27A:
18.37
3ko0P-5o27A:
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.
5omc REPLICATION FACTOR A
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A  11
GLY A   9
GLY A  27
PHE A 119
 None
 0.82A 3ko0M-5omcA:
undetectable
3ko0P-5omcA:
undetectable		 3ko0M-5omcA:
16.67
3ko0P-5omcA:
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.
5swj PROBABLE ATP
SYNTHASE SPAL/MXIB

(Shigella
flexneri) 		PF00006
(ATP-synt_ab) 		4 GLY A 139
GLY A 177
PHE A 167
PHE A 339
 None
 0.71A 3ko0M-5swjA:
undetectable
3ko0P-5swjA:
undetectable		 3ko0M-5swjA:
14.41
3ko0P-5swjA:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b0t FASCIN

(Homo sapiens) 		no annotation 4 GLY A 390
GLY A 472
CYH A 456
PHE A 455
 None
 0.94A 3ko0M-6b0tA:
undetectable
3ko0P-6b0tA:
undetectable		 3ko0M-6b0tA:
24.53
3ko0P-6b0tA:
24.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eub ANGIOPOIETIN-RELATED
PROTEIN 4

(Homo sapiens) 		no annotation 4 PHE A 237
GLY A 361
GLY A 233
PHE A 326
 None
 0.82A 3ko0M-6eubA:
undetectable
3ko0P-6eubA:
undetectable		 3ko0M-6eubA:
18.87
3ko0P-6eubA:
18.87