SIMILAR PATTERNS OF AMINO ACIDS FOR 3BJW_A_SVRA508

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.
1aye PROCARBOXYPEPTIDASE
A2

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 GLN A 285
PHE A  95
ARG A 124
ARG A 272
 None
 1.42A 3bjwE-1ayeA:
0.0		 3bjwE-1ayeA:
13.89
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.
1gqj ALPHA-D-GLUCURONIDAS
E

(Cellvibrio
japonicus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		4 VAL A 620
GLN A 627
PHE A 395
ARG A 660
 None
EDO  A1718 (-4.3A)
None
None
 1.45A 3bjwE-1gqjA:
0.0		 3bjwE-1gqjA:
10.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ixp PYRIDOXINE
5'-PHOSPHATE
SYNTHASE

(Escherichia
coli) 		PF03740
(PdxJ) 		4 VAL A 147
GLN A 140
PHE A 151
ARG A 117
 None
 1.45A 3bjwE-1ixpA:
0.0		 3bjwE-1ixpA:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kaq NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Bacillus
subtilis) 		PF01467
(CTP_transf_like) 		4 VAL A  75
GLN A  40
PHE A   7
ARG A  95
 None
None
DND  A 601 (-4.2A)
None
 1.33A 3bjwE-1kaqA:
0.0		 3bjwE-1kaqA:
16.32
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.
1kaq NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Bacillus
subtilis) 		PF01467
(CTP_transf_like) 		4 VAL A  75
GLN A  40
PHE A  36
ARG A  95
 None
 1.32A 3bjwE-1kaqA:
0.0		 3bjwE-1kaqA:
16.32
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.
1ldj CULLIN HOMOLOG 1

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		4 VAL A 686
GLN A 602
PHE A 606
ARG A 681
 None
 1.41A 3bjwE-1ldjA:
0.0		 3bjwE-1ldjA:
8.36
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.
1lsh LIPOVITELLIN (LV-1N,
LV-1C)

(Ichthyomyzon
unicuspis) 		PF01347
(Vitellogenin_N)
PF09172
(DUF1943) 		4 VAL A 365
GLN A 345
PHE A 335
ARG A 379
 None
 1.45A 3bjwE-1lshA:
0.0		 3bjwE-1lshA:
7.25
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.
1ndf CARNITINE
ACETYLTRANSFERASE

(Mus musculus) 		PF00755
(Carn_acyltransf) 		4 VAL A 114
GLN A 328
PHE A 566
ARG A 256
 None
None
152  A5001 (-3.3A)
None
 1.09A 3bjwE-1ndfA:
0.0		 3bjwE-1ndfA:
11.13
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.
1u2x ADP-SPECIFIC
PHOSPHOFRUCTOKINASE

(Pyrococcus
horikoshii) 		PF04587
(ADP_PFK_GK) 		4 VAL A  94
GLN A 287
PHE A 214
ARG A  81
 None
 1.44A 3bjwE-1u2xA:
0.0		 3bjwE-1u2xA:
12.17
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.
1w9x ALPHA AMYLASE

(Bacillus
halmapalus) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 VAL A 120
GLN A 129
PHE A 173
ARG A 181
 None
 1.49A 3bjwE-1w9xA:
0.0		 3bjwE-1w9xA:
13.44
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.
1y56 HYPOTHETICAL PROTEIN
PH1363

(Pyrococcus
horikoshii) 		PF07992
(Pyr_redox_2)
PF13510
(Fer2_4) 		4 VAL A 422
GLN A 411
PHE A 454
ARG A  50
 None
 1.45A 3bjwE-1y56A:
undetectable		 3bjwE-1y56A:
13.03
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.
2gkw TNF
RECEPTOR-ASSOCIATED
FACTOR 3
TUMOR NECROSIS
FACTOR RECEPTOR
SUPERFAMILY MEMBER
13C

(;
Homo sapiens) 		no annotation 4 VAL B 174
GLN A 343
PHE A 381
ARG A 364
 None
 1.14A 3bjwE-2gkwB:
undetectable		 3bjwE-2gkwB:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h8l PROTEIN
DISULFIDE-ISOMERASE
A3

(Homo sapiens) 		PF13848
(Thioredoxin_6) 		4 VAL A 325
GLN A 339
PHE A 299
ARG A 304
 None
 1.40A 3bjwE-2h8lA:
undetectable		 3bjwE-2h8lA:
21.18
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.
2jbw 2,6-DIHYDROXY-PSEUDO
-OXYNICOTINE
HYDROLASE

(Paenarthrobacter
nicotinovorans) 		PF06500
(DUF1100) 		4 VAL A  99
GLN A  83
PHE A 155
ARG A  91
 None
 1.38A 3bjwE-2jbwA:
undetectable		 3bjwE-2jbwA:
13.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nlk PROTEIN TYROSINE
PHOSPHATASE,
RECEPTOR TYPE, G
VARIANT (FRAGMENT)

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 VAL A1056
PHE A 994
ARG A1049
ARG A1099
 None
 1.42A 3bjwE-2nlkA:
undetectable		 3bjwE-2nlkA:
11.97
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.
2obe HEXON

(Human
mastadenovirus
E) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		4 VAL A 372
GLN A 574
ARG A 361
ARG A 311
 None
 1.32A 3bjwE-2obeA:
undetectable		 3bjwE-2obeA:
7.51
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 VAL A 671
PHE A 656
ARG A 618
ARG A 622
 None
 1.29A 3bjwE-2x40A:
undetectable		 3bjwE-2x40A:
10.80
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.
2zyi LIPASE, PUTATIVE

(Archaeoglobus
fulgidus) 		PF00561
(Abhydrolase_1) 		4 VAL A  25
GLN A  41
PHE A  58
ARG A  44
 None
 1.35A 3bjwE-2zyiA:
undetectable		 3bjwE-2zyiA:
13.12
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.
3c4n UNCHARACTERIZED
PROTEIN DR_0571

(Deinococcus
radiodurans) 		PF01266
(DAO) 		4 VAL A 288
GLN A 281
ARG A 255
ARG A 170
 None
 1.39A 3bjwE-3c4nA:
0.7		 3bjwE-3c4nA:
12.14
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.
3dhv D-ALANINE-POLY(PHOSP
HORIBITOL) LIGASE

(Bacillus cereus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 VAL A 493
GLN A 482
PHE A 245
ARG A 495
 None
 1.32A 3bjwE-3dhvA:
undetectable		 3bjwE-3dhvA:
11.22
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.
3e29 UNCHARACTERIZED
PROTEIN Q7WE92_BORBR

(Bordetella
bronchiseptica) 		PF03061
(4HBT) 		4 VAL A  35
GLN A 101
PHE A  12
ARG A  97
 None
 1.26A 3bjwE-3e29A:
undetectable		 3bjwE-3e29A:
18.92
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.
3e7f 6-PHOSPHOGLUCONOLACT
ONASE

(Trypanosoma
brucei) 		PF01182
(Glucosamine_iso) 		4 VAL A 126
PHE A 105
ARG A 125
ARG A 200
 None
None
None
6PG  A 843 (-2.7A)
 1.40A 3bjwE-3e7fA:
undetectable		 3bjwE-3e7fA:
19.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gl3 PUTATIVE
THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBE

(Chlorobaculum
tepidum) 		PF08534
(Redoxin) 		4 VAL A  56
GLN A  80
PHE A 136
ARG A 140
 None
 0.96A 3bjwE-3gl3A:
undetectable		 3bjwE-3gl3A:
20.13
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.
3i4x TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Aspergillus
fumigatus) 		PF11991
(Trp_DMAT) 		4 VAL A 211
GLN A 335
PHE A 141
ARG A 220
 None
 1.30A 3bjwE-3i4xA:
undetectable		 3bjwE-3i4xA:
13.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3izy TRANSLATION
INITIATION FACTOR
IF-2, MITOCHONDRIAL

(Bos taurus) 		PF00009
(GTP_EFTU)
PF11987
(IF-2) 		4 VAL P 444
GLN P 453
ARG P 382
ARG P 439
 None
 1.49A 3bjwE-3izyP:
undetectable		 3bjwE-3izyP:
10.53
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.
3kdn RIBULOSE
BISPHOSPHATE
CARBOXYLASE

(Thermococcus
kodakarensis) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 VAL A 349
GLN A 332
PHE A  29
ARG A 335
 None
 1.48A 3bjwE-3kdnA:
undetectable		 3bjwE-3kdnA:
13.24
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.
3p8t ASNS-LIKE
ASPARAGINYL-TRNA
SYNTHETASE RELATED
PROTEIN

(Pyrococcus
abyssi) 		PF00152
(tRNA-synt_2) 		4 VAL A 287
PHE A 284
ARG A 103
ARG A 109
 None
 1.39A 3bjwE-3p8tA:
undetectable		 3bjwE-3p8tA:
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.
3qci RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 VAL A1056
PHE A 994
ARG A1049
ARG A1099
 None
 1.45A 3bjwE-3qciA:
undetectable		 3bjwE-3qciA:
15.53
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.
3u1k POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL

(Homo sapiens) 		PF00013
(KH_1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		4 VAL A 610
GLN A 641
PHE A 650
ARG A 617
 None
 1.41A 3bjwE-3u1kA:
undetectable		 3bjwE-3u1kA:
10.03
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.
4bzi SEC23P

(Saccharomyces
cerevisiae) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		4 VAL A 300
GLN A 320
PHE A 328
ARG A 257
 None
 1.18A 3bjwE-4bziA:
undetectable		 3bjwE-4bziA:
10.73
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.
4evz HISF-LUCA

(synthetic
construct) 		PF00977
(His_biosynth) 		4 VAL A 154
PHE A 141
ARG A 158
ARG A 188
 None
 1.47A 3bjwE-4evzA:
undetectable		 3bjwE-4evzA:
15.77
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.
4f2e CUPA

(Streptococcus
pneumoniae) 		PF13473
(Cupredoxin_1) 		4 VAL A  65
PHE A  83
ARG A  42
ARG A  68
 None
 1.45A 3bjwE-4f2eA:
undetectable		 3bjwE-4f2eA:
17.56
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.
4f6a BH1408 PROTEIN

(Bacillus
halodurans) 		PF00583
(Acetyltransf_1) 		4 VAL A  58
PHE A 110
ARG A   4
ARG A  16
 None
 1.05A 3bjwE-4f6aA:
undetectable		 3bjwE-4f6aA:
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.
4f7k LACCASE

(uncultured
bacterium) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 VAL A 400
GLN A 253
PHE A 371
ARG A 395
 None
 1.32A 3bjwE-4f7kA:
undetectable		 3bjwE-4f7kA:
11.75
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.
4gi2 CROTONYL-COA
CARBOXYLASE/REDUCTAS
E

(Methylobacterium
extorquens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 VAL A 128
GLN A 170
PHE A 166
ARG A 172
 None
 1.46A 3bjwE-4gi2A:
undetectable		 3bjwE-4gi2A:
12.39
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.
4h2h MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Salipiger
bermudensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 VAL A 139
GLN A 148
ARG A 167
ARG A 147
 None
 1.41A 3bjwE-4h2hA:
undetectable		 3bjwE-4h2hA:
14.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4igl YENB

(Yersinia
entomophaga) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		4 VAL A 268
GLN A 210
PHE A 265
ARG A 274
 None
 1.34A 3bjwE-4iglA:
undetectable		 3bjwE-4iglA:
5.57
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.
4nc6 RAB
GTPASE-ACTIVATING
PROTEIN 1

(Homo sapiens) 		PF00566
(RabGAP-TBC) 		4 VAL A 589
GLN A 577
PHE A 676
ARG A 593
 None
 1.39A 3bjwE-4nc6A:
undetectable		 3bjwE-4nc6A:
16.43
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.
4o26 TELOMERASE REVERSE
TRANSCRIPTASE

(Oryzias latipes) 		PF12009
(Telomerase_RBD) 		4 VAL A 350
GLN A 510
PHE A 519
ARG A 506
 None
None
None
U  E 182 ( 4.0A)
 1.33A 3bjwE-4o26A:
undetectable		 3bjwE-4o26A:
16.94
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.
4p7y METHIONINE
GAMMA-LYASE

(Citrobacter
freundii) 		PF01053
(Cys_Met_Meta_PP) 		4 VAL A 204
GLN A 195
PHE A 188
ARG A  78
 None
1PE  A 402 (-4.0A)
None
None
 1.43A 3bjwE-4p7yA:
undetectable		 3bjwE-4p7yA:
13.92
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.
4uw2 CSM1

(Thermococcus
onnurineus) 		PF01966
(HD) 		4 GLN A 481
PHE A 296
ARG A 214
ARG A 171
 None
 1.33A 3bjwE-4uw2A:
undetectable		 3bjwE-4uw2A:
8.94
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.
4y0e PUTATIVE DIOXYGENASE

(Mycobacteroides
abscessus) 		PF02668
(TauD) 		4 VAL A 284
GLN A 294
PHE A 109
ARG A 291
 None
 1.36A 3bjwE-4y0eA:
undetectable		 3bjwE-4y0eA:
14.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ysb METALLO-BETA-LACTAMA
SE FAMILY PROTEIN

(Myxococcus
xanthus) 		PF00753
(Lactamase_B) 		4 VAL A  77
PHE A 104
ARG A  70
ARG A 221
 None
 1.32A 3bjwE-4ysbA:
undetectable		 3bjwE-4ysbA:
17.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e66 HEMAGGLUTININ-ESTERA
SE

(Influenza D
virus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		4 VAL A 116
PHE A 138
ARG A  58
ARG A 327
 CAC  A 501 (-4.7A)
None
None
None
 1.49A 3bjwE-5e66A:
undetectable		 3bjwE-5e66A:
16.62
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.
5efv PHI ETA ORF 56-LIKE
PROTEIN

(Staphylococcus
virus 11) 		no annotation 4 VAL A 426
GLN A 148
PHE A 152
ARG A 142
 None
 0.93A 3bjwE-5efvA:
undetectable		 3bjwE-5efvA:
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.
5fp1 TONB-DEPENDENT
SIDEROPHORE RECEPTOR

(Acinetobacter
baumannii) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 VAL A  54
GLN A 678
PHE A 109
ARG A  62
 None
 1.34A 3bjwE-5fp1A:
undetectable		 3bjwE-5fp1A:
9.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jxu DYP-TYPE PEROXIDASE
FAMILY

(Thermomonospora
curvata) 		PF04261
(Dyp_perox) 		4 VAL A 252
GLN A 196
PHE A 125
ARG A 255
 None
 1.46A 3bjwE-5jxuA:
undetectable		 3bjwE-5jxuA:
14.03
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.
5kqi CATALASE-PEROXIDASE

(Burkholderia
pseudomallei) 		PF00141
(peroxidase) 		4 VAL A 652
PHE A 601
ARG A 649
ARG A 656
 None
None
None
MPD  A 808 ( 4.0A)
 1.30A 3bjwE-5kqiA:
undetectable		 3bjwE-5kqiA:
9.75
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.
5ldn HEXON PROTEIN,HEXON
CAPSID

(Human
mastadenovirus
C) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		4 VAL A 390
GLN A 593
ARG A 379
ARG A 329
 None
 1.32A 3bjwE-5ldnA:
undetectable		 3bjwE-5ldnA:
8.29
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.
5my0 FATTY ACID SYNTHASE

(Mus musculus) 		no annotation 4 VAL B 527
GLN B 596
PHE B 553
ARG B 522
 None
 1.30A 3bjwE-5my0B:
undetectable		 3bjwE-5my0B:
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.
5nfb GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		4 VAL A 172
PHE A 149
ARG A 186
ARG A 169
 None
None
8VT  A 301 (-3.4A)
None
 1.43A 3bjwE-5nfbA:
undetectable		 3bjwE-5nfbA:
19.76
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.
5owj TRIGGER FACTOR

(Escherichia
coli) 		no annotation 4 VAL A 258
GLN A 191
PHE A 252
ARG A 193
 None
 1.27A 3bjwE-5owjA:
undetectable		 3bjwE-5owjA:
13.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w7c ACYLOXYACYL
HYDROLASE

(Homo sapiens) 		no annotation 4 VAL C 180
GLN C 335
PHE C 193
ARG C 356
 None
 1.29A 3bjwE-5w7cC:
undetectable		 3bjwE-5w7cC:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bka NITRONATE
MONOOXYGENASE

(Cyberlindnera
mrakii) 		no annotation 4 VAL A 168
GLN A 190
PHE A 234
ARG A 198
 None
FMN  A 401 (-3.9A)
None
None
 1.46A 3bjwE-6bkaA:
undetectable		 3bjwE-6bkaA:
20.87
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.
6egx STRUCTURAL PROTEIN
VP1
STRUCTURAL PROTEIN
VP2

(Sacbrood virus) 		no annotation 4 VAL A 176
GLN B 138
PHE B 134
ARG A 184
 None
 1.38A 3bjwE-6egxA:
undetectable		 3bjwE-6egxA:
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.
6fof GALECTIN-3,GALECTIN-
3

(Homo sapiens) 		no annotation 4 VAL C 172
PHE C 149
ARG C 186
ARG C 169
 None
None
LAT  C 301 (-4.0A)
None
 1.38A 3bjwE-6fofC:
undetectable		 3bjwE-6fofC:
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.
1a4i METHYLENETETRAHYDROF
OLATE DEHYDROGENASE
/
METHENYLTETRAHYDROFO
LATE CYCLOHYDROLASE

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 VAL A 271
GLY A 273
PRO A 277
THR A 279
GLY A 151
 None
None
None
NDP  A 302 ( 3.7A)
None
 1.08A 3bjwG-1a4iA:
0.0		 3bjwG-1a4iA:
15.10
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.
1bjn PHOSPHOSERINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00266
(Aminotran_5) 		5 VAL A 331
GLY A 327
LYS A 326
THR A 153
GLY A 156
 None
None
None
LLP  A 198 ( 3.5A)
None
 1.11A 3bjwG-1bjnA:
0.0		 3bjwG-1bjnA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bt4 PHOSPHOSERINE
AMINOTRANSFERASE

(Bacillus
circulans) 		PF00266
(Aminotran_5) 		5 VAL A 331
GLY A 327
LYS A 326
THR A 153
GLY A 156
 None
None
None
PLP  A 363 (-3.3A)
None
 1.24A 3bjwG-1bt4A:
0.0		 3bjwG-1bt4A:
13.87
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.
1d1t ALCOHOL
DEHYDROGENASE CLASS
IV SIGMA CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A 290
VAL A 291
GLY A 316
THR A 178
GLY A 181
 None
None
None
NAD  A1377 (-2.8A)
None
 1.40A 3bjwG-1d1tA:
0.0		 3bjwG-1d1tA:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		5 VAL A  56
VAL A  77
GLY A  78
GLY A  48
LYS A  45
 None
None
None
A79  A 800 (-4.1A)
None
 1.40A 3bjwG-1hvcA:
undetectable		 3bjwG-1hvcA:
19.42
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.
1kpl PUTATIVE CLC FAMILY,
CHLORINE TRANSPORT
PROTEIN

(Salmonella
enterica) 		PF00654
(Voltage_CLC) 		5 VAL A  57
GLY A 135
PRO A 150
THR A 151
GLY A  50
 None
 1.13A 3bjwG-1kplA:
0.0		 3bjwG-1kplA:
10.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mc2 ACUTOHAEMONLYSIN

(Deinagkistrodon
acutus) 		PF00068
(Phospholip_A2_1) 		5 GLY A1006
LYS A1007
PRO A1017
LYS A1069
ARG A1072
 IPA  A1136 (-3.6A)
None
IPA  A1136 (-4.4A)
None
None
 1.29A 3bjwG-1mc2A:
20.0		 3bjwG-1mc2A:
56.56
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.
1ohf NUDAURELIA CAPENSIS
OMEGA VIRUS CAPSID
PROTEIN

(Nudaurelia
capensis omega
virus) 		PF03566
(Peptidase_A21) 		5 GLY A 331
PRO A 315
THR A 336
GLY A 337
ARG A 290
 None
 1.33A 3bjwG-1ohfA:
0.0		 3bjwG-1ohfA:
9.50
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.
1q3s THERMOSOME ALPHA
SUBUNIT

(Thermococcus
sp. JCM 11816) 		PF00118
(Cpn60_TCP1) 		5 VAL A 349
GLY A 365
THR A 328
GLY A 345
ARG A 233
 None
 1.46A 3bjwG-1q3sA:
2.3		 3bjwG-1q3sA:
12.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yv9 HYDROLASE, HALOACID
DEHALOGENASE FAMILY

(Enterococcus
faecalis) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		5 VAL A 120
VAL A 119
GLY A 146
PRO A 178
THR A 176
 None
 1.48A 3bjwG-1yv9A:
undetectable		 3bjwG-1yv9A:
17.49
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.
2b4g DIHYDROOROTATE
DEHYDROGENASE

(Trypanosoma
brucei) 		PF01180
(DHO_dh) 		5 VAL A 134
GLY A  71
THR A  47
GLY A 101
LYS A 137
 None
ORO  A1399 (-3.7A)
None
None
None
 1.44A 3bjwG-2b4gA:
undetectable		 3bjwG-2b4gA:
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.
2i5p GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1

(Kluyveromyces
marxianus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 VAL O 130
GLY O 131
PRO O 156
THR O 290
GLY O 272
 None
 1.36A 3bjwG-2i5pO:
0.5		 3bjwG-2i5pO:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iuy GLYCOSYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF00534
(Glycos_transf_1) 		5 VAL A 278
VAL A 279
GLY A 294
PRO A 316
GLY A 275
 None
 1.27A 3bjwG-2iuyA:
undetectable		 3bjwG-2iuyA:
16.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lbp LEUCINE-BINDING
PROTEIN

(Escherichia
coli) 		PF13458
(Peripla_BP_6) 		5 VAL A   7
VAL A   8
GLY A  75
PRO A  99
GLY A  25
 None
 1.40A 3bjwG-2lbpA:
undetectable		 3bjwG-2lbpA:
15.07
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.
2nsg HYPOTHETICAL PROTEIN
CGL3021

(Corynebacterium
glutamicum) 		PF11716
(MDMPI_N) 		5 VAL A 207
VAL A 187
PRO A 235
GLY A 232
ARG A 196
 None
 1.26A 3bjwG-2nsgA:
1.5		 3bjwG-2nsgA:
16.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o4c ERYTHRONATE-4-PHOSPH
ATE DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
PF11890
(DUF3410) 		5 VAL A  96
VAL A  95
GLY A  94
THR A 356
GLY A 376
 None
 1.49A 3bjwG-2o4cA:
undetectable		 3bjwG-2o4cA:
16.31
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.
2ph1 NUCLEOTIDE-BINDING
PROTEIN

(Archaeoglobus
fulgidus) 		PF10609
(ParA) 		5 VAL A 184
VAL A 157
GLY A 155
PRO A 153
THR A 180
 None
 1.25A 3bjwG-2ph1A:
undetectable		 3bjwG-2ph1A:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qgq PROTEIN TM_1862

(Thermotoga
maritima) 		PF04055
(Radical_SAM) 		5 VAL A 415
VAL A 416
GLY A 427
LYS A 418
GLY A 388
 None
 1.42A 3bjwG-2qgqA:
undetectable		 3bjwG-2qgqA:
15.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qhe PHOSPHOLIPASE A2

(Echis carinatus) 		PF00068
(Phospholip_A2_1) 		6 VAL A   2
VAL A   3
GLY A   6
PRO A  18
THR A  23
GLY A  30
 None
 0.76A 3bjwG-2qheA:
22.6		 3bjwG-2qheA:
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.
2r9h H(+)/CL(-) EXCHANGE
TRANSPORTER CLCA

(Escherichia
coli) 		PF00654
(Voltage_CLC) 		5 VAL A  57
GLY A 135
PRO A 150
THR A 151
LYS A  55
 None
 1.40A 3bjwG-2r9hA:
undetectable		 3bjwG-2r9hA:
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.
2yxb COENZYME
B12-DEPENDENT MUTASE

(Aeropyrum
pernix) 		PF02310
(B12-binding) 		5 VAL A  40
VAL A  39
GLY A  36
GLY A  76
ARG A  42
 None
 1.28A 3bjwG-2yxbA:
undetectable		 3bjwG-2yxbA:
17.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gaz ALCOHOL
DEHYDROGENASE
SUPERFAMILY PROTEIN

(Novosphingobium
aromaticivorans) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A 134
VAL A 163
PRO A  46
THR A  44
GLY A  43
 None
None
CA  A 401 ( 4.7A)
None
None
 1.40A 3bjwG-3gazA:
undetectable		 3bjwG-3gazA:
13.78
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.
3h4y PUTATIVE CHEMOTAXIS
PROTEIN

(Desulfovibrio
vulgaris) 		PF13690
(CheX) 		5 VAL A  94
VAL A  91
GLY A  92
PRO A 118
GLY A 100
 None
 1.22A 3bjwG-3h4yA:
undetectable		 3bjwG-3h4yA:
18.24
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.
3hm4 CHEMOTAXIS PROTEIN
CHEX

(Desulfovibrio
alaskensis) 		PF13690
(CheX) 		5 VAL A  94
VAL A  91
GLY A  92
PRO A 118
GLY A 100
 None
 1.13A 3bjwG-3hm4A:
undetectable		 3bjwG-3hm4A:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iwj PUTATIVE
AMINOALDEHYDE
DEHYDROGENASE

(Pisum sativum) 		PF00171
(Aldedh) 		5 VAL A 336
GLY A 101
LYS A 102
PRO A 326
GLY A 372
 None
 1.42A 3bjwG-3iwjA:
undetectable		 3bjwG-3iwjA:
12.90
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.
3lp5 PUTATIVE CELL
SURFACE HYDROLASE

(Lactobacillus
plantarum) 		PF06028
(DUF915) 		5 VAL A 187
GLY A 190
LYS A 191
THR A 132
GLY A 108
 None
 1.41A 3bjwG-3lp5A:
0.2		 3bjwG-3lp5A:
17.39
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.
3ph2 CYTOCHROME C6

(Phormidium
laminosum) 		PF13442
(Cytochrome_CBB3) 		5 VAL B  52
VAL B  51
GLY B  55
LYS B  56
GLY B  64
 IMD  B1088 (-4.5A)
IMD  B1088 (-4.3A)
IMD  B1088 ( 4.4A)
HEM  B1087 (-2.8A)
None
 1.18A 3bjwG-3ph2B:
undetectable		 3bjwG-3ph2B:
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.
3qm2 PHOSPHOSERINE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF00266
(Aminotran_5) 		5 VAL A 331
GLY A 327
LYS A 326
THR A 153
GLY A 156
 None
 1.12A 3bjwG-3qm2A:
undetectable		 3bjwG-3qm2A:
16.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r75 ANTHRANILATE/PARA-AM
INOBENZOATE
SYNTHASES COMPONENT
I

(Burkholderia
lata) 		PF00117
(GATase)
PF00425
(Chorismate_bind) 		5 VAL A 580
GLY A 584
PRO A 603
THR A 604
GLY A 519
 None
 1.29A 3bjwG-3r75A:
undetectable		 3bjwG-3r75A:
9.66
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.
3wev L-LYSINE 6-OXIDASE

(Marinomonas
mediterranea) 		no annotation 5 VAL A  87
VAL A 226
GLY A 224
PRO A 498
GLY A 140
 None
 1.45A 3bjwG-3wevA:
undetectable		 3bjwG-3wevA:
9.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b4u BIFUNCTIONAL PROTEIN
FOLD

(Acinetobacter
baumannii) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 VAL A 257
GLY A 259
PRO A 263
THR A 265
GLY A 144
 EDO  A1286 ( 4.9A)
EDO  A1286 (-3.7A)
EDO  A1286 (-4.3A)
None
None
 1.20A 3bjwG-4b4uA:
1.9		 3bjwG-4b4uA:
15.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4by6 GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 1
GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 2

(Saccharomyces
cerevisiae) 		PF04054
(Not1)
PF04153
(NOT2_3_5) 		5 VAL A1804
VAL A1805
GLY A1808
PRO B  59
THR B  63
 None
 0.93A 3bjwG-4by6A:
undetectable		 3bjwG-4by6A:
10.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cr4 26S PROTEASE
REGULATORY SUBUNIT
6B HOMOLOG
26S PROTEASE
REGULATORY SUBUNIT 8
HOMOLOG

(Saccharomyces
cerevisiae) 		PF00004
(AAA) 		5 VAL J 358
VAL J 361
GLY J 360
PRO K 331
GLY J 192
 None
 1.35A 3bjwG-4cr4J:
undetectable		 3bjwG-4cr4J:
14.36
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.
4cr4 26S PROTEASE
REGULATORY SUBUNIT
6B HOMOLOG
26S PROTEASE
REGULATORY SUBUNIT 8
HOMOLOG

(Saccharomyces
cerevisiae) 		PF00004
(AAA) 		5 VAL J 358
VAL J 361
GLY J 360
PRO K 331
GLY J 194
 None
 1.27A 3bjwG-4cr4J:
undetectable		 3bjwG-4cr4J:
14.36
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.
4cxh ELONGATION FACTOR 1A

(Oryctolagus
cuniculus) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 VAL A 169
VAL A 170
LYS A 174
THR A 132
GLY A 125
 None
 0.86A 3bjwG-4cxhA:
undetectable		 3bjwG-4cxhA:
13.97
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.
4d01 NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-9

(Homo sapiens) 		PF02931
(Neur_chan_LBD) 		5 VAL A  30
VAL A 158
GLY A 155
PRO A 198
LYS A  29
 None
 1.49A 3bjwG-4d01A:
undetectable		 3bjwG-4d01A:
19.19
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.
4i8p AMINOALDEHYDE
DEHYDROGENASE 1

(Zea mays) 		PF00171
(Aldedh) 		5 VAL A 338
GLY A 103
LYS A 104
PRO A 328
GLY A 374
 None
 1.49A 3bjwG-4i8pA:
undetectable		 3bjwG-4i8pA:
11.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mio INOSITOL
2-DEHYDROGENASE/D-CH
IRO-INOSITOL
3-DEHYDROGENASE

(Lactobacillus
casei) 		PF01408
(GFO_IDH_MocA) 		5 VAL A  30
VAL A  31
GLY A   6
THR A  10
GLY A  14
 None
 1.10A 3bjwG-4mioA:
undetectable		 3bjwG-4mioA:
14.75
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.
4qwv HIGH-AFFINITY
LEUCINE-SPECIFIC
TRANSPORT SYSTEM
PERIPLASMIC BINDING
PROTEIN, CHEMOTAXIS
PROTEIN CHEY

(Escherichia
coli;
Thermotoga
maritima) 		PF00072
(Response_reg)
PF13458
(Peripla_BP_6) 		5 VAL A   7
VAL A   8
GLY A  75
PRO A  99
GLY A  25
 None
 1.43A 3bjwG-4qwvA:
undetectable		 3bjwG-4qwvA:
16.77
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.
4yeu CYS-LOOP
LIGAND-GATED ION
CHANNEL,PROTON-GATED
ION CHANNEL

(Dickeya
chrysanthemi;
Gloeobacter
violaceus) 		PF02931
(Neur_chan_LBD) 		5 VAL A  35
GLY A 108
PRO A  85
THR A  87
GLY A  88
 None
 1.15A 3bjwG-4yeuA:
1.2		 3bjwG-4yeuA:
17.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yzf BAND 3 ANION
TRANSPORT PROTEIN

(Homo sapiens) 		PF00955
(HCO3_cotransp) 		5 VAL A 709
VAL A 710
GLY A 713
THR A 444
GLY A 448
 None
 0.95A 3bjwG-4yzfA:
undetectable		 3bjwG-4yzfA:
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.
5c5z GLUTAMYL-TRNA
AMIDOTRANSFERASE

(Escherichia
coli) 		no annotation 5 VAL A  63
VAL A   8
GLY A  10
PRO A  49
GLY A 117
 None
 1.00A 3bjwG-5c5zA:
undetectable		 3bjwG-5c5zA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f8v AMINOTRANSFERASE,
CLASS V FAMILY
PROTEIN

(Trichomonas
vaginalis) 		PF00266
(Aminotran_5) 		5 VAL A 342
GLY A 338
LYS A 337
THR A 158
GLY A 161
 None
None
None
LLP  A 202 ( 3.0A)
None
 1.13A 3bjwG-5f8vA:
undetectable		 3bjwG-5f8vA:
17.12
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.
5hp5 PROTEIN-ARGININE
DEIMINASE TYPE-1

(Homo sapiens) 		PF03068
(PAD)
PF08526
(PAD_N)
PF08527
(PAD_M) 		5 VAL A 265
GLY A 263
PRO A 257
THR A 255
GLY A 253
 None
 1.26A 3bjwG-5hp5A:
undetectable		 3bjwG-5hp5A:
11.48
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.
5tc4 BIFUNCTIONAL
METHYLENETETRAHYDROF
OLATE
DEHYDROGENASE/CYCLOH
YDROLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 VAL A 308
GLY A 310
PRO A 314
THR A 316
GLY A 179
 None
L34  A 402 (-3.6A)
L34  A 402 (-4.5A)
NAD  A 401 (-3.2A)
None
 1.21A 3bjwG-5tc4A:
undetectable		 3bjwG-5tc4A:
16.56
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.
6ape BIFUNCTIONAL PROTEIN
FOLD

(Helicobacter
pylori) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 VAL A 262
GLY A 265
PRO A 268
THR A 270
GLY A 148
 None
None
None
GOL  A 305 (-4.7A)
None
 1.40A 3bjwG-6apeA:
undetectable		 3bjwG-6apeA:
17.35