SIMILAR PATTERNS OF AMINO ACIDS FOR 5VOO_E_C2FE3001

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.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		7 GLU A   6
ASP A  43
LEU A 122
GLY A 196
SER A 198
ARG A 207
ILE A 227
 None
 0.63A 5vooE-1f6yA:
29.1		 5vooE-1f6yA:
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.
1htp H-PROTEIN

(Pisum sativum) 		PF01597
(GCV_H) 		5 GLU A  14
GLY A  55
VAL A  38
SER A  12
ILE A  27
 OSS  A 132 (-3.5A)
None
None
None
OSS  A 132 ( 4.2A)
 1.16A 5vooE-1htpA:
undetectable		 5vooE-1htpA:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jqo PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Zea mays) 		PF00311
(PEPcase) 		5 ARG A 641
GLY A 650
VAL A 794
LEU A 871
SER A 658
 None
 1.10A 5vooE-1jqoA:
6.6		 5vooE-1jqoA:
15.96
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		5 GLU A 301
LYS A 353
GLY A 260
SER A 311
ILE A 285
 None
 1.05A 5vooE-1kb0A:
undetectable		 5vooE-1kb0A:
18.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mro METHYL-COENZYME M
REDUCTASE

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 GLY A 418
VAL A 308
LEU A 305
GLY A 410
ILE A 491
 None
 1.19A 5vooE-1mroA:
undetectable		 5vooE-1mroA:
20.66
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.
1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE

(Methanocaldococcus
jannaschii) 		PF01862
(PvlArgDC) 		5 GLU A 111
VAL A 150
LEU A 153
ARG A  50
ILE A  80
 None
 1.20A 5vooE-1n2mA:
undetectable		 5vooE-1n2mA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		6 MET A 175
VAL A  48
LEU A  94
GLY A 141
SER A 139
ILE A 153
 None
 1.35A 5vooE-1ns3A:
undetectable		 5vooE-1ns3A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sd5 PUTATIVE
ANTITERMINATOR

(Mycobacterium
tuberculosis) 		PF00072
(Response_reg)
PF03861
(ANTAR) 		5 GLU A 170
ARG A 131
VAL A 195
LEU A 196
GLY A 160
 None
None
IOD  A 415 ( 4.0A)
None
None
 1.17A 5vooE-1sd5A:
2.8		 5vooE-1sd5A:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Arabidopsis
thaliana) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 GLU A 490
ARG A 493
VAL A 743
LEU A 747
GLY A 734
 MET  A 772 (-3.2A)
None
None
None
MET  A 772 (-3.2A)
 1.14A 5vooE-1u1hA:
8.3		 5vooE-1u1hA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wgv KIAA1068 PROTEIN

(Homo sapiens) 		PF04969
(CS) 		5 MET A  70
VAL A  33
LEU A  31
SER A  52
ILE A  56
 None
 1.20A 5vooE-1wgvA:
undetectable		 5vooE-1wgvA:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT

(Pseudomonas
putida) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 GLU A  79
VAL A  62
LEU A 108
GLY A  72
ILE A  76
 None
 1.19A 5vooE-1wveA:
undetectable		 5vooE-1wveA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xa0 PUTATIVE NADPH
DEPENDENT
OXIDOREDUCTASES

(Geobacillus
stearothermophilus) 		PF00107
(ADH_zinc_N) 		5 ARG A 227
GLY A 226
VAL A 177
LEU A 170
GLY A 163
 SO4  A 330 (-4.5A)
None
None
None
None
 1.19A 5vooE-1xa0A:
2.5		 5vooE-1xa0A:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xdi RV3303C-LPDA

(Mycobacterium
tuberculosis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 153
VAL A 112
LEU A 105
GLY A  38
ARG A 173
 FAD  A 999 (-3.3A)
None
None
None
None
 1.10A 5vooE-1xdiA:
undetectable		 5vooE-1xdiA:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yio RESPONSE REGULATORY
PROTEIN

(Pseudomonas
fluorescens) 		PF00072
(Response_reg)
PF00196
(GerE) 		5 ARG A  44
GLY A  50
GLY A  98
ARG A 130
ILE A  79
 None
HG  A 211 (-4.1A)
None
None
None
 1.05A 5vooE-1yioA:
2.8		 5vooE-1yioA:
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.
1ztm FUSION GLYCOPROTEIN

(Human
respirovirus 3) 		PF00523
(Fusion_gly) 		5 GLY A 225
VAL A 269
LEU A  86
GLY A 219
ILE A 218
 None
 1.19A 5vooE-1ztmA:
undetectable		 5vooE-1ztmA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bi7 UDP-GALACTOPYRANOSE
MUTASE

(Klebsiella
pneumoniae) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		6 GLY A 197
VAL A 213
LEU A 215
GLY A  39
SER A  42
ILE A 202
 None
None
None
None
FAD  A1385 ( 3.8A)
None
 1.35A 5vooE-2bi7A:
undetectable		 5vooE-2bi7A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d52 PENTAKETIDE CHROMONE
SYNTHASE

(Aloe
arborescens) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 GLU A 205
GLY A 229
MET A 276
GLY A 176
SER A 355
 None
 1.05A 5vooE-2d52A:
undetectable		 5vooE-2d52A:
23.22
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.
2d7d UVRABC SYSTEM
PROTEIN B

(Bacillus
subtilis) 		PF00271
(Helicase_C)
PF02151
(UVR)
PF04851
(ResIII)
PF12344
(UvrB) 		5 GLY A 429
VAL A 448
LEU A 516
GLY A 436
ILE A 435
 None
 1.11A 5vooE-2d7dA:
3.1		 5vooE-2d7dA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g39 ACETYL-COA HYDROLASE

(Pseudomonas
aeruginosa) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 GLU A 288
GLY A 308
VAL A 226
GLY A 263
ILE A 264
 ACY  A 901 (-2.6A)
None
None
None
ACY  A 901 (-4.1A)
 1.08A 5vooE-2g39A:
undetectable		 5vooE-2g39A:
23.25
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.
2glf PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Thermotoga
maritima) 		PF02127
(Peptidase_M18) 		5 GLY A 249
LYS A  33
VAL A 356
LEU A 394
SER A 433
 None
 1.17A 5vooE-2glfA:
undetectable		 5vooE-2glfA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		5 GLY A 282
VAL A 298
LEU A 277
GLY A 209
ILE A 210
 None
 1.17A 5vooE-2gnpA:
undetectable		 5vooE-2gnpA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i5g AMIDOHYDROLASE

(Pseudomonas
aeruginosa) 		PF01244
(Peptidase_M19) 		5 GLY A  92
VAL A 288
LEU A  35
GLY A 248
SER A 180
 None
 1.16A 5vooE-2i5gA:
6.5		 5vooE-2i5gA:
24.09
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.
2qvb HALOALKANE
DEHALOGENASE 3

(Mycobacterium
tuberculosis) 		PF00561
(Abhydrolase_1) 		5 GLU A 282
MET A 132
VAL A 106
GLY A 284
ILE A 283
 None
 1.18A 5vooE-2qvbA:
undetectable		 5vooE-2qvbA:
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.
2v4j SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT BETA

(Desulfovibrio
vulgaris) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 ARG B 336
GLY B 338
GLY B 202
SER B 199
ILE B 201
 SH0  A 503 (-3.0A)
None
None
None
None
 1.12A 5vooE-2v4jB:
undetectable		 5vooE-2v4jB:
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.
2wja PUTATIVE ACID
PHOSPHATASE WZB

(Escherichia
coli) 		PF01451
(LMWPc) 		5 GLY A  42
ASP A 119
VAL A 131
LEU A 135
SER A  89
 None
PO4  A1148 (-3.3A)
None
None
None
 1.17A 5vooE-2wjaA:
undetectable		 5vooE-2wjaA:
22.92
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLU A 139
GLY A 150
VAL A  35
LEU A  23
GLY A  67
 None
 1.18A 5vooE-2wtbA:
undetectable		 5vooE-2wtbA:
19.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		8 GLU A   7
LYS A  14
ASP A  44
LEU A 123
GLY A 197
SER A 199
ARG A 208
ILE A 228
 C2F  A3000 ( 4.1A)
None
C2F  A3000 ( 4.5A)
None
C2F  A3000 (-3.6A)
GOL  A1270 ( 3.9A)
C2F  A3000 ( 2.6A)
C2F  A3000 (-4.6A)
 0.91A 5vooE-2ycjA:
29.8		 5vooE-2ycjA:
30.13
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.
2yjv REGULATOR OF
RIBONUCLEASE
ACTIVITY A

(Escherichia
coli) 		PF03737
(RraA-like) 		6 GLU A  43
ARG A  71
GLY A 118
ASP A  44
GLY A  65
SER A  68
 None
 1.49A 5vooE-2yjvA:
undetectable		 5vooE-2yjvA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yv5 YJEQ PROTEIN

(Aquifex
aeolicus) 		PF03193
(RsgA_GTPase) 		5 GLY A 208
VAL A  50
LEU A  10
GLY A  20
ILE A  19
 None
 1.16A 5vooE-2yv5A:
undetectable		 5vooE-2yv5A:
23.24
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.
3abg BILIRUBIN OXIDASE

(Albifimbria
verrucaria) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLU A 275
ASP A 227
VAL A 315
ARG A 412
ILE A 271
 None
 0.97A 5vooE-3abgA:
undetectable		 5vooE-3abgA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aja PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycolicibacterium
smegmatis) 		PF01083
(Cutinase) 		5 ARG A 193
MET A 158
VAL A  79
GLY A 183
ILE A 185
 None
 1.12A 5vooE-3ajaA:
undetectable		 5vooE-3ajaA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aqg ZYMOGEN GRANULE
PROTEIN 16 HOMOLOG B

(Homo sapiens) 		PF01419
(Jacalin) 		5 GLY A 102
VAL A 122
LEU A 164
GLY A 180
ILE A 179
 None
 1.01A 5vooE-3aqgA:
undetectable		 5vooE-3aqgA:
17.94
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.
3av6 DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		5 GLY A 474
MET A 508
VAL A 428
GLY A 484
ILE A 483
 None
 1.12A 5vooE-3av6A:
undetectable		 5vooE-3av6A:
12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		5 GLY A 294
VAL A  32
LEU A  34
GLY A 289
ILE A 258
 None
 1.08A 5vooE-3b05A:
6.9		 5vooE-3b05A:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		6 GLU A 320
ASP A 358
LEU A 437
GLY A 505
SER A 507
ILE A 536
 None
 0.64A 5vooE-3bolA:
22.5		 5vooE-3bolA:
19.93
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.
3c5y RIBOSE/GALACTOSE
ISOMERASE

(Novosphingobium
aromaticivorans) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		5 GLU A   8
GLY A  77
LEU A 127
SER A  10
ILE A   7
 None
 1.17A 5vooE-3c5yA:
undetectable		 5vooE-3c5yA:
24.03
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.
3d7l LIN1944 PROTEIN

(Listeria
innocua) 		PF13561
(adh_short_C2) 		5 GLY A 122
VAL A 174
LEU A 157
GLY A 112
ILE A 113
 None
 1.12A 5vooE-3d7lA:
3.4		 5vooE-3d7lA:
25.33
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.
3dbk ELASTASE

(Pseudomonas
aeruginosa) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 GLU A 172
ASP A 168
GLY A 187
ARG A 179
ILE A 186
 CA  A 303 (-2.8A)
None
None
None
None
 1.02A 5vooE-3dbkA:
undetectable		 5vooE-3dbkA:
19.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ebv CHINITASE A

(Streptomyces
coelicolor) 		PF00704
(Glyco_hydro_18) 		5 GLY A   9
ASP A  31
LEU A 294
GLY A 288
SER A 284
 None
 1.10A 5vooE-3ebvA:
9.4		 5vooE-3ebvA:
23.64
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.
3eoz PUTATIVE
PHOSPHOGLYCERATE
MUTASE

(Plasmodium
falciparum) 		PF00300
(His_Phos_1) 		5 GLY A 183
VAL A  69
LEU A  64
GLY A  57
ILE A  87
 None
 1.08A 5vooE-3eozA:
undetectable		 5vooE-3eozA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gfb L-THREONINE
3-DEHYDROGENASE

(Thermococcus
kodakarensis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 164
ASP A 159
VAL A 110
GLY A 290
ILE A 291
 None
 1.19A 5vooE-3gfbA:
undetectable		 5vooE-3gfbA:
24.41
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.
3gqs ADENYLATE
CYCLASE-LIKE PROTEIN

(Chlamydia
trachomatis) 		PF16697
(Yop-YscD_cpl) 		5 GLY A  70
VAL A   9
LEU A   7
GLY A  30
ILE A  45
 None
 1.17A 5vooE-3gqsA:
undetectable		 5vooE-3gqsA:
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.
3hbn UDP-SUGAR HYDROLASE

(Campylobacter
jejuni) 		no annotation 5 GLU A  85
ASP A  84
LEU A  53
SER A  98
ILE A  80
 None
 1.17A 5vooE-3hbnA:
2.1		 5vooE-3hbnA:
23.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		5 ASP A 396
MET A 429
VAL A 478
GLY A 592
ILE A 356
 THH  A 642 ( 4.7A)
None
None
None
None
 1.10A 5vooE-3k13A:
38.5		 5vooE-3k13A:
34.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		9 GLU A 358
GLY A 364
ASP A 396
MET A 429
VAL A 478
GLY A 558
SER A 560
ARG A 573
ILE A 593
 THH  A 642 ( 3.5A)
THH  A 642 (-3.7A)
THH  A 642 ( 4.7A)
None
None
THH  A 642 (-3.3A)
K  A 644 ( 3.4A)
THH  A 642 (-3.1A)
THH  A 642 (-4.2A)
 0.39A 5vooE-3k13A:
38.5		 5vooE-3k13A:
34.19
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.
3sjn MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 302
VAL A 122
LEU A 126
GLY A 280
ILE A 108
 None
 1.16A 5vooE-3sjnA:
8.1		 5vooE-3sjnA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v4v INTEGRIN BETA-7

(Homo sapiens) 		PF00362
(Integrin_beta) 		5 GLU B 240
GLY B 241
ASP B 237
GLY B 234
SER B 142
 0DU  B4000 (-3.3A)
None
CA  B2003 ( 3.6A)
0DU  B4000 (-3.4A)
MG  B2001 ( 2.9A)
 1.17A 5vooE-3v4vB:
2.3		 5vooE-3v4vB:
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.
3v4v INTEGRIN BETA-7

(Homo sapiens) 		PF00362
(Integrin_beta) 		5 GLU B 240
GLY B 241
LEU B 193
GLY B 234
SER B 142
 0DU  B4000 (-3.3A)
None
None
0DU  B4000 (-3.4A)
MG  B2001 ( 2.9A)
 1.18A 5vooE-3v4vB:
2.3		 5vooE-3v4vB:
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.
3va8 PROBABLE DEHYDRATASE

(Fusarium
graminearum) 		PF13378
(MR_MLE_C) 		5 GLY A  53
LYS A 402
LEU A 383
GLY A  49
ILE A  38
 None
 1.09A 5vooE-3va8A:
8.9		 5vooE-3va8A:
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.
3vnk XYLOSE ISOMERASE
DOMAIN PROTEIN TIM
BARREL

([Clostridium]
cellulolyticum) 		PF01261
(AP_endonuc_2) 		5 GLU A 227
GLY A 196
VAL A 241
GLY A 229
ILE A 228
 None
 1.18A 5vooE-3vnkA:
8.2		 5vooE-3vnkA:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zf8 MANNAN POLYMERASE
COMPLEXES SUBUNIT
MNN9

(Saccharomyces
cerevisiae) 		PF03452
(Anp1) 		5 GLU A 364
VAL A 379
LEU A 333
GLY A 337
ARG A 209
 None
None
None
None
GDP  A1395 (-3.6A)
 1.20A 5vooE-3zf8A:
undetectable		 5vooE-3zf8A:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a2w RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16739
(CARD_2) 		5 GLY A 361
VAL A 297
LEU A 299
SER A 336
ILE A 341
 None
 1.20A 5vooE-4a2wA:
undetectable		 5vooE-4a2wA:
16.54
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.
4beq ALANINE RACEMASE 2

(Vibrio cholerae) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 GLU A 186
GLY A 183
VAL A 198
GLY A 141
ILE A 190
 None
 1.13A 5vooE-4beqA:
8.5		 5vooE-4beqA:
23.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		8 GLU A 376
GLY A 382
ASP A 414
VAL A 496
GLY A 576
SER A 578
ARG A 591
ILE A 611
 THG  A1652 (-3.5A)
THG  A1652 (-3.8A)
None
None
THG  A1652 (-3.6A)
THG  A1652 (-4.2A)
THG  A1652 (-3.0A)
THG  A1652 (-4.2A)
 0.48A 5vooE-4cczA:
38.6		 5vooE-4cczA:
16.87
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.
4e4r PHOSPHATE
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF01515
(PTA_PTB) 		5 GLY A 177
VAL A 133
LEU A 299
GLY A 151
ILE A 169
 EDO  A 502 (-3.7A)
None
None
None
None
 1.16A 5vooE-4e4rA:
undetectable		 5vooE-4e4rA:
23.53
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.
4e6e CELL DIVISION
PROTEIN FTSZ

(Thermobifida
fusca) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A 109
VAL A  89
LEU A  90
GLY A  15
ILE A  40
 None
 1.17A 5vooE-4e6eA:
undetectable		 5vooE-4e6eA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fc7 PEROXISOMAL
2,4-DIENOYL-COA
REDUCTASE

(Homo sapiens) 		PF13561
(adh_short_C2) 		6 ARG A 218
GLY A  10
VAL A 249
GLY A  41
SER A  38
ILE A  40
 None
None
None
None
NAP  A 401 (-2.7A)
NAP  A 401 (-4.0A)
 1.47A 5vooE-4fc7A:
2.9		 5vooE-4fc7A:
23.82
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.
4fgw GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD(+)] 1

(Saccharomyces
cerevisiae) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		5 GLY A 298
VAL A 347
GLY A 280
SER A 287
ILE A 240
 None
 1.17A 5vooE-4fgwA:
undetectable		 5vooE-4fgwA:
21.10
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.
4i04 CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)

(Schistosoma
mansoni) 		PF00112
(Peptidase_C1)
PF08127
(Propeptide_C1) 		5 LYS A 233
LEU A 125
GLY A 218
SER A 220
ILE A 322
 None
 1.11A 5vooE-4i04A:
undetectable		 5vooE-4i04A:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i05 CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)

(Schistosoma
mansoni) 		PF00112
(Peptidase_C1) 		5 LYS A 233
LEU A 125
GLY A 218
SER A 220
ILE A 322
 None
 1.10A 5vooE-4i05A:
undetectable		 5vooE-4i05A:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ifd EXOSOME COMPLEX
COMPONENT RRP43

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH) 		5 GLU C 339
GLY C 224
GLY C 298
ARG C  44
ILE C 343
 None
 1.11A 5vooE-4ifdC:
undetectable		 5vooE-4ifdC:
22.42
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.
4j7h EVAA 2,3-DEHYDRATASE

(Amycolatopsis
orientalis) 		PF03559
(Hexose_dehydrat) 		5 GLU A 361
VAL A  91
LEU A  89
GLY A 192
ARG A 454
 None
 1.17A 5vooE-4j7hA:
undetectable		 5vooE-4j7hA:
23.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jer HEMOPHORE HASA

(Yersinia pestis) 		PF06438
(HasA) 		5 GLY A 149
LEU A 109
GLY A  58
SER A  60
ILE A  57
 None
 0.95A 5vooE-4jerA:
undetectable		 5vooE-4jerA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k46 ADENYLATE KINASE

(Photobacterium
profundum) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 ARG A 167
LYS A 160
VAL A 205
GLY A  14
ARG A  36
 AMP  A 302 (-4.2A)
None
None
ADP  A 301 (-3.5A)
AMP  A 302 (-2.5A)
 1.15A 5vooE-4k46A:
undetectable		 5vooE-4k46A:
22.92
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.
4mg4 PHOSPHONOMUTASE

(Burkholderia
cenocepacia) 		PF13714
(PEP_mutase) 		5 ARG A  11
VAL A  74
LEU A  70
ARG A 137
ILE A 109
 None
 1.09A 5vooE-4mg4A:
5.0		 5vooE-4mg4A:
25.78
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.
4mgg MUCONATE LACTONIZING
ENZYME

(Labrenzia
aggregata) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLU A 332
GLY A 333
VAL A  11
LEU A  13
ILE A 355
 None
 1.17A 5vooE-4mggA:
6.9		 5vooE-4mggA:
21.02
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.
4nar PUTATIVE URONATE
ISOMERASE

(Thermotoga
maritima) 		PF09861
(DUF2088) 		5 ARG A 247
GLY A 241
VAL A  48
LEU A  52
ILE A 238
 None
 1.09A 5vooE-4narA:
undetectable		 5vooE-4narA:
23.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nen INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF17205
(PSI_integrin) 		5 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
 CA  B 705 ( 3.2A)
None
None
None
MG  B 707 (-2.1A)
 1.15A 5vooE-4nenB:
2.4		 5vooE-4nenB:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		5 GLU A   7
ASP A  44
LEU A 123
GLY A 196
ILE A 227
 C2F  A3000 (-3.6A)
None
None
C2F  A3000 (-3.5A)
C2F  A3000 (-4.3A)
 0.64A 5vooE-4o1eA:
27.8		 5vooE-4o1eA:
28.26
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.
4ou2 2-AMINOMUCONATE
6-SEMIALDEHYDE
DEHYDROGENASE

(Pseudomonas
fluorescens) 		PF00171
(Aldedh) 		5 GLY A 472
VAL A 258
LEU A 242
GLY A 251
SER A 248
 None
 1.19A 5vooE-4ou2A:
undetectable		 5vooE-4ou2A:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rxm POSSIBLE SUGAR ABC
SUPERFAMILY ATP
BINDING CASSETTE
TRANSPORTER, BINDING
PROTEIN

(Mannheimia
haemolytica) 		PF13407
(Peripla_BP_4) 		5 GLY A 154
VAL A 139
LEU A 259
GLY A 132
ILE A 168
 None
 0.84A 5vooE-4rxmA:
undetectable		 5vooE-4rxmA:
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.
4s1i PYRIDOXAL KINASE

(Entamoeba
histolytica) 		PF08543
(Phos_pyr_kin) 		5 GLY B 215
LEU B 109
GLY B  82
SER B  10
ILE B 113
 None
None
None
PLP  B 302 (-2.4A)
PLP  B 302 ( 4.7A)
 1.18A 5vooE-4s1iB:
2.7		 5vooE-4s1iB:
19.68
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.
4twb RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE

(Sulfolobus
solfataricus) 		PF00156
(Pribosyltran)
PF13793
(Pribosyltran_N) 		5 ARG A 230
GLY A 261
LEU A 247
GLY A 222
ILE A 225
 None
None
None
SO4  A 302 (-3.7A)
None
 1.20A 5vooE-4twbA:
2.9		 5vooE-4twbA:
24.61
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.
4tx1 ESTERASE

(Sinorhizobium
meliloti) 		PF13472
(Lipase_GDSL_2) 		5 GLY A  88
VAL A  73
LEU A   5
GLY A  47
SER A  10
 None
 1.08A 5vooE-4tx1A:
3.2		 5vooE-4tx1A:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z0t OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY

(Brucella ovis) 		PF00106
(adh_short) 		5 LYS A 181
VAL A  61
LEU A  63
GLY A  75
ILE A  78
 None
 0.98A 5vooE-4z0tA:
3.3		 5vooE-4z0tA:
26.11
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.
4ztx COBALAMIN-INDEPENDEN
T METHIONINE
SYNTHASE

(Neurospora
crassa) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 GLU A 494
ARG A 497
VAL A 747
LEU A 751
GLY A 738
 None
 1.15A 5vooE-4ztxA:
7.7		 5vooE-4ztxA:
19.77
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.
5bnz GLUTAMINE--TRNA
LIGASE

(Pseudomonas
aeruginosa) 		PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C) 		5 GLU A 524
ARG A 414
VAL A 470
LEU A 472
GLY A 527
 None
 1.10A 5vooE-5bnzA:
2.9		 5vooE-5bnzA:
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.
5by2 PHOSPHOHEPTOSE
ISOMERASE

(Colwellia
psychrerythraea) 		PF13580
(SIS_2) 		5 GLY A  48
LEU A  23
GLY A 144
SER A 119
ILE A 171
 None
 1.13A 5vooE-5by2A:
undetectable		 5vooE-5by2A:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c6u AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF12897
(Aminotran_MocR) 		5 GLY A  74
ASP A 290
LEU A  50
GLY A 264
SER A 266
 None
 0.99A 5vooE-5c6uA:
undetectable		 5vooE-5c6uA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5czl GLUCANASE

(Raoultella
ornithinolytica) 		PF01270
(Glyco_hydro_8) 		5 GLY A  30
LEU A 309
GLY A  39
SER A  35
ILE A  26
 None
 1.15A 5vooE-5czlA:
undetectable		 5vooE-5czlA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLY A 517
MET A 582
VAL A  31
LEU A  25
GLY A 562
 None
 1.14A 5vooE-5e6sA:
undetectable		 5vooE-5e6sA:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e6s INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		5 GLU B 212
GLY B 213
ASP B 209
GLY B 206
SER B 114
 None
None
CA  B2003 (-3.0A)
None
None
 1.20A 5vooE-5e6sB:
undetectable		 5vooE-5e6sB:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e6s INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		5 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
 None
 1.08A 5vooE-5e6sB:
undetectable		 5vooE-5e6sB:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5exr DNA POLYMERASE ALPHA
SUBUNIT B

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF08418
(Pol_alpha_B_N) 		5 GLU D 543
GLY D 565
VAL D 171
GLY D 560
ARG D 427
 None
 1.06A 5vooE-5exrD:
2.3		 5vooE-5exrD:
21.02
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.
5gkx UNCHARACTERIZED
PROTEIN

(Thermococcus
onnurineus) 		PF14336
(DUF4392) 		5 GLY A 154
VAL A  88
LEU A  92
GLY A  62
SER A 196
 None
 1.20A 5vooE-5gkxA:
undetectable		 5vooE-5gkxA:
24.92
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.
5hz1 PROBABLE LRR
RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE
AT4G26540

(Arabidopsis
thaliana) 		PF13855
(LRR_8) 		5 GLY B 166
LYS B 142
LEU B 237
GLY B 186
ILE B 185
 None
 1.14A 5vooE-5hz1B:
undetectable		 5vooE-5hz1B:
19.70
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.
5j7x DIMETHYLANILINE
MONOOXYGENASE,
PUTATIVE

(Aspergillus
flavus) 		PF00743
(FMO-like) 		5 GLU A 480
VAL A 532
LEU A 461
SER A 427
ARG A 413
 None
 1.05A 5vooE-5j7xA:
undetectable		 5vooE-5j7xA:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oe5 ANTHRANILATE--COA
LIGASE

(Pseudomonas
aeruginosa) 		PF00501
(AMP-binding) 		5 VAL A 239
LEU A 243
GLY A 253
SER A 277
ILE A 257
 None
 1.12A 5vooE-5oe5A:
undetectable		 5vooE-5oe5A:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t6o POLY-BETA-HYDROXYBUT
ERATE POLYMERASE

(Cupriavidus
necator) 		PF07167
(PhaC_N) 		5 GLY A 206
ASP A 254
VAL A 266
LEU A 231
GLY A 214
 None
 1.03A 5vooE-5t6oA:
undetectable		 5vooE-5t6oA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tii 3-OXOACYL-ACP
REDUCTASE

(uncultured
bacterium) 		PF13561
(adh_short_C2) 		5 GLY A 188
GLY A 150
SER A 147
ARG A 165
ILE A 151
 None
 1.08A 5vooE-5tiiA:
3.2		 5vooE-5tiiA:
25.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tnu DNA-DEPENDENT ATPASE
XPBII

(Sulfurisphaera
tokodaii) 		no annotation 5 GLU A 143
GLY A 141
ASP A 144
LEU A 112
GLY A 137
 None
SO4  A 505 ( 4.8A)
None
None
None
 1.13A 5vooE-5tnuA:
undetectable		 5vooE-5tnuA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tov ADENOSYLHOMOCYSTEINA
SE

(Thermotoga
maritima) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 GLY A 143
VAL A 129
LEU A 130
SER A 137
ILE A 111
 None
 0.98A 5vooE-5tovA:
2.2		 5vooE-5tovA:
24.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v4b F-BOX/WD
REPEAT-CONTAINING
PROTEIN 7

(Homo sapiens) 		PF00400
(WD40)
PF12937
(F-box-like) 		5 GLU B2569
GLY B2571
LEU B2589
GLY B2551
ILE B2552
 None
 1.01A 5vooE-5v4bB:
undetectable		 5vooE-5v4bB:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 11 GLU A 373
GLY A 379
LYS A 381
ASP A 411
MET A 441
VAL A 490
LEU A 492
GLY A 570
SER A 572
ARG A 583
ILE A 603
 C2F  A3001 (-3.7A)
C2F  A3001 (-3.3A)
None
C2F  A3001 ( 3.8A)
C2F  A3001 ( 4.8A)
C2F  A3001 ( 4.7A)
None
C2F  A3001 (-3.5A)
C2F  A3001 ( 4.5A)
C2F  A3001 (-3.0A)
C2F  A3001 (-3.5A)
 0.56A 5vooE-5vopA:
46.1		 5vooE-5vopA:
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.
5w3j TUBULIN BETA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 GLU B 108
GLY B  98
VAL B 116
GLY B  93
SER B  95
 None
GDP  B 501 (-4.4A)
None
None
None
 1.14A 5vooE-5w3jB:
undetectable		 5vooE-5w3jB:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yy8 INFLUENZA VIRUS
NS1A-BINDING PROTEIN

(Homo sapiens) 		no annotation 5 ARG A 236
GLY A 255
MET A 231
GLY A 251
SER A 283
 None
 1.19A 5vooE-5yy8A:
undetectable		 5vooE-5yy8A:
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.
6bfn INTERLEUKIN-1
RECEPTOR-ASSOCIATED
KINASE 1

(Homo sapiens) 		no annotation 5 GLY A 222
VAL A 272
LEU A 356
GLY A 360
SER A 255
 None
DL1  A 601 ( 4.8A)
None
None
None
 1.13A 5vooE-6bfnA:
undetectable		 5vooE-6bfnA:
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.
6c8z ADP-DEPENDENT
PHOSPHOFRUCTOKINASE

(Methanosarcinales) 		no annotation 5 GLY A 242
ASP A 471
GLY A 114
SER A  33
ILE A 119
 None
ADP  A 501 (-3.6A)
None
None
None
 0.92A 5vooE-6c8zA:
2.4		 5vooE-6c8zA:
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.
6gbn -

(-) 		no annotation 5 GLY A  53
VAL A 177
LEU A 176
GLY A 155
ILE A 153
 None
 1.16A 5vooE-6gbnA:
undetectable		 5vooE-6gbnA:
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.
6gun -

(-) 		no annotation 5 GLY A 104
ASP A  57
LEU A 151
GLY A 158
SER A 181
 None
 1.06A 5vooE-6gunA:
undetectable		 5vooE-6gunA:
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.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		4 ASN A   9
ASP A  75
ASN A  96
ASP A 160
 None
 0.45A 5vooE-1f6yA:
29.1		 5vooE-1f6yA:
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.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi) 		PF00365
(PFK) 		4 ASP A 382
ASN A 386
ASP A 176
ASN A 181
 None
None
SO4  A 601 (-3.8A)
None
 1.23A 5vooE-1kzhA:
undetectable		 5vooE-1kzhA:
20.68
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.
1nxz HYPOTHETICAL PROTEIN
HI0303

(Haemophilus
influenzae) 		PF04452
(Methyltrans_RNA) 		4 ASN A  47
ASP A  73
ASP A 242
ASN A 105
 None
 1.28A 5vooE-1nxzA:
undetectable		 5vooE-1nxzA:
21.31
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.
1rdk MANNOSE-BINDING
PROTEIN-C

(Rattus rattus) 		PF00059
(Lectin_C) 		4 ASN 1 171
ASP 1 166
ASN 1 199
ASN 1 192
 None
CA  1 227 ( 2.4A)
CA  1 227 (-3.4A)
GAL  1   1 (-2.7A)
 1.47A 5vooE-1rdk1:
undetectable		 5vooE-1rdk1:
18.66
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.
1rk2 RIBOKINASE

(Escherichia
coli) 		PF00294
(PfkB) 		4 ASP A 255
ASN A  46
ASP A  16
ASN A 108
 RIB  A 311 (-3.1A)
RIB  A 311 (-3.3A)
RIB  A 311 (-2.8A)
None
 1.24A 5vooE-1rk2A:
2.8		 5vooE-1rk2A:
26.41
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.
1tz6 PUTATIVE SUGAR
KINASE

(Salmonella
enterica) 		PF00294
(PfkB) 		4 ASN A 160
ASP A 252
ASN A  35
ASP A  16
 ACP  A 401 (-2.7A)
AIS  A 402 (-3.0A)
AIS  A 402 (-3.9A)
AIS  A 402 (-2.5A)
 1.12A 5vooE-1tz6A:
undetectable		 5vooE-1tz6A:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ux6 THROMBOSPONDIN-1

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C) 		4 ASP A 933
ASN A 931
ASP A 874
ASN A 855
 None
 1.49A 5vooE-1ux6A:
undetectable		 5vooE-1ux6A:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wdu TRAS1 ORF2P

(Bombyx mori) 		PF14529
(Exo_endo_phos_2) 		4 ASN A  29
ASP A 157
ASN A 159
ASP A 130
 PO4  A 249 (-3.7A)
PO4  A 249 (-3.7A)
PO4  A 249 (-3.3A)
None
 1.33A 5vooE-1wduA:
undetectable		 5vooE-1wduA:
19.93
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.
2ajr SUGAR KINASE, PFKB
FAMILY

(Thermotoga
maritima) 		PF00294
(PfkB) 		4 ASP A 261
ASN A  44
ASP A  12
ASN A 110
 None
ACT  A 321 (-3.9A)
ACT  A 321 (-3.1A)
None
 1.13A 5vooE-2ajrA:
undetectable		 5vooE-2ajrA:
24.28
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.
2bwp 5-AMINOLEVULINATE
SYNTHASE

(Rhodobacter
capsulatus) 		PF00155
(Aminotran_1_2) 		4 ASN A 162
ASP A 138
ASN A 141
ASP A 214
 None
None
None
PLG  A 500 (-3.1A)
 1.45A 5vooE-2bwpA:
undetectable		 5vooE-2bwpA:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o5p FERRIPYOVERDINE
RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07660
(STN)
PF07715
(Plug) 		4 ASN A 184
ASP A 186
ASN A 205
ASP A 201
 PO4  A   3 (-3.4A)
PO4  A   3 (-3.7A)
PO4  A   3 (-4.1A)
None
 1.26A 5vooE-2o5pA:
undetectable		 5vooE-2o5pA:
18.54
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.
2v73 PUTATIVE
EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF02973
(Sialidase) 		4 ASN A  61
ASP A  59
ASN A  65
ASP A  88
 None
 1.26A 5vooE-2v73A:
undetectable		 5vooE-2v73A:
22.33
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.
2vef DIHYDROPTEROATE
SYNTHASE

(Streptococcus
pneumoniae) 		PF00809
(Pterin_bind) 		4 ASN A  17
ASP A  91
ASN A 110
ASP A 201
 None
 0.84A 5vooE-2vefA:
18.6		 5vooE-2vefA:
23.49
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.
2xgo XCOGT

(Xanthomonas
campestris) 		PF13432
(TPR_16)
PF13844
(Glyco_transf_41) 		4 ASN A 384
ASP A 459
ASP A 509
ASN A 390
 None
 1.15A 5vooE-2xgoA:
2.4		 5vooE-2xgoA:
22.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		4 ASN A  10
ASP A  44
ASP A 161
ASN A 200
 C2F  A3000 ( 4.8A)
C2F  A3000 ( 4.5A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.1A)
 1.40A 5vooE-2ycjA:
29.8		 5vooE-2ycjA:
30.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ycj 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Carboxydothermus
hydrogenoformans) 		PF00809
(Pterin_bind) 		5 ASN A  10
ASP A  76
ASN A  97
ASP A 161
ASN A 200
 C2F  A3000 ( 4.8A)
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.1A)
 0.38A 5vooE-2ycjA:
29.8		 5vooE-2ycjA:
30.13
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.
3a79 TOLL-LIKE RECEPTOR
6, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Mus musculus) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 ASN B 363
ASN B 359
ASP B 409
ASN B 413
 None
NAG  B 951 (-1.7A)
NDG  B 971 ( 4.1A)
None
 1.43A 5vooE-3a79B:
2.1		 5vooE-3a79B:
20.63
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.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		5 ASN A 323
ASP A 390
ASN A 411
ASP A 473
ASN A 508
 None
 0.89A 5vooE-3bolA:
22.5		 5vooE-3bolA:
19.93
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.
3fii BOTULINUM NEUROTOXIN
TYPE F

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		4 ASN A 358
ASN A 366
ASP A 205
ASN A 401
 None
 1.40A 5vooE-3fiiA:
undetectable		 5vooE-3fiiA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3go7 RIBOKINASE RBSK

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		4 ASN A 169
ASP A 242
ASN A  55
ASP A  25
 None
RIB  A 305 (-2.9A)
RIB  A 305 (-3.2A)
RIB  A 305 (-2.8A)
 1.08A 5vooE-3go7A:
2.2		 5vooE-3go7A:
24.34
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.
3hn8 SYNAPTOTAGMIN-3

(Rattus
norvegicus) 		PF00168
(C2) 		4 ASN A 434
ASP A 402
ASN A 403
ASN A 497
 None
 1.20A 5vooE-3hn8A:
undetectable		 5vooE-3hn8A:
25.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hzs MONOFUNCTIONAL
GLYCOSYLTRANSFERASE

(Staphylococcus
aureus) 		PF00912
(Transgly) 		4 ASN A  87
ASP A  86
ASN A 170
ASN A 178
 None
 1.31A 5vooE-3hzsA:
undetectable		 5vooE-3hzsA:
18.79
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.
3ifr CARBOHYDRATE KINASE,
FGGY

(Rhodospirillum
rubrum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 ASN A 180
ASP A 287
ASN A 298
ASP A 270
 None
PO4  A 509 ( 4.4A)
PO4  A 509 (-3.6A)
None
 1.49A 5vooE-3ifrA:
undetectable		 5vooE-3ifrA:
23.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3in1 UNCHARACTERIZED
SUGAR KINASE YDJH

(Escherichia
coli) 		PF00294
(PfkB) 		4 ASN A  98
ASP A  15
ASP A 260
ASN A 144
 None
 1.07A 5vooE-3in1A:
2.5		 5vooE-3in1A:
22.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		5 ASN A 361
ASP A 431
ASN A 452
ASP A 519
ASN A 561
 GOL  A 643 (-3.1A)
THH  A 642 (-3.3A)
THH  A 642 (-3.0A)
THH  A 642 (-3.4A)
THH  A 642 ( 3.3A)
 0.28A 5vooE-3k13A:
38.5		 5vooE-3k13A:
34.19
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.
3ksm ABC-TYPE SUGAR
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Hahella
chejuensis) 		PF13407
(Peripla_BP_4) 		4 ASN A 106
ASP A  79
ASN A  50
ASP A 259
 None
None
BDR  A   1 ( 4.3A)
BDR  A   1 (-2.7A)
 1.30A 5vooE-3ksmA:
undetectable		 5vooE-3ksmA:
25.08
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.
3lrk ALPHA-GALACTOSIDASE
1

(Saccharomyces
cerevisiae) 		PF16499
(Melibiase_2) 		4 ASN A  36
ASP A  35
ASN A 263
ASP A 209
 None
GOL  A7002 (-3.5A)
GOL  A7002 (-3.1A)
GOL  A7002 ( 3.9A)
 1.04A 5vooE-3lrkA:
8.4		 5vooE-3lrkA:
21.33
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.
3nqw CG11900

(Drosophila
melanogaster) 		PF13328
(HD_4) 		4 ASN A 127
ASP A 126
ASN A  39
ASN A 134
 MN  A 300 ( 4.2A)
None
None
None
 1.41A 5vooE-3nqwA:
undetectable		 5vooE-3nqwA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nr8 PHOSPHATIDYLINOSITOL
-3,4,5-TRISPHOSPHATE
5-PHOSPHATASE 2

(Homo sapiens) 		no annotation 4 ASP B 607
ASN B 432
ASP B 717
ASN B 684
 None
 1.34A 5vooE-3nr8B:
undetectable		 5vooE-3nr8B:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oft CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		4 ASN A  45
ASP A  15
ASN A  18
ASN A 383
 None
None
None
HX2  A 397 (-3.7A)
 1.47A 5vooE-3oftA:
undetectable		 5vooE-3oftA:
25.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tr9 DIHYDROPTEROATE
SYNTHASE

(Coxiella
burnetii) 		PF00809
(Pterin_bind) 		4 ASN A  35
ASP A 111
ASN A 130
ASP A 199
 CL  A 315 (-3.6A)
PT1  A1001 ( 3.4A)
PT1  A1001 ( 2.9A)
PT1  A1001 (-3.3A)
 0.87A 5vooE-3tr9A:
19.3		 5vooE-3tr9A:
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.
3tsr RIBONUCLEASE
PANCREATIC
RIBONUCLEASE
INHIBITOR

(Mus musculus;
Mus musculus) 		PF00074
(RnaseA)
PF13516
(LRR_6) 		4 ASN A  45
ASP E 431
ASN E 402
ASP E 399
 None
 1.45A 5vooE-3tsrA:
undetectable		 5vooE-3tsrA:
15.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u37 ACETYL-XYLAN
ESTERASE EST2A

(Butyrivibrio
proteoclasticus) 		PF13472
(Lipase_GDSL_2) 		4 ASP A 259
ASN A 257
ASP A 198
ASN A 108
 None
 1.17A 5vooE-3u37A:
2.4		 5vooE-3u37A:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		4 ASN A 989
ASP A 986
ASN A1602
ASN A 948
 None
 1.42A 5vooE-4amcA:
2.6		 5vooE-4amcA:
13.33
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.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		4 ASN A 379
ASP A 414
ASP A 537
ASN A 579
 THG  A1652 (-4.6A)
None
THG  A1652 (-3.4A)
THG  A1652 (-3.1A)
 1.43A 5vooE-4cczA:
38.6		 5vooE-4cczA:
16.87
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.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		5 ASN A 379
ASP A 449
ASN A 470
ASP A 537
ASN A 579
 THG  A1652 (-4.6A)
THG  A1652 (-3.4A)
THG  A1652 (-3.2A)
THG  A1652 (-3.4A)
THG  A1652 (-3.1A)
 0.25A 5vooE-4cczA:
38.6		 5vooE-4cczA:
16.87
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.
4dhg MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Thermobispora
bispora) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ASN A  20
ASP A 401
ASP A  51
ASN A 318
 PO4  A 501 (-3.6A)
None
None
PO4  A 501 ( 4.8A)
 1.24A 5vooE-4dhgA:
5.4		 5vooE-4dhgA:
24.22
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.
4fva 5'-TYROSYL-DNA
PHOSPHODIESTERASE

(Caenorhabditis
elegans) 		PF03372
(Exo_endo_phos) 		4 ASN A 273
ASP A 271
ASN A 126
ASP A 128
 MLI  A 403 (-3.2A)
MLI  A 403 ( 4.5A)
MLI  A 403 (-4.2A)
MG  A 402 (-3.3A)
 1.23A 5vooE-4fvaA:
undetectable		 5vooE-4fvaA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gz2 TYROSYL-DNA
PHOSPHODIESTERASE 2

(Mus musculus) 		PF03372
(Exo_endo_phos) 		4 ASN A 274
ASP A 272
ASN A 130
ASP A 132
 None
None
MG  A 402 ( 4.3A)
MG  A 402 (-2.9A)
 1.23A 5vooE-4gz2A:
undetectable		 5vooE-4gz2A:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k35 GLYCOSIDE HYDROLASE
FAMILY 81
ENDO-BETA-1,3-GLUCAN
ASE

(Rhizomucor
miehei) 		PF03639
(Glyco_hydro_81) 		4 ASN A 515
ASP A 520
ASN A  14
ASP A  16
 None
 1.49A 5vooE-4k35A:
undetectable		 5vooE-4k35A:
16.13
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.
4n91 TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Anaerococcus
prevotii) 		PF03480
(DctP) 		4 ASN A 103
ASP A 104
ASN A 318
ASP A 319
 PG4  A 404 ( 4.9A)
None
None
None
 1.45A 5vooE-4n91A:
undetectable		 5vooE-4n91A:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		4 ASN A  10
ASP A  76
ASN A  97
ASP A 161
 C2F  A3000 ( 4.5A)
C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 (-3.5A)
 0.29A 5vooE-4o1eA:
27.8		 5vooE-4o1eA:
28.26
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.
4o1e DIHYDROPTEROATE
SYNTHASE DHPS

(Desulfitobacterium
hafniense) 		PF00809
(Pterin_bind) 		4 ASP A  76
ASN A  97
ASP A 161
ASN A 199
 C2F  A3000 (-3.6A)
C2F  A3000 (-3.0A)
C2F  A3000 (-3.5A)
C2F  A3000 ( 4.3A)
 0.80A 5vooE-4o1eA:
27.8		 5vooE-4o1eA:
28.26
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.
4ow2 YOP EFFECTOR YOPM

(Yersinia
enterocolitica) 		PF12468
(TTSSLRR) 		4 ASN A 363
ASN A 359
ASP A 399
ASN A 403
 None
 1.39A 5vooE-4ow2A:
undetectable		 5vooE-4ow2A:
23.27
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.
4r7b CHOLINE KINASE

(Streptococcus
pneumoniae) 		PF01633
(Choline_kinase) 		4 ASN A  32
ASN A  88
ASP A  73
ASN A 181
 None
 1.46A 5vooE-4r7bA:
undetectable		 5vooE-4r7bA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		4 ASN A2693
ASP A2170
ASN A2801
ASN A2182
 CA  A3000 (-3.1A)
CA  A3000 (-2.2A)
None
None
 1.40A 5vooE-4tvcA:
3.0		 5vooE-4tvcA:
13.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z2q LECTIN

(Athelia rolfsii) 		PF07367
(FB_lectin) 		4 ASN A  59
ASP A  14
ASN A  12
ASN A 116
 None
 1.20A 5vooE-4z2qA:
undetectable		 5vooE-4z2qA:
19.33
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.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		4 ASN A 538
ASP A 533
ASN A 570
ASN A 662
 None
 1.23A 5vooE-4zgvA:
undetectable		 5vooE-4zgvA:
16.57
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.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		4 ASN A 540
ASP A 533
ASN A 570
ASN A 662
 None
 1.11A 5vooE-4zgvA:
undetectable		 5vooE-4zgvA:
16.57
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.
5a6f GATING RING OF
POTASSIUM CHANNEL
SUBFAMILY T MEMBER 1

(Gallus gallus) 		PF03493
(BK_channel_a) 		4 ASN C 838
ASP C 837
ASN C 877
ASP C 857
 None
 1.34A 5vooE-5a6fC:
undetectable		 5vooE-5a6fC:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		4 ASN A  44
ASP A  40
ASN A 743
ASP A 739
 None
B12  A1101 (-3.5A)
B12  A1101 ( 4.6A)
None
 1.19A 5vooE-5cjuA:
8.1		 5vooE-5cjuA:
15.02
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.
5dx9 TREHALOSE-6-PHOSPHAT
E PHOSPHATASE

(Cryptococcus
neoformans) 		PF02358
(Trehalose_PPase) 		4 ASP A 214
ASN A  24
ASP A  26
ASN A 178
 T6P  A 402 ( 4.3A)
MG  A 401 ( 2.5A)
T6P  A 402 ( 2.9A)
T6P  A 402 (-3.5A)
 1.22A 5vooE-5dx9A:
undetectable		 5vooE-5dx9A:
24.87
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.
5ey7 FRUCTOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		4 ASN A 174
ASP A 266
ASN A  49
ASP A  30
 None
 1.18A 5vooE-5ey7A:
2.5		 5vooE-5ey7A:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		4 ASN A 218
ASP A 217
ASP A 144
ASN A 161
 None
 1.43A 5vooE-5m60A:
undetectable		 5vooE-5m60A:
16.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oko PHOSPHATIDYLINOSITOL
3,4,5-TRISPHOSPHATE
5-PHOSPHATASE 2

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		4 ASP A 607
ASN A 432
ASP A 717
ASN A 684
 None
 1.30A 5vooE-5okoA:
undetectable		 5vooE-5okoA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 4 ASN A 376
ASP A 411
ASP A 531
ASN A 573
 NA  A3005 (-3.0A)
C2F  A3001 ( 3.8A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.6A)
 1.32A 5vooE-5vopA:
46.1		 5vooE-5vopA:
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.
5vop 5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE

(Thermus
thermophilus) 		no annotation 5 ASN A 376
ASP A 443
ASN A 464
ASP A 531
ASN A 573
 NA  A3005 (-3.0A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.2A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.6A)
 0.18A 5vooE-5vopA:
46.1		 5vooE-5vopA:
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.
6b4m MONOTREME LACTATION
PROTEIN

(Ornithorhynchus
anatinus) 		no annotation 4 ASN A  45
ASP A  60
ASN A  57
ASP A 119
 None
 1.46A 5vooE-6b4mA:
2.4		 5vooE-6b4mA:
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT A, VACUOLAR
ISOFORM

(Saccharomyces
cerevisiae) 		no annotation 4 ASN A 136
ASP A 137
ASN A 259
ASP A 257
 None
 1.20A 5vooE-6c6lA:
undetectable		 5vooE-6c6lA:
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.
6cw5 RIBOKINASE

(Cryptococcus
neoformans) 		no annotation 4 ASN A 163
ASP A 273
ASN A  46
ASP A  16
 None
None
GOL  A 400 (-3.3A)
GOL  A 400 (-2.8A)
 1.09A 5vooE-6cw5A:
2.5		 5vooE-6cw5A:
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.
6d6q EXOSOME COMPLEX
EXONUCLEASE RRP44

(Homo sapiens) 		no annotation 4 ASP K 488
ASN K 487
ASP K 784
ASN K 671
 A  O  61 ( 3.3A)
A  O  62 ( 3.2A)
None
None
 1.28A 5vooE-6d6qK:
undetectable		 5vooE-6d6qK:
undetectable