SIMILAR PATTERNS OF AMINO ACIDS FOR 2VUF_B_FUAB2002_1

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.
1amk TRIOSE PHOSPHATE
ISOMERASE

(Leishmania
mexicana) 		PF00121
(TIM) 		4 ALA A 110
VAL A 113
CYH A 117
LYS A 118
 None
 0.67A 2vufB-1amkA:
0.0		 2vufB-1amkA:
16.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ddm NUMB PROTEIN

(Drosophila
melanogaster) 		PF00640
(PID) 		4 ILE A 144
ALA A 190
VAL A 191
CYH A 150
 None
 1.01A 2vufB-1ddmA:
undetectable		 2vufB-1ddmA:
12.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1elk TARGET OF MYB1

(Homo sapiens) 		PF00790
(VHS) 		4 ILE A  36
ALA A  70
VAL A  73
CYH A  77
 None
 0.77A 2vufB-1elkA:
0.3		 2vufB-1elkA:
15.09
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.
1guz MALATE DEHYDROGENASE

(Chlorobaculum
tepidum;
Prosthecochloris
vibrioformis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 ALA A 295
VAL A 298
CYH A 302
LYS A 303
 None
 0.88A 2vufB-1guzA:
0.0		 2vufB-1guzA:
18.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gv0 MALATE DEHYDROGENASE

(Chlorobaculum
tepidum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 ALA A 295
VAL A 298
CYH A 302
LYS A 303
 None
 0.76A 2vufB-1gv0A:
0.0		 2vufB-1gv0A:
20.10
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.
1gz6 ESTRADIOL 17
BETA-DEHYDROGENASE 4

(Rattus
norvegicus) 		PF00106
(adh_short) 		4 ILE A 147
ALA A 219
VAL A 222
CYH A 226
 None
 0.89A 2vufB-1gz6A:
undetectable		 2vufB-1gz6A:
18.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hqs ISOCITRATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00180
(Iso_dh) 		4 ILE A  34
ALA A 352
CYH A 411
LYS A 410
 None
 0.76A 2vufB-1hqsA:
undetectable		 2vufB-1hqsA:
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.
1hqs ISOCITRATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00180
(Iso_dh) 		4 ILE A  34
VAL A 357
CYH A 411
LYS A 410
 None
 0.98A 2vufB-1hqsA:
undetectable		 2vufB-1hqsA:
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.
1ktc ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Gallus gallus) 		PF16499
(Melibiase_2)
PF17450
(Melibiase_2_C) 		4 ILE A 102
ALA A 130
VAL A 134
LYS A  99
 None
 1.05A 2vufB-1ktcA:
undetectable		 2vufB-1ktcA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mpx ALPHA-AMINO ACID
ESTER HYDROLASE

(Xanthomonas
citri) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 ILE A 390
ARG A 406
ALA A 403
VAL A 388
 None
 0.95A 2vufB-1mpxA:
0.0		 2vufB-1mpxA:
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.
1mum 2-METHYLISOCITRATE
LYASE

(Escherichia
coli) 		PF13714
(PEP_mutase) 		4 ILE A 114
ALA A  94
VAL A  97
LYS A 102
 None
 0.68A 2vufB-1mumA:
undetectable		 2vufB-1mumA:
19.52
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.
1nex CDC4 PROTEIN

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12937
(F-box-like) 		4 ILE B 594
ARG B 655
ALA B 648
VAL B 635
 None
 1.02A 2vufB-1nexB:
undetectable		 2vufB-1nexB:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ovm INDOLE-3-PYRUVATE
DECARBOXYLASE

(Enterobacter
cloacae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 ILE A 402
ALA A  58
CYH A  65
LYS A  66
 None
 1.05A 2vufB-1ovmA:
undetectable		 2vufB-1ovmA:
21.80
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.
1phj TELOMERE-BINDING
PROTEIN BETA SUBUNIT

(Sterkiella nova) 		PF07404
(TEBP_beta) 		4 ILE B  88
ALA B  60
VAL B  52
CYH B  41
 None
 1.03A 2vufB-1phjB:
undetectable		 2vufB-1phjB:
17.40
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.
1qni NITROUS-OXIDE
REDUCTASE

(Marinobacter
hydrocarbonoclasticus) 		no annotation 4 ILE A 170
ALA A 106
VAL A 105
CYH A 143
 None
 1.02A 2vufB-1qniA:
undetectable		 2vufB-1qniA:
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.
1qo8 FLAVOCYTOCHROME C3
FUMARATE REDUCTASE

(Shewanella
frigidimarina) 		PF00890
(FAD_binding_2)
PF14537
(Cytochrom_c3_2) 		4 ILE A 371
ARG A 376
ALA A 412
VAL A 494
 None
 0.96A 2vufB-1qo8A:
undetectable		 2vufB-1qo8A:
21.37
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.
1rjw ALCOHOL
DEHYDROGENASE

(Geobacillus
stearothermophilus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 ILE A  85
ALA A 128
VAL A 131
LYS A 133
 None
 0.96A 2vufB-1rjwA:
undetectable		 2vufB-1rjwA:
19.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tf0 SERUM ALBUMIN

(Homo sapiens) 		PF00273
(Serum_albumin) 		4 ILE A 513
ALA A 552
VAL A 555
LYS A 560
 None
 0.59A 2vufB-1tf0A:
48.7		 2vufB-1tf0A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uli BIPHENYL DIOXYGENASE
LARGE SUBUNIT

(Rhodococcus
jostii) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 ILE A  91
ARG A  92
ALA A 154
VAL A 156
 None
 1.06A 2vufB-1uliA:
undetectable		 2vufB-1uliA:
19.14
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.
1v6t HYPOTHETICAL UPF0271
PROTEIN PH0986

(Pyrococcus
horikoshii) 		PF03746
(LamB_YcsF) 		4 ILE A 220
ALA A 193
VAL A 196
LYS A 201
 None
 1.06A 2vufB-1v6tA:
undetectable		 2vufB-1v6tA:
18.49
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.
1w9c CRM1 PROTEIN

(Homo sapiens) 		PF08767
(CRM1_C) 		4 ILE A 815
ALA A 805
VAL A 808
CYH A 859
 None
 0.92A 2vufB-1w9cA:
4.0		 2vufB-1w9cA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wk9 VALYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1) 		4 ILE A 210
ALA A 256
VAL A 228
LYS A 262
 None
 0.98A 2vufB-1wk9A:
undetectable		 2vufB-1wk9A:
14.60
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.
2bg5 PHOSPHOENOLPYRUVATE-
PROTEIN KINASE

(Caldanaerobacter
subterraneus) 		PF02896
(PEP-utilizers_C) 		4 ILE A 428
ALA A 443
VAL A 446
LYS A 425
 None
 0.95A 2vufB-2bg5A:
undetectable		 2vufB-2bg5A:
21.99
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.
2bll PROTEIN YFBG

(Escherichia
coli) 		PF01370
(Epimerase) 		4 ILE A 416
VAL A 386
CYH A 420
LYS A 425
 None
 1.06A 2vufB-2bllA:
undetectable		 2vufB-2bllA:
18.15
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.
2hqj PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Leishmania
major) 		PF00160
(Pro_isomerase) 		4 ARG A 101
ALA A  99
VAL A 138
CYH A 107
 None
 1.04A 2vufB-2hqjA:
undetectable		 2vufB-2hqjA:
14.60
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.
2i4c BICARBONATE
TRANSPORTER

(Synechocystis
sp. PCC 6803) 		PF13379
(NMT1_2) 		4 ILE A 249
ARG A 248
ALA A 225
VAL A 228
 None
 0.95A 2vufB-2i4cA:
undetectable		 2vufB-2i4cA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ioj HYPOTHETICAL PROTEIN
AF_1212

(Archaeoglobus
fulgidus) 		PF07085
(DRTGG) 		4 ILE A 212
ALA A 253
VAL A 230
LYS A 228
 None
 0.86A 2vufB-2iojA:
undetectable		 2vufB-2iojA:
11.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jgr YEGS

(Escherichia
coli) 		PF00781
(DAGK_cat) 		4 ILE A 216
ALA A 100
VAL A 103
CYH A 295
 None
 0.78A 2vufB-2jgrA:
undetectable		 2vufB-2jgrA:
19.35
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.
2jpi HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF09981
(DUF2218) 		4 ALA A  14
VAL A  17
CYH A  21
LYS A  22
 None
 0.88A 2vufB-2jpiA:
undetectable		 2vufB-2jpiA:
11.40
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.
2la3 UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		PF06042
(NTP_transf_6) 		4 ILE A  47
ARG A  44
ALA A  39
VAL A  43
 None
 1.07A 2vufB-2la3A:
undetectable		 2vufB-2la3A:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nch TRANSLATION
INITIATION FACTOR
IF-1

(Wolbachia
endosymbiont of
Brugia malayi) 		PF01176
(eIF-1a) 		4 ILE A  36
ALA A  16
VAL A  28
CYH A  38
 None
 1.02A 2vufB-2nchA:
undetectable		 2vufB-2nchA:
8.55
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.
2ooe CLEAVAGE STIMULATION
FACTOR 77 KDA
SUBUNIT

(Mus musculus) 		PF05843
(Suf) 		4 ILE A 293
ALA A 246
VAL A 249
LYS A 254
 None
 1.03A 2vufB-2ooeA:
undetectable		 2vufB-2ooeA:
23.34
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.
2ox6 HYPOTHETICAL PROTEIN
SO3848

(Shewanella
oneidensis) 		PF14590
(DUF4447) 		4 ILE A 120
ALA A  86
VAL A 132
CYH A 124
 None
 0.93A 2vufB-2ox6A:
undetectable		 2vufB-2ox6A:
13.58
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.
2p4b SIGMA-E FACTOR
REGULATORY PROTEIN
RSEB

(Escherichia
coli) 		PF03888
(MucB_RseB)
PF17188
(MucB_RseB_C) 		4 ILE A 136
ARG A 139
ALA A 187
VAL A 185
 None
 0.95A 2vufB-2p4bA:
undetectable		 2vufB-2p4bA:
20.48
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.
2qg7 ETHANOLAMINE KINASE
PV091845

(Plasmodium
vivax) 		PF01633
(Choline_kinase) 		4 ILE A 415
VAL A 279
CYH A 283
LYS A 284
 None
 1.07A 2vufB-2qg7A:
1.1		 2vufB-2qg7A:
18.90
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.
2voa EXODEOXYRIBONUCLEASE
III

(Archaeoglobus
fulgidus) 		PF03372
(Exo_endo_phos) 		4 ILE A   4
ALA A  94
VAL A 101
CYH A 144
 None
 0.79A 2vufB-2voaA:
undetectable		 2vufB-2voaA:
19.24
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.
2wym L-ASCORBATE-6-PHOSPH
ATE LACTONASE ULAG

(Escherichia
coli) 		PF13483
(Lactamase_B_3) 		4 ILE A 107
ALA A 128
VAL A 131
CYH A 135
 GOL  A1343 (-3.9A)
None
None
None
 1.04A 2vufB-2wymA:
undetectable		 2vufB-2wymA:
20.03
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.
2xdp LYSINE-SPECIFIC
DEMETHYLASE 4C

(Homo sapiens) 		PF09465
(LBR_tudor) 		4 ILE A 983
ALA A 901
VAL A 899
CYH A 897
 None
 1.03A 2vufB-2xdpA:
undetectable		 2vufB-2xdpA:
12.85
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.
2xdp LYSINE-SPECIFIC
DEMETHYLASE 4C

(Homo sapiens) 		PF09465
(LBR_tudor) 		4 ILE A 983
ALA A 977
VAL A 968
CYH A 897
 None
 1.05A 2vufB-2xdpA:
undetectable		 2vufB-2xdpA:
12.85
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.
2xwu IMPORTIN13

(Homo sapiens) 		PF03810
(IBN_N)
PF08389
(Xpo1) 		4 ILE B 764
ALA B 721
VAL B 724
CYH B 728
 None
 0.91A 2vufB-2xwuB:
4.0		 2vufB-2xwuB:
21.81
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.
2yc2 SMALL RAB-RELATED
GTPASE

(Chlamydomonas
reinhardtii) 		PF00071
(Ras) 		4 ILE C 182
ALA C  20
VAL C  19
CYH C  17
 None
 1.03A 2vufB-2yc2C:
undetectable		 2vufB-2yc2C:
16.24
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.
2ylf PROTEIN SPIRE
HOMOLOG 1

(Homo sapiens) 		PF16474
(KIND) 		4 ILE A  88
ALA A  58
VAL A  61
CYH A  65
 None
 0.99A 2vufB-2ylfA:
undetectable		 2vufB-2ylfA:
16.70
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.
3bsx PUMILIO HOMOLOG 1

(Homo sapiens) 		PF00806
(PUF) 		4 ILE A1061
ALA A1078
VAL A1081
CYH A1085
 None
 1.06A 2vufB-3bsxA:
undetectable		 2vufB-3bsxA:
20.34
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.
3cc1 PUTATIVE
ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Bacillus
halodurans) 		PF16499
(Melibiase_2) 		4 ILE A 111
ALA A 173
VAL A 177
LYS A 108
 None
 0.94A 2vufB-3cc1A:
undetectable		 2vufB-3cc1A:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ccg HD SUPERFAMILY
HYDROLASE

(Clostridium
acetobutylicum) 		PF01966
(HD) 		4 ILE A  97
ALA A  47
VAL A  50
CYH A  53
 None
 0.84A 2vufB-3ccgA:
undetectable		 2vufB-3ccgA:
14.73
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.
3clh 3-DEHYDROQUINATE
SYNTHASE

(Helicobacter
pylori) 		PF01761
(DHQ_synthase) 		4 ILE A 175
ALA A 123
VAL A 125
LYS A 210
 None
NAD  A 400 ( 4.6A)
None
None
 0.96A 2vufB-3clhA:
undetectable		 2vufB-3clhA:
21.09
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.
3ctp PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Alkaliphilus
metalliredigens) 		PF13377
(Peripla_BP_3) 		4 ILE A 229
ALA A 243
VAL A 246
LYS A 251
 None
 1.04A 2vufB-3ctpA:
undetectable		 2vufB-3ctpA:
20.64
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.
3eni BACTERIOCHLOROPHYLL
A PROTEIN

(Chlorobaculum
tepidum) 		PF02327
(BChl_A) 		4 ALA A 345
VAL A 348
CYH A 352
LYS A 353
 None
BCL  A 374 ( 4.1A)
BCL  A 373 ( 3.8A)
None
 0.50A 2vufB-3eniA:
undetectable		 2vufB-3eniA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eoj BACTERIOCHLOROPHYLL
A PROTEIN

(Prosthecochloris
aestuarii) 		PF02327
(BChl_A) 		4 ALA A 346
VAL A 349
CYH A 353
LYS A 354
 None
BCL  A 374 ( 4.0A)
BCL  A 373 ( 3.8A)
None
 0.52A 2vufB-3eojA:
2.3		 2vufB-3eojA:
17.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fhm UNCHARACTERIZED
PROTEIN ATU1752

(Agrobacterium
fabrum) 		PF00571
(CBS) 		4 ILE A 118
ALA A 115
VAL A 108
CYH A  85
 None
 1.07A 2vufB-3fhmA:
undetectable		 2vufB-3fhmA:
14.73
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.
3h55 ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Homo sapiens) 		PF16499
(Melibiase_2)
PF17450
(Melibiase_2_C) 		4 ILE A 118
ALA A 146
VAL A 150
LYS A 115
 None
None
None
CIT  A1100 (-2.7A)
 1.02A 2vufB-3h55A:
undetectable		 2vufB-3h55A:
20.03
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.
3hib PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF02889
(Sec63) 		4 ILE A2019
ARG A2027
ALA A2042
VAL A2045
 None
 1.03A 2vufB-3hibA:
1.8		 2vufB-3hibA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ic6 PUTATIVE METHYLASE
FAMILY PROTEIN

(Neisseria
gonorrhoeae) 		PF00588
(SpoU_methylase) 		4 ILE A  17
ALA A 177
VAL A 180
CYH A 184
 None
 0.88A 2vufB-3ic6A:
undetectable		 2vufB-3ic6A:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j0l RIBOSOMAL PROTEIN
S14

(Oryctolagus
cuniculus) 		PF00411
(Ribosomal_S11) 		4 ALA K  78
VAL K  81
CYH K  85
LYS K  86
 None
 0.97A 2vufB-3j0lK:
undetectable		 2vufB-3j0lK:
12.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oml PEROXISOMAL
MULTIFUNCTIONAL
ENZYME TYPE 2,
CG3415

(Drosophila
melanogaster) 		PF00106
(adh_short)
PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		4 ILE A 150
ALA A 222
VAL A 225
CYH A 229
 None
 0.95A 2vufB-3omlA:
undetectable		 2vufB-3omlA:
23.41
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.
3pm9 PUTATIVE
OXIDOREDUCTASE

(Rhodopseudomonas
palustris) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		4 ILE A 215
VAL A  63
CYH A  67
LYS A  68
 FAD  A 476 (-4.6A)
None
None
None
 0.94A 2vufB-3pm9A:
undetectable		 2vufB-3pm9A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qc0 SUGAR ISOMERASE

(Sinorhizobium
meliloti) 		PF01261
(AP_endonuc_2) 		4 ILE A 248
ALA A 259
VAL A 262
CYH A 266
 None
 1.02A 2vufB-3qc0A:
undetectable		 2vufB-3qc0A:
17.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r7g PROTEIN SPIRE
HOMOLOG 1

(Homo sapiens) 		PF16474
(KIND) 		4 ILE A  88
ALA A  58
VAL A  61
CYH A  65
 None
 1.05A 2vufB-3r7gA:
undetectable		 2vufB-3r7gA:
16.44
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.
3rlc A1 PROTEIN

(Escherichia
virus Qbeta) 		PF16814
(Read-through) 		4 ILE A 233
ALA A 304
CYH A 317
LYS A 316
 None
 0.97A 2vufB-3rlcA:
undetectable		 2vufB-3rlcA:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		4 ILE A 413
ALA A 374
VAL A 377
CYH A 381
 None
 0.89A 2vufB-3swdA:
undetectable		 2vufB-3swdA:
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.
3tqi GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Coxiella
burnetii) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 ILE A  10
ALA A 195
VAL A 198
CYH A 204
 None
 1.00A 2vufB-3tqiA:
undetectable		 2vufB-3tqiA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vcy UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Aliivibrio
fischeri) 		PF00275
(EPSP_synthase) 		4 ILE A 414
ALA A 375
VAL A 378
CYH A 382
 None
 0.89A 2vufB-3vcyA:
undetectable		 2vufB-3vcyA:
22.04
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.
3wxo CATALASE-PEROXIDASE

(Synechococcus
elongatus) 		PF00141
(peroxidase) 		4 ILE A 452
ARG A 451
ALA A 519
VAL A 524
 None
 1.05A 2vufB-3wxoA:
undetectable		 2vufB-3wxoA:
22.06
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.
4c0d CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 ILE A1993
ARG A1992
ALA A1938
VAL A1940
 None
 0.98A 2vufB-4c0dA:
2.5		 2vufB-4c0dA:
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.
4gp1 POLYPRENYL
SYNTHETASE

(Pyrobaculum
calidifontis) 		PF00348
(polyprenyl_synt) 		4 ILE A 120
ALA A 134
VAL A 137
LYS A 142
 None
 1.04A 2vufB-4gp1A:
undetectable		 2vufB-4gp1A:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hyr GLUCARATE
DEHYDRATASE

(Acidaminococcus
intestini) 		PF13378
(MR_MLE_C) 		4 ALA A 181
VAL A 184
CYH A 188
LYS A 189
 None
 0.97A 2vufB-4hyrA:
undetectable		 2vufB-4hyrA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i3m AEROTAXIS TRANSDUCER
AER2

(Pseudomonas
aeruginosa) 		no annotation 4 ILE A 148
ARG A 152
ALA A 124
VAL A 121
 None
SO4  A 202 (-3.0A)
None
None
 1.07A 2vufB-4i3mA:
undetectable		 2vufB-4i3mA:
12.86
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.
4ixu ARGINASE-2,
MITOCHONDRIAL

(Homo sapiens) 		PF00491
(Arginase) 		4 ILE A  29
ALA A 100
VAL A 103
CYH A 113
 None
 0.98A 2vufB-4ixuA:
undetectable		 2vufB-4ixuA:
20.03
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.
4lms CRYPTOPHYTE
PHYCOCYANIN (BETA
CHAIN)

(Chroomonas sp.) 		PF00502
(Phycobilisome) 		4 ILE B  89
ALA B 128
VAL B 131
LYS B 135
 None
 0.98A 2vufB-4lmsB:
3.1		 2vufB-4lmsB:
15.24
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.
4noc PUTATIVE SIGNAL
TRANSDUCTION PROTEIN
WITH CBS DOMAINS

(Kribbella
flavida) 		PF00571
(CBS) 		4 ILE A 114
ALA A 124
VAL A 123
CYH A 120
 None
 0.96A 2vufB-4nocA:
undetectable		 2vufB-4nocA:
14.73
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.
4o3v VIRB8-LIKE PROTEIN
OF TYPE IV SECRETION
SYSTEM

(Rickettsia
typhi) 		PF04335
(VirB8) 		4 ILE A 197
ARG A 108
ALA A 126
VAL A 218
 None
 1.02A 2vufB-4o3vA:
undetectable		 2vufB-4o3vA:
14.48
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.
4pnh D,D-HEPTOSE
1,7-BISPHOSPHATE
PHOSPHATASE

(Burkholderia
thailandensis) 		PF13242
(Hydrolase_like) 		4 ILE A 116
ARG A 119
ALA A  91
VAL A  53
 None
 0.93A 2vufB-4pnhA:
2.1		 2vufB-4pnhA:
15.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qav 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Neisseria
meningitidis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 ILE A 395
ALA A 280
VAL A 283
LYS A 288
 None
 1.00A 2vufB-4qavA:
undetectable		 2vufB-4qavA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r7u UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Vibrio cholerae) 		PF00275
(EPSP_synthase) 		4 ILE A 414
ALA A 375
VAL A 378
CYH A 382
 None
 0.83A 2vufB-4r7uA:
undetectable		 2vufB-4r7uA:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zhy YFIR

(Pseudomonas
aeruginosa) 		PF13689
(DUF4154) 		4 ILE A 113
ARG A  99
ALA A 100
VAL A  73
 None
None
SO4  A 201 (-3.6A)
None
 0.90A 2vufB-4zhyA:
undetectable		 2vufB-4zhyA:
15.87
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.
4zmu DIGUANYLATE CYCLASE

(Pseudomonas
aeruginosa) 		PF00990
(GGDEF)
PF01590
(GAF) 		4 ILE A 226
ALA A 242
VAL A 238
CYH A 294
 None
 1.05A 2vufB-4zmuA:
undetectable		 2vufB-4zmuA:
22.35
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.
5agy GLUTATHIONE
S-TRANSFERASE

(Glycine max) 		PF02798
(GST_N)
PF13410
(GST_C_2) 		4 ILE A 155
ARG A  18
ALA A  70
VAL A  71
 None
GTB  A1222 ( 4.9A)
None
None
 1.03A 2vufB-5agyA:
3.4		 2vufB-5agyA:
16.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cee NAD-DEPENDENT MALIC
ENZYME

(Aster yellows
witches'-broom
phytoplasma) 		PF00390
(malic)
PF03949
(Malic_M) 		4 ILE A 335
ALA A 375
VAL A 378
LYS A 383
 None
 0.98A 2vufB-5ceeA:
2.6		 2vufB-5ceeA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ch8 MONO- AND
DIACYLGLYCEROL
LIPASE

(Penicillium
cyclopium) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		4 ILE A 185
ARG A 193
ALA A 149
VAL A 176
 None
 1.03A 2vufB-5ch8A:
undetectable		 2vufB-5ch8A:
19.10
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.
5fjp O-SUCCINYLBENZOATE
SYNTHASE

(Amycolatopsis
sp.) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A 242
ALA A 273
VAL A 276
CYH A 280
 None
 1.02A 2vufB-5fjpA:
undetectable		 2vufB-5fjpA:
23.12
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.
5fu7 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 ILE A1993
ARG A1992
ALA A1938
VAL A1940
 None
 0.95A 2vufB-5fu7A:
1.8		 2vufB-5fu7A:
22.07
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 ILE A 541
ARG A 524
ALA A 591
VAL A 606
 None
 0.88A 2vufB-5i2tA:
undetectable		 2vufB-5i2tA:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ioj HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 4 ILE A 419
ARG A 417
ALA A 331
VAL A 360
 None
 1.04A 2vufB-5iojA:
undetectable		 2vufB-5iojA:
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.
5kod INDOLE-3-ACETIC
ACID-AMIDO
SYNTHETASE GH3.5

(Arabidopsis
thaliana) 		PF03321
(GH3) 		4 ALA A 283
VAL A 286
CYH A 290
LYS A 291
 None
 0.79A 2vufB-5kodA:
undetectable		 2vufB-5kodA:
23.81
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.
5kuf GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
2

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 ILE A  75
ALA A  84
VAL A  87
CYH A  91
 None
 1.03A 2vufB-5kufA:
undetectable		 2vufB-5kufA:
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.
5l6s GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE

(Escherichia
coli) 		PF00483
(NTP_transferase) 		4 ILE A 245
ALA A 166
VAL A 165
CYH A 163
 None
 1.07A 2vufB-5l6sA:
undetectable		 2vufB-5l6sA:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mpx MULTIPLE ORGANELLAR
RNA EDITING FACTOR
1, MITOCHONDRIAL

(Arabidopsis
thaliana) 		no annotation 4 ILE A 186
ALA A 110
VAL A 109
CYH A 134
 None
 0.95A 2vufB-5mpxA:
undetectable		 2vufB-5mpxA:
12.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mu7 COATOMER SUBUNIT
DELTA-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF01217
(Clat_adaptor_s) 		4 ILE B 102
ALA B  87
VAL B  90
CYH B  94
 None
 0.88A 2vufB-5mu7B:
undetectable		 2vufB-5mu7B:
14.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ner O PANASIA VP2

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		4 ILE 2 132
ALA 2 124
VAL 2 180
CYH 2  78
 None
 0.96A 2vufB-5ner2:
undetectable		 2vufB-5ner2:
16.15
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.
5nfr MALATE DEHYDROGENASE

(Plasmodium
falciparum) 		no annotation 4 ILE A  73
ALA A 102
VAL A 105
CYH A 109
 None
 1.03A 2vufB-5nfrA:
undetectable		 2vufB-5nfrA:
7.92
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.
5o7g ALPHA/BETA HYDROLASE
FAMILY PROTEIN

(Bacillus
coagulans) 		no annotation 4 ILE A 243
ARG A 121
ALA A 125
VAL A 237
 None
 1.02A 2vufB-5o7gA:
undetectable		 2vufB-5o7gA:
7.04
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.
5u32 TRNA LIGASE

(Candida
albicans) 		no annotation 4 ILE A 486
ARG A 483
ALA A 508
VAL A 416
 None
 0.99A 2vufB-5u32A:
undetectable		 2vufB-5u32A:
17.25
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.
5vj1 MDCA

(Pseudomonas
aeruginosa) 		PF16957
(Mal_decarbox_Al) 		4 ILE A  47
ALA A 150
VAL A 149
LYS A  18
 None
 1.05A 2vufB-5vj1A:
undetectable		 2vufB-5vj1A:
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.
5xk2 DIACYLGLYCEROL
LIPASE

(Aspergillus
oryzae) 		no annotation 4 ILE A 192
ARG A 200
ALA A 157
VAL A 183
 None
 1.05A 2vufB-5xk2A:
undetectable		 2vufB-5xk2A:
10.14
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.
5xvd HYDROGENASE-2 SMALL
CHAIN

(Citrobacter sp.
MGH106) 		no annotation 4 ILE S 191
ALA S 250
VAL S 249
CYH S 226
 None
None
SF4  S 401 ( 4.9A)
SF4  S 401 (-2.3A)
 1.04A 2vufB-5xvdS:
undetectable		 2vufB-5xvdS:
9.85
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.
5ykh PUMILIO HOMOLOG 1

(Homo sapiens) 		no annotation 4 ILE A 162
ALA A 179
VAL A 182
CYH A 186
 None
 0.95A 2vufB-5ykhA:
undetectable		 2vufB-5ykhA:
8.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ykh PUMILIO HOMOLOG 1

(Homo sapiens) 		no annotation 4 ILE A 277
ALA A 294
VAL A 297
CYH A 301
 None
 0.93A 2vufB-5ykhA:
undetectable		 2vufB-5ykhA:
8.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6az1 RIBOSOMAL PROTEIN S3

(Leishmania
donovani) 		no annotation 4 ILE C 121
ALA C 170
VAL C 185
CYH C 133
 None
 0.82A 2vufB-6az1C:
undetectable		 2vufB-6az1C:
8.85
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.
6d4j PROTEIN PATCHED
HOMOLOG 1

(Homo sapiens) 		no annotation 4 ILE A 805
ALA A 990
VAL A 994
CYH A 998
 None
 0.85A 2vufB-6d4jA:
undetectable		 2vufB-6d4jA:
8.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6en9 HYDROGENASE-2 SMALL
CHAIN

(Escherichia
coli) 		no annotation 4 ILE S 191
ALA S 250
VAL S 249
CYH S 226
 None
None
SF4  S 301 ( 4.9A)
SF4  S 301 (-2.3A)
 1.03A 2vufB-6en9S:
undetectable		 2vufB-6en9S:
9.11