SIMILAR PATTERNS OF AMINO ACIDS FOR 5VOO_F_C2FF3001

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)
5 ASN A  45
ASP A  43
LEU A 122
GLY A 196
ILE A 227
None
1.05A 5vooF-1f6yA:
29.3
5vooF-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.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE


(Moorella
thermoacetica)
PF00809
(Pterin_bind)
8 GLU A   6
ASN A   9
ASP A  43
LEU A 122
GLY A 196
SER A 198
ARG A 207
ILE A 227
None
0.62A 5vooF-1f6yA:
29.3
5vooF-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.
1g5u PROFILIN

(Hevea
brasiliensis)
PF00235
(Profilin)
5 GLY A1069
VAL A1119
LEU A1020
GLY A1091
ILE A1092
None
1.17A 5vooF-1g5uA:
undetectable
5vooF-1g5uA:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hcu ALPHA-1,2-MANNOSIDAS
E


(Trichoderma
reesei)
PF01532
(Glyco_hydro_47)
5 GLY A 341
VAL A 404
GLY A 313
SER A 310
PHE A 292
None
1.15A 5vooF-1hcuA:
undetectable
5vooF-1hcuA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
1.10A 5vooF-1kb0A:
undetectable
5vooF-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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1


(Paracoccus
denitrificans)
PF01011
(PQQ)
PF13360
(PQQ_2)
5 GLY A 239
LYS A 236
ASP A 300
GLY A 306
SER A 259
None
1.15A 5vooF-1lrwA:
undetectable
5vooF-1lrwA:
19.28
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.
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
1.18A 5vooF-1mroA:
undetectable
5vooF-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.
1oe5 SINGLE-STRAND
SELECTIVE
MONOFUNCTIONAL
URACIL DNA
GLYCOSYLASE


(Xenopus laevis)
no annotation 5 ASN A 174
GLY A  94
LEU A 119
GLY A 149
SER A 148
URA  A1282 (-3.0A)
URA  A1282 (-3.6A)
None
None
URA  A1282 ( 4.4A)
1.04A 5vooF-1oe5A:
undetectable
5vooF-1oe5A:
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.
1qpw PORCINE HEMOGLOBIN
(BETA SUBUNIT)


(Sus scrofa)
PF00042
(Globin)
5 GLY B  64
LYS B  59
VAL B 133
LEU B  75
ILE B 110
None
1.17A 5vooF-1qpwB:
undetectable
5vooF-1qpwB:
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.
1v02 DHURRINASE

(Sorghum bicolor)
PF00232
(Glyco_hydro_1)
5 ASN A 374
GLY A 408
VAL A 202
LEU A 203
GLY A 464
None
1.18A 5vooF-1v02A:
3.1
5vooF-1v02A:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xvy SFUA

(Yersinia
enterocolitica)
PF13343
(SBP_bac_6)
5 ASN A  60
LEU A 258
GLY A  97
PHE A  56
ILE A 227
None
1.06A 5vooF-1xvyA:
undetectable
5vooF-1xvyA:
22.81
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.
1z8l GLUTAMATE
CARBOXYPEPTIDASE II


(Homo sapiens)
PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28)
5 GLU A 522
ASN A 519
ASP A 520
GLY A 427
PHE A 209
None
ZN  A1751 (-3.7A)
None
None
None
1.12A 5vooF-1z8lA:
undetectable
5vooF-1z8lA:
18.99
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.
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
1.18A 5vooF-1ztmA:
undetectable
5vooF-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.
2aaf ARGININE DEIMINASE

(Pseudomonas
aeruginosa)
PF02274
(Amidinotransf)
5 ASN A 233
GLY A 234
ASP A 417
LEU A 338
ILE A 416
None
1.13A 5vooF-2aafA:
undetectable
5vooF-2aafA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
1.33A 5vooF-2bi7A:
undetectable
5vooF-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.
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
1.14A 5vooF-2d7dA:
2.0
5vooF-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.
2drh 361AA LONG
HYPOTHETICAL
D-AMINOPEPTIDASE


(Pyrococcus
horikoshii)
PF03576
(Peptidase_S58)
5 GLU A 213
GLY A 223
LEU A 266
GLY A 210
PHE A 181
None
1.14A 5vooF-2drhA:
undetectable
5vooF-2drhA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e1d TRANSALDOLASE

(Mus musculus)
PF00923
(TAL_FSA)
5 ASN A  82
GLY A  69
ASP A  85
PHE A 331
ILE A  84
None
1.16A 5vooF-2e1dA:
6.9
5vooF-2e1dA:
23.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
1.10A 5vooF-2g39A:
2.6
5vooF-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.
2gjx BETA-HEXOSAMINIDASE
ALPHA CHAIN


(Homo sapiens)
PF00728
(Glyco_hydro_20)
PF14845
(Glycohydro_20b2)
5 GLY A 250
ASP A 314
VAL A 371
LEU A 415
SER A 112
None
1.20A 5vooF-2gjxA:
10.3
5vooF-2gjxA:
21.00
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.
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
1.19A 5vooF-2gnpA:
undetectable
5vooF-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
1.13A 5vooF-2i5gA:
4.8
5vooF-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.
2ics ADENINE DEAMINASE

(Enterococcus
faecalis)
PF01979
(Amidohydro_1)
5 GLY A 113
VAL A 161
LEU A 128
GLY A 121
ILE A 122
None
1.09A 5vooF-2icsA:
4.1
5vooF-2icsA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jif SHORT/BRANCHED CHAIN
SPECIFIC ACYL-COA
DEHYDROGENASE


(Homo sapiens)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
5 ASN A 291
GLY A 288
GLY A 296
PHE A 174
ILE A 295
COS  A1434 (-3.0A)
None
None
None
None
1.16A 5vooF-2jifA:
undetectable
5vooF-2jifA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pwh SUCROSE ISOMERASE

([Pseudomonas]
mesoacidophila)
PF00128
(Alpha-amylase)
PF11941
(DUF3459)
5 ASN A  59
GLY A  63
GLY A  29
SER A  19
ILE A  28
None
None
CA  A7001 ( 4.6A)
None
None
1.13A 5vooF-2pwhA:
9.3
5vooF-2pwhA:
20.36
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] SMALL CHAIN


(Azospirillum
brasilense)
PF07992
(Pyr_redox_2)
PF14691
(Fer4_20)
5 GLU G 219
ASN G 408
ASP G 411
VAL G 236
LEU G 237
FAD  G 484 (-2.9A)
FAD  G 484 (-4.2A)
None
None
None
1.20A 5vooF-2vdcG:
2.3
5vooF-2vdcG:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vun ENAMIDASE

(Eubacterium
barkeri)
PF01979
(Amidohydro_1)
5 ASN A 222
GLY A 250
VAL A 210
GLY A 195
ILE A 228
None
1.18A 5vooF-2vunA:
5.2
5vooF-2vunA:
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.
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
1.15A 5vooF-2wtbA:
4.2
5vooF-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)
6 ASN A  10
LYS A  14
ASP A  76
GLY A 197
SER A 199
ARG A 208
C2F  A3000 ( 4.8A)
None
C2F  A3000 (-3.4A)
C2F  A3000 (-3.6A)
GOL  A1270 ( 3.9A)
C2F  A3000 ( 2.6A)
1.44A 5vooF-2ycjA:
29.8
5vooF-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  46
ASP A  44
LEU A 123
GLY A 197
ILE A 228
None
C2F  A3000 ( 4.5A)
None
C2F  A3000 (-3.6A)
C2F  A3000 (-4.6A)
1.05A 5vooF-2ycjA:
29.8
5vooF-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)
9 GLU A   7
ASN A  10
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)
C2F  A3000 ( 4.8A)
None
C2F  A3000 ( 4.5A)
None
C2F  A3000 (-3.6A)
GOL  A1270 ( 3.9A)
C2F  A3000 ( 2.6A)
C2F  A3000 (-4.6A)
0.67A 5vooF-2ycjA:
29.8
5vooF-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)
5 GLU A  43
GLY A 118
ASP A  44
GLY A  65
SER A  68
None
1.14A 5vooF-2yjvA:
undetectable
5vooF-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
1.18A 5vooF-2yv5A:
2.2
5vooF-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
0.99A 5vooF-3abgA:
undetectable
5vooF-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.
3au9 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE


(Plasmodium
falciparum)
PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C)
5 GLY A 186
LEU A 219
GLY A 212
SER A 210
ILE A 208
None
1.17A 5vooF-3au9A:
2.4
5vooF-3au9A:
19.22
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.
3bol 5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE


(Thermotoga
maritima)
PF00809
(Pterin_bind)
PF02574
(S-methyl_trans)
7 GLU A 320
ASN A 323
ASP A 358
LEU A 437
GLY A 505
SER A 507
ILE A 536
None
0.66A 5vooF-3bolA:
22.3
5vooF-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 5vooF-3c5yA:
undetectable
5vooF-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
1.10A 5vooF-3d7lA:
2.5
5vooF-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
1.06A 5vooF-3dbkA:
undetectable
5vooF-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
1.11A 5vooF-3ebvA:
7.4
5vooF-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
1.10A 5vooF-3eozA:
undetectable
5vooF-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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM


(Serratia
plymuthica)
PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C)
5 ASN A  73
GLY A  77
GLY A  43
SER A  33
ILE A  42
None
1.17A 5vooF-3gbdA:
9.5
5vooF-3gbdA:
18.47
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.
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
1.20A 5vooF-3gfbA:
2.4
5vooF-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 5vooF-3gqsA:
undetectable
5vooF-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
1.16A 5vooF-3hbnA:
4.7
5vooF-3hbnA:
23.17
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.
3hje 704AA LONG
HYPOTHETICAL
GLYCOSYLTRANSFERASE


(Sulfurisphaera
tokodaii)
PF00128
(Alpha-amylase)
PF09196
(DUF1953)
5 GLU A 468
LEU A 535
SER A 548
PHE A 552
ILE A 472
None
1.14A 5vooF-3hjeA:
6.5
5vooF-3hjeA:
17.50
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.
3ifr CARBOHYDRATE KINASE,
FGGY


(Rhodospirillum
rubrum)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
5 ASN A 298
GLY A 299
ASP A 287
LEU A 138
GLY A 131
PO4  A 509 (-3.6A)
None
PO4  A 509 ( 4.4A)
None
None
1.11A 5vooF-3ifrA:
undetectable
5vooF-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.
3iuu PUTATIVE
METALLOPEPTIDASE


(Chelativorans
sp. BNC1)
PF07171
(MlrC_C)
PF07364
(DUF1485)
5 GLU A 210
VAL A 245
LEU A 227
GLY A 212
ILE A 211
None
1.15A 5vooF-3iuuA:
2.4
5vooF-3iuuA:
23.80
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
ASN A 361
GLY A 364
ASP A 396
VAL A 478
GLY A 558
SER A 560
ARG A 573
ILE A 593
THH  A 642 ( 3.5A)
GOL  A 643 (-3.1A)
THH  A 642 (-3.7A)
THH  A 642 ( 4.7A)
None
THH  A 642 (-3.3A)
K  A 644 ( 3.4A)
THH  A 642 (-3.1A)
THH  A 642 (-4.2A)
0.35A 5vooF-3k13A:
38.2
5vooF-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.
3p24 BFT-3

(Bacteroides
fragilis)
PF13583
(Reprolysin_4)
PF16376
(fragilysinNterm)
5 ASN A 275
GLY A 274
ASP A 277
GLY A 315
ILE A 316
None
1.05A 5vooF-3p24A:
undetectable
5vooF-3p24A:
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.
3pqv RCL1 PROTEIN

(Kluyveromyces
lactis)
PF01137
(RTC)
PF05189
(RTC_insert)
5 GLY A 119
LEU A 103
GLY A 128
SER A 122
ILE A 129
None
1.16A 5vooF-3pqvA:
undetectable
5vooF-3pqvA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rf7 IRON-CONTAINING
ALCOHOL
DEHYDROGENASE


(Shewanella
denitrificans)
PF00465
(Fe-ADH)
5 GLY A 100
ASP A 194
GLY A 246
SER A 149
PHE A 170
NAD  A 358 (-3.2A)
FE  A 360 (-2.0A)
None
NAD  A 358 (-2.5A)
None
1.19A 5vooF-3rf7A:
undetectable
5vooF-3rf7A:
21.46
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.
3riq TAILSPIKE PROTEIN

(Salmonella
virus 9NA)
PF09251
(PhageP22-tail)
5 ASN A 413
VAL A 467
GLY A 409
SER A 376
ILE A 410
None
1.20A 5vooF-3riqA:
undetectable
5vooF-3riqA:
21.28
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.
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
1.17A 5vooF-3sjnA:
9.3
5vooF-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
LEU B 193
GLY B 234
SER B 142
0DU  B4000 (-3.3A)
None
None
0DU  B4000 (-3.4A)
MG  B2001 ( 2.9A)
1.15A 5vooF-3v4vB:
2.8
5vooF-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.
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
1.16A 5vooF-3vnkA:
6.9
5vooF-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.
4aah METHANOL
DEHYDROGENASE


(Methylophilus
methylotrophus)
PF13360
(PQQ_2)
5 GLY A 233
LYS A 230
ASP A 294
GLY A 300
SER A 253
None
1.14A 5vooF-4aahA:
undetectable
5vooF-4aahA:
20.54
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.
4b90 DIHYDROPYRIMIDINASE-
RELATED PROTEIN 5


(Homo sapiens)
PF01979
(Amidohydro_1)
5 GLY A  93
ASP A 401
LEU A 385
GLY A 392
PHE A 373
None
1.14A 5vooF-4b90A:
5.2
5vooF-4b90A:
19.87
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.
4b92 DIHYDROPYRIMIDINASE-
RELATED PROTEIN 5


(Homo sapiens)
PF01979
(Amidohydro_1)
5 GLY A  93
ASP A 401
LEU A 385
GLY A 392
PHE A 373
None
1.14A 5vooF-4b92A:
8.4
5vooF-4b92A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ccz METHIONINE SYNTHASE

(Homo sapiens)
PF00809
(Pterin_bind)
PF02574
(S-methyl_trans)
6 GLU A 376
ASN A 379
GLY A 382
ASP A 414
PHE A 582
ARG A 591
THG  A1652 (-3.5A)
THG  A1652 (-4.6A)
THG  A1652 (-3.8A)
None
THG  A1652 (-4.5A)
THG  A1652 (-3.0A)
0.76A 5vooF-4cczA:
38.6
5vooF-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)
9 GLU A 376
ASN A 379
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 (-4.6A)
THG  A1652 (-3.8A)
None
None
THG  A1652 (-3.6A)
THG  A1652 (-4.2A)
THG  A1652 (-3.0A)
THG  A1652 (-4.2A)
0.44A 5vooF-4cczA:
38.6
5vooF-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.
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA


(Methanothermobacter
marburgensis)
PF04422
(FrhB_FdhB_N)
PF04432
(FrhB_FdhB_C)
5 GLY C 226
LEU C  68
GLY C  98
ARG C 110
ILE C  42
None
1.11A 5vooF-4ci0C:
undetectable
5vooF-4ci0C:
25.61
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.
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
1.15A 5vooF-4e4rA:
undetectable
5vooF-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.
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
1.15A 5vooF-4fgwA:
3.9
5vooF-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.
4fys AMINOPEPTIDASE N

(Homo sapiens)
PF01433
(Peptidase_M1)
PF11838
(ERAP1_C)
5 GLU A 523
LEU A 487
GLY A 499
SER A 502
PHE A 507
NAG  A1010 (-3.9A)
None
NAG  A1010 ( 4.4A)
NAG  A1010 (-4.1A)
None
0.66A 5vooF-4fysA:
undetectable
5vooF-4fysA:
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.
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
1.18A 5vooF-4ifdC:
undetectable
5vooF-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.
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 5vooF-4jerA:
undetectable
5vooF-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.
4jz6 SALICYLALDEHYDE
DEHYDROGENASE NAHF


(Pseudomonas
putida)
PF00171
(Aldedh)
5 GLY A 150
VAL A 169
LEU A 198
GLY A 173
SER A 174
NK  A 501 (-3.1A)
None
None
None
None
1.05A 5vooF-4jz6A:
undetectable
5vooF-4jz6A:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
1.14A 5vooF-4nenB:
2.5
5vooF-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 ASN A  10
LEU A 123
GLY A 196
ARG A 207
ILE A 227
C2F  A3000 ( 4.5A)
None
C2F  A3000 (-3.5A)
None
C2F  A3000 (-4.3A)
1.13A 5vooF-4o1eA:
27.8
5vooF-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)
6 GLU A   7
ASN A  10
ASP A  44
LEU A 123
GLY A 196
ILE A 227
C2F  A3000 (-3.6A)
C2F  A3000 ( 4.5A)
None
None
C2F  A3000 (-3.5A)
C2F  A3000 (-4.3A)
0.60A 5vooF-4o1eA:
27.8
5vooF-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)
5 GLU A   7
ASN A  10
LEU A 163
GLY A 196
ILE A 227
C2F  A3000 (-3.6A)
C2F  A3000 ( 4.5A)
None
C2F  A3000 (-3.5A)
C2F  A3000 (-4.3A)
1.17A 5vooF-4o1eA:
27.8
5vooF-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
1.18A 5vooF-4ou2A:
undetectable
5vooF-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.
4ovq TRAP DICARBOXYLATE
ABC TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN


(Roseobacter
denitrificans)
PF03480
(DctP)
5 GLU A  84
ASN A 240
GLY A  81
GLY A  29
ILE A  85
None
1.17A 5vooF-4ovqA:
undetectable
5vooF-4ovqA:
22.74
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.
4q0c VIRULENCE SENSOR
PROTEIN BVGS


(Bordetella
pertussis)
PF00497
(SBP_bac_3)
5 ASN A 131
GLY A 244
LEU A 116
GLY A 249
SER A 143
None
0.99A 5vooF-4q0cA:
undetectable
5vooF-4q0cA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 5vooF-4rxmA:
2.6
5vooF-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)
1.15A 5vooF-4s1iB:
2.7
5vooF-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.
4yh2 GLUTATHIONE S
TRANSFERASE E6


(Drosophila
melanogaster)
PF13417
(GST_N_3)
PF14497
(GST_C_3)
5 GLU A 193
ASN A 202
GLY A 203
VAL A 142
ILE A 189
None
0.92A 5vooF-4yh2A:
undetectable
5vooF-4yh2A:
23.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bp1 MYCOCEROSIC ACID
SYNTHASE


(Mycolicibacterium
smegmatis)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 GLY A  68
LYS A  66
LEU A  28
GLY A 244
ARG A  46
None
1.19A 5vooF-5bp1A:
undetectable
5vooF-5bp1A:
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.
5bxp LACTO-N-BIOSIDASE

(Bifidobacterium
bifidum)
PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b)
PF14200
(RicinB_lectin_2)
5 ASN A 357
GLY A 354
LEU A 404
GLY A 376
ILE A 372
None
1.14A 5vooF-5bxpA:
3.7
5vooF-5bxpA:
19.78
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.
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
1.18A 5vooF-5by2A:
undetectable
5vooF-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.
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
1.18A 5vooF-5e6sB:
2.5
5vooF-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
1.06A 5vooF-5e6sB:
2.5
5vooF-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.
5fp1 TONB-DEPENDENT
SIDEROPHORE RECEPTOR


(Acinetobacter
baumannii)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
5 GLY A  74
ASP A 303
GLY A 375
SER A 373
ARG A 406
None
PO4  A1716 (-2.8A)
None
None
None
1.20A 5vooF-5fp1A:
undetectable
5vooF-5fp1A:
18.63
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.
5h8w ATP-DEPENDENT DNA
HELICASE TA0057


(Thermoplasma
acidophilum)
PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2)
5 GLU A 564
LEU A 484
GLY A 504
SER A 502
PHE A 455
None
1.08A 5vooF-5h8wA:
3.0
5vooF-5h8wA:
22.26
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.
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
1.06A 5vooF-5hz1B:
undetectable
5vooF-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.
5k66 NTA1P

(Saccharomyces
cerevisiae)
PF00795
(CN_hydrolase)
5 ASN A 151
GLY A 154
GLY A 185
PHE A 207
ILE A 186
None
1.06A 5vooF-5k66A:
undetectable
5vooF-5k66A:
20.47
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.
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
1.09A 5vooF-5oe5A:
undetectable
5vooF-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 5vooF-5t6oA:
undetectable
5vooF-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
1.10A 5vooF-5tiiA:
3.1
5vooF-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
1.09A 5vooF-5tnuA:
undetectable
5vooF-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
1.03A 5vooF-5tovA:
undetectable
5vooF-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.
5u2a AMP-DEPENDENT
SYNTHETASE AND
LIGASE


(Brucella canis)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
5 VAL A 288
LEU A 316
GLY A 293
SER A 294
ILE A 244
None
1.01A 5vooF-5u2aA:
3.2
5vooF-5u2aA:
21.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 5vooF-5v4bB:
undetectable
5vooF-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 12 GLU A 373
ASN A 376
GLY A 379
LYS A 381
ASP A 411
VAL A 490
LEU A 492
GLY A 570
SER A 572
PHE A 576
ARG A 583
ILE A 603
C2F  A3001 (-3.7A)
NA  A3005 (-3.0A)
C2F  A3001 (-3.3A)
None
C2F  A3001 ( 3.8A)
C2F  A3001 ( 4.7A)
None
C2F  A3001 (-3.5A)
C2F  A3001 ( 4.5A)
C2F  A3001 (-4.7A)
C2F  A3001 (-3.0A)
C2F  A3001 (-3.5A)
0.52A 5vooF-5vopA:
45.7
5vooF-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
1.19A 5vooF-5w3jB:
2.1
5vooF-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.
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
1.14A 5vooF-6bfnA:
undetectable
5vooF-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
0.97A 5vooF-6c8zA:
2.4
5vooF-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.
6dhi -

(-)
no annotation 5 GLY A 167
LYS A 439
VAL A 187
LEU A 188
ILE A 179
None
1.19A 5vooF-6dhiA:
undetectable
5vooF-6dhiA:
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
1.07A 5vooF-6gunA:
undetectable
5vooF-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.
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
1.20A 5vooF-1kzhA:
0.3
5vooF-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.
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
1.22A 5vooF-1rk2A:
2.6
5vooF-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.
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
1.47A 5vooF-1ux6A:
undetectable
5vooF-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.
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
1.14A 5vooF-2ajrA:
2.6
5vooF-2ajrA:
24.28
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 ASP A  76
ASN A  97
ASP A 161
ASN A 200
C2F  A3000 (-3.4A)
C2F  A3000 (-3.0A)
C2F  A3000 (-3.5A)
C2F  A3000 (-3.1A)
0.31A 5vooF-2ycjA:
29.8
5vooF-2ycjA:
30.13
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)
4 ASP A 396
ASN A 452
ASP A 519
ASN A 561
THH  A 642 ( 4.7A)
THH  A 642 (-3.0A)
THH  A 642 (-3.4A)
THH  A 642 ( 3.3A)
1.39A 5vooF-3k13A:
38.2
5vooF-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)
4 ASP A 431
ASN A 452
ASP A 519
ASN A 561
THH  A 642 (-3.3A)
THH  A 642 (-3.0A)
THH  A 642 (-3.4A)
THH  A 642 ( 3.3A)
0.23A 5vooF-3k13A:
38.2
5vooF-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.
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
1.31A 5vooF-3nr8B:
undetectable
5vooF-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.
4ccz METHIONINE SYNTHASE

(Homo sapiens)
PF00809
(Pterin_bind)
PF02574
(S-methyl_trans)
4 ASP A 449
ASN A 470
ASP A 537
ASN A 579
THG  A1652 (-3.4A)
THG  A1652 (-3.2A)
THG  A1652 (-3.4A)
THG  A1652 (-3.1A)
0.23A 5vooF-4cczA:
38.6
5vooF-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.
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)
0.83A 5vooF-4o1eA:
27.8
5vooF-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.
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)
1.24A 5vooF-5dx9A:
1.4
5vooF-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.
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
1.27A 5vooF-5okoA:
undetectable
5vooF-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 ASP A 443
ASN A 464
ASP A 531
ASN A 573
C2F  A3001 (-2.5A)
C2F  A3001 (-2.2A)
C2F  A3001 (-2.5A)
C2F  A3001 (-2.6A)
0.09A 5vooF-5vopA:
45.7
5vooF-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.
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
1.23A 5vooF-6d6qK:
undetectable
5vooF-6d6qK:
undetectable