SIMILAR PATTERNS OF AMINO ACIDS FOR 2ZXW_W_CHDW1060_0

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.
1go3 DNA-DIRECTED RNA
POLYMERASE SUBUNIT E

(Methanocaldococcus
jannaschii) 		PF00575
(S1)
PF03876
(SHS2_Rpb7-N) 		4 ILE E 176
LEU E 173
MET E 165
THR E 164
 None
 1.08A 2zxwN-1go3E:
0.0
2zxwW-1go3E:
0.0		 2zxwN-1go3E:
14.98
2zxwW-1go3E:
15.06
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.
1gzk RAC-BETA
SERINE/THREONINE
PROTEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		4 LEU A 380
PHE A 408
ARG A 251
MET A 344
 None
 1.02A 2zxwN-1gzkA:
0.0
2zxwW-1gzkA:
undetectable		 2zxwN-1gzkA:
20.42
2zxwW-1gzkA:
12.22
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.
1hu8 CELLULAR TUMOR
ANTIGEN P53

(Mus musculus) 		PF00870
(P53) 		4 ILE A 252
PHE A 267
TYR A 233
THR A 137
 None
 0.98A 2zxwN-1hu8A:
undetectable
2zxwW-1hu8A:
undetectable		 2zxwN-1hu8A:
15.26
2zxwW-1hu8A:
15.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i5p PESTICIDIAL CRYSTAL
PROTEIN CRY2AA

(Bacillus
thuringiensis) 		PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N)
PF09131
(Endotoxin_mid) 		4 ILE A 622
PHE A 624
ARG A 533
THR A 560
 None
 1.17A 2zxwN-1i5pA:
3.6
2zxwW-1i5pA:
0.0		 2zxwN-1i5pA:
23.40
2zxwW-1i5pA:
6.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kyw CAFFEIC ACID
3-O-METHYLTRANSFERAS
E

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 ILE A 294
PHE A 198
MET A 188
THR A 187
 None
 1.05A 2zxwN-1kywA:
0.3
2zxwW-1kywA:
0.0		 2zxwN-1kywA:
22.20
2zxwW-1kywA:
10.16
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.
1lua METHYLENE
TETRAHYDROMETHANOPTE
RIN DEHYDROGENASE

(Methylobacterium
extorquens) 		PF09176
(Mpt_N) 		4 ILE A 264
LEU A 267
PHE A 268
THR A  32
 None
 1.06A 2zxwN-1luaA:
0.0
2zxwW-1luaA:
undetectable		 2zxwN-1luaA:
19.12
2zxwW-1luaA:
11.47
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 ILE A1442
ARG A 511
MET A1424
THR A1425
 None
 1.17A 2zxwN-1ofeA:
0.0
2zxwW-1ofeA:
0.0		 2zxwN-1ofeA:
15.55
2zxwW-1ofeA:
3.34
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.
1rzr GLUCOSE-RESISTANCE
AMYLASE REGULATOR

(Bacillus
megaterium) 		no annotation 4 ILE G 121
LEU G 305
ARG G  80
THR G  87
 None
 1.19A 2zxwN-1rzrG:
0.0
2zxwW-1rzrG:
0.0		 2zxwN-1rzrG:
20.77
2zxwW-1rzrG:
10.21
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.
1tmx HYDROXYQUINOL
1,2-DIOXYGENASE

(Pimelobacter
simplex) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		4 ILE A 238
LEU A 222
PHE A 224
TYR A 187
 None
 0.98A 2zxwN-1tmxA:
2.1
2zxwW-1tmxA:
0.0		 2zxwN-1tmxA:
20.53
2zxwW-1tmxA:
11.92
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.
1uxe FIBER PROTEIN

(Human
mastadenovirus
D) 		PF00541
(Adeno_knob) 		4 ILE A 337
LEU A 248
PHE A 250
THR A 185
 None
 1.04A 2zxwN-1uxeA:
undetectable
2zxwW-1uxeA:
undetectable		 2zxwN-1uxeA:
16.05
2zxwW-1uxeA:
14.74
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.
1wj5 HYPOTHETICAL PROTEIN
(RIKEN CDNA
0610009H20)

(Mus musculus) 		PF09170
(STN1_2) 		4 ILE A  25
LEU A  42
PHE A  80
ARG A  54
 None
 1.13A 2zxwN-1wj5A:
undetectable
2zxwW-1wj5A:
undetectable		 2zxwN-1wj5A:
13.92
2zxwW-1wj5A:
20.83
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.
1yrz XYLAN
BETA-1,4-XYLOSIDASE

(Bacillus
halodurans) 		PF04616
(Glyco_hydro_43) 		4 ILE A1428
LEU A1414
MET A1463
THR A1462
 None
 1.16A 2zxwN-1yrzA:
undetectable
2zxwW-1yrzA:
undetectable		 2zxwN-1yrzA:
20.25
2zxwW-1yrzA:
7.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ywf PHOSPHOTYROSINE
PROTEIN PHOSPHATASE
PTPB

(Mycobacterium
tuberculosis) 		PF13350
(Y_phosphatase3) 		4 PHE A 222
ARG A 235
MET A 126
THR A 127
 None
 1.19A 2zxwN-1ywfA:
undetectable
2zxwW-1ywfA:
undetectable		 2zxwN-1ywfA:
20.50
2zxwW-1ywfA:
11.11
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.
2a62 CADHERIN-8

(Mus musculus) 		PF00028
(Cadherin) 		4 ILE A  94
LEU A  73
PHE A  92
ARG A  23
 None
 1.05A 2zxwN-2a62A:
undetectable
2zxwW-2a62A:
undetectable		 2zxwN-2a62A:
20.25
2zxwW-2a62A:
13.19
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.
2be7 ASPARTATE
CARBAMOYLTRANSFERASE
CATALYTIC CHAIN
ASPARTATE
CARBAMOYLTRANSFERASE
REGULATORY CHAIN

(Moritella
profunda;
Moritella
profunda) 		PF00185
(OTCace)
PF02729
(OTCace_N)
PF01948
(PyrI)
PF02748
(PyrI_C) 		4 ILE D 114
LEU A 115
ARG A 106
MET A 105
 None
 1.18A 2zxwN-2be7D:
undetectable
2zxwW-2be7D:
undetectable		 2zxwN-2be7D:
17.43
2zxwW-2be7D:
16.28
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.
2cph RNA BINDING MOTIF
PROTEIN 19

(Mus musculus) 		PF00076
(RRM_1) 		4 ILE A 478
LEU A 481
PHE A 482
ARG A 467
 None
 1.04A 2zxwN-2cphA:
undetectable
2zxwW-2cphA:
undetectable		 2zxwN-2cphA:
12.76
2zxwW-2cphA:
24.30
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.
2det TRNA-SPECIFIC
2-THIOURIDYLASE MNMA

(Escherichia
coli) 		PF03054
(tRNA_Me_trans) 		4 ILE A 329
PHE A 300
ARG A 305
THR A 307
 None
 1.21A 2zxwN-2detA:
0.0
2zxwW-2detA:
undetectable		 2zxwN-2detA:
21.21
2zxwW-2detA:
12.59
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.
2dn6 KIAA0640 PROTEIN

(Homo sapiens) 		PF00169
(PH) 		4 ILE A  36
LEU A  31
ARG A  27
MET A  14
 None
 1.20A 2zxwN-2dn6A:
undetectable
2zxwW-2dn6A:
undetectable		 2zxwN-2dn6A:
12.04
2zxwW-2dn6A:
20.43
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.
2dx5 VACUOLAR PROTEIN
SORTING PROTEIN 36

(Mus musculus) 		PF11605
(Vps36_ESCRT-II) 		4 ILE A  82
LEU A 108
PHE A 110
ARG A 121
 None
 1.20A 2zxwN-2dx5A:
undetectable
2zxwW-2dx5A:
undetectable		 2zxwN-2dx5A:
12.45
2zxwW-2dx5A:
16.18
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.
2fej CELLULAR TUMOR
ANTIGEN P53

(Homo sapiens) 		PF00870
(P53) 		4 ILE A 255
LEU A 111
PHE A 270
TYR A 236
 None
 1.17A 2zxwN-2fejA:
undetectable
2zxwW-2fejA:
undetectable		 2zxwN-2fejA:
15.09
2zxwW-2fejA:
14.07
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.
2hcz BETA-EXPANSIN 1A

(Zea mays) 		PF01357
(Pollen_allerg_1)
PF03330
(DPBB_1) 		4 ILE X 148
PHE X 150
ARG X 213
MET X 177
 None
 1.11A 2zxwN-2hczX:
undetectable
2zxwW-2hczX:
undetectable		 2zxwN-2hczX:
17.97
2zxwW-2hczX:
17.28
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.
2iaf HYPOTHETICAL PROTEIN
SDHL

(Legionella
pneumophila) 		PF03315
(SDH_beta) 		4 ILE A  78
LEU A  84
PHE A  94
THR A  50
 None
 1.21A 2zxwN-2iafA:
undetectable
2zxwW-2iafA:
undetectable		 2zxwN-2iafA:
14.20
2zxwW-2iafA:
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.
2ibn INOSITOL OXYGENASE

(Homo sapiens) 		PF05153
(MIOX) 		4 LEU A 131
PHE A 132
MET A  71
THR A  72
 None
 1.00A 2zxwN-2ibnA:
undetectable
2zxwW-2ibnA:
undetectable		 2zxwN-2ibnA:
17.97
2zxwW-2ibnA:
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.
2jls SERINE PROTEASE
SUBUNIT NS3

(Dengue virus) 		PF07652
(Flavi_DEAD) 		4 ILE A 220
ARG A 297
MET A 314
THR A 315
 None
 1.13A 2zxwN-2jlsA:
undetectable
2zxwW-2jlsA:
undetectable		 2zxwN-2jlsA:
21.54
2zxwW-2jlsA:
8.26
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.
2kb3 OXOGLUTARATE
DEHYDROGENASE
INHIBITOR

(Corynebacterium
glutamicum) 		PF00498
(FHA) 		4 ILE A 128
LEU A 135
ARG A  93
THR A  69
 None
 0.99A 2zxwN-2kb3A:
undetectable
2zxwW-2kb3A:
undetectable		 2zxwN-2kb3A:
14.43
2zxwW-2kb3A:
16.78
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.
2o9r BETA-GLUCOSIDASE B

(Paenibacillus
polymyxa) 		PF00232
(Glyco_hydro_1) 		4 ILE A 352
LEU A 396
PHE A 389
ARG A 341
 None
 1.22A 2zxwN-2o9rA:
undetectable
2zxwW-2o9rA:
undetectable		 2zxwN-2o9rA:
20.38
2zxwW-2o9rA:
9.55
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.
2of5 DEATH
DOMAIN-CONTAINING
PROTEIN CRADD

(Homo sapiens) 		PF00531
(Death) 		4 LEU A 180
PHE A 177
ARG A 118
MET A 197
 None
 1.20A 2zxwN-2of5A:
undetectable
2zxwW-2of5A:
undetectable		 2zxwN-2of5A:
12.25
2zxwW-2of5A:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q7s N-FORMYLGLUTAMATE
AMIDOHYDROLASE

(Cupriavidus
pinatubonensis) 		PF05013
(FGase) 		4 ILE A 250
PHE A 192
ARG A 272
THR A 275
 None
 0.98A 2zxwN-2q7sA:
undetectable
2zxwW-2q7sA:
undetectable		 2zxwN-2q7sA:
19.19
2zxwW-2q7sA:
12.61
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.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 ILE A 363
LEU A 342
PHE A 341
ARG A 409
 None
 0.97A 2zxwN-2v7bA:
undetectable
2zxwW-2v7bA:
undetectable		 2zxwN-2v7bA:
21.98
2zxwW-2v7bA:
8.35
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.
2whx SERINE
PROTEASE/NTPASE/HELI
CASE NS3

(Dengue virus) 		PF00949
(Peptidase_S7)
PF07652
(Flavi_DEAD) 		4 ILE A 220
ARG A 297
MET A 314
THR A 315
 None
 1.13A 2zxwN-2whxA:
undetectable
2zxwW-2whxA:
undetectable		 2zxwN-2whxA:
21.69
2zxwW-2whxA:
6.47
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.
2wnb -

(Sus scrofa) 		PF00777
(Glyco_transf_29) 		4 ILE A  68
LEU A 281
PHE A  81
ARG A  60
 None
 1.15A 2zxwN-2wnbA:
undetectable
2zxwW-2wnbA:
undetectable		 2zxwN-2wnbA:
17.88
2zxwW-2wnbA:
11.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x0q ALCALIGIN
BIOSYNTHESIS PROTEIN

(Bordetella
bronchiseptica) 		PF04183
(IucA_IucC)
PF06276
(FhuF) 		4 ILE A 538
LEU A 557
PHE A 558
ARG A 532
 None
 1.21A 2zxwN-2x0qA:
undetectable
2zxwW-2x0qA:
undetectable		 2zxwN-2x0qA:
21.83
2zxwW-2x0qA:
11.83
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.
2y69 CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1

(Bos taurus) 		PF02238
(COX7a) 		4 TYR J  32
ARG J  33
MET J  36
THR J  37
 None
 0.33A 2zxwN-2y69J:
undetectable
2zxwW-2y69J:
7.9		 2zxwN-2y69J:
10.31
2zxwW-2y69J:
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.
2zkm 1-PHOSPHATIDYLINOSIT
OL-4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-2

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		4 ILE X 460
LEU X 405
PHE X 407
THR X 426
 None
 1.21A 2zxwN-2zkmX:
undetectable
2zxwW-2zkmX:
undetectable		 2zxwN-2zkmX:
20.22
2zxwW-2zkmX:
6.10
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.
3adc L-SERYL-TRNA(SEC)
KINASE

(Methanocaldococcus
jannaschii) 		PF08433
(KTI12) 		4 ILE A  62
LEU A  34
ARG A  83
THR A  76
 None
None
None
A  C  76 ( 3.6A)
 1.09A 2zxwN-3adcA:
3.7
2zxwW-3adcA:
undetectable		 2zxwN-3adcA:
16.54
2zxwW-3adcA:
14.77
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.
3egj N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Vibrio cholerae) 		PF01979
(Amidohydro_1) 		4 LEU A  60
PHE A  92
TYR A 114
THR A  73
 None
 1.10A 2zxwN-3egjA:
undetectable
2zxwW-3egjA:
undetectable		 2zxwN-3egjA:
22.35
2zxwW-3egjA:
11.46
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.
3ezx MONOMETHYLAMINE
CORRINOID PROTEIN 1

(Methanosarcina
barkeri) 		PF02310
(B12-binding)
PF02607
(B12-binding_2) 		4 ILE A  40
LEU A  37
ARG A 111
THR A 114
 None
 1.18A 2zxwN-3ezxA:
2.4
2zxwW-3ezxA:
undetectable		 2zxwN-3ezxA:
18.16
2zxwW-3ezxA:
14.35
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN

(Geobacillus
kaustophilus) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		4 ILE A 875
LEU A 993
PHE A 994
ARG A 825
 None
 1.07A 2zxwN-3f2bA:
2.1
2zxwW-3f2bA:
undetectable		 2zxwN-3f2bA:
20.21
2zxwW-3f2bA:
4.51
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.
3fa3 2,3-DIMETHYLMALATE
LYASE

(Aspergillus
niger) 		PF13714
(PEP_mutase) 		4 ILE A 203
LEU A 211
PHE A 234
THR A 194
 None
 1.17A 2zxwN-3fa3A:
undetectable
2zxwW-3fa3A:
undetectable		 2zxwN-3fa3A:
20.73
2zxwW-3fa3A:
10.60
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.
3h7o GROUP 3 ALLERGEN
SMIPP-S YV6023A04

(Sarcoptes
scabiei) 		PF00089
(Trypsin) 		4 TYR A  82
ARG A  83
MET A  87
THR A  86
 None
 1.17A 2zxwN-3h7oA:
undetectable
2zxwW-3h7oA:
undetectable		 2zxwN-3h7oA:
16.77
2zxwW-3h7oA:
12.12
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.
3hdn SERINE/THREONINE-PRO
TEIN KINASE SGK1

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 228
LEU A 184
PHE A 185
TYR A 263
 None
 1.06A 2zxwN-3hdnA:
undetectable
2zxwW-3hdnA:
undetectable		 2zxwN-3hdnA:
20.50
2zxwW-3hdnA:
14.07
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.
3j31 A223 PENTON BASE

(Sulfolobus
turreted
icosahedral
virus 1) 		no annotation 4 ILE Q 156
LEU Q 162
MET Q 186
THR Q 185
 None
 1.21A 2zxwN-3j31Q:
undetectable
2zxwW-3j31Q:
undetectable		 2zxwN-3j31Q:
19.22
2zxwW-3j31Q:
14.16
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.
3lki FRUCTOKINASE

(Xylella
fastidiosa) 		PF00294
(PfkB) 		4 LEU A 196
PHE A 173
MET A 148
THR A 149
 None
 1.11A 2zxwN-3lkiA:
undetectable
2zxwW-3lkiA:
undetectable		 2zxwN-3lkiA:
22.00
2zxwW-3lkiA:
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.
3lrk ALPHA-GALACTOSIDASE
1

(Saccharomyces
cerevisiae) 		PF16499
(Melibiase_2) 		4 ILE A  69
LEU A 103
PHE A 108
ARG A  55
 None
 1.03A 2zxwN-3lrkA:
undetectable
2zxwW-3lrkA:
undetectable		 2zxwN-3lrkA:
20.99
2zxwW-3lrkA:
8.58
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.
3o96 RAC-ALPHA
SERINE/THREONINE-PRO
TEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase)
PF00169
(PH) 		4 LEU A 379
PHE A 407
ARG A 249
MET A 343
 LEU  A 379 ( 0.6A)
PHE  A 407 ( 1.3A)
ARG  A 249 ( 0.6A)
MET  A 343 ( 0.0A)
 1.01A 2zxwN-3o96A:
undetectable
2zxwW-3o96A:
undetectable		 2zxwN-3o96A:
19.89
2zxwW-3o96A:
9.90
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.
3oep PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA0988

(Thermus
thermophilus) 		PF02626
(CT_A_B)
PF02682
(CT_C_D) 		4 ILE A 489
LEU A 392
PHE A 491
ARG A 452
 None
 0.97A 2zxwN-3oepA:
undetectable
2zxwW-3oepA:
undetectable		 2zxwN-3oepA:
21.17
2zxwW-3oepA:
7.33
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.
3w1e FLAGELLA BASAL-BODY
PROTEIN

(Vibrio
alginolyticus) 		PF16538
(FlgT_C)
PF16539
(FlgT_M)
PF16548
(FlgT_N) 		4 ILE A 266
LEU A 268
TYR A 170
THR A 208
 None
 1.04A 2zxwN-3w1eA:
undetectable
2zxwW-3w1eA:
undetectable		 2zxwN-3w1eA:
21.00
2zxwW-3w1eA:
9.91
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.
4ack TSSL

(Francisella
tularensis) 		PF09850
(DotU) 		4 ILE A  61
LEU A  49
TYR A  94
ARG A  96
 None
 1.22A 2zxwN-4ackA:
undetectable
2zxwW-4ackA:
undetectable		 2zxwN-4ackA:
14.31
2zxwW-4ackA:
16.48
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.
4biz SENSOR PROTEIN CPXA

(Escherichia
coli) 		PF00512
(HisKA)
PF00672
(HAMP)
PF02518
(HATPase_c) 		4 ILE A 399
LEU A 421
PHE A 400
THR A 383
 ADP  A 501 (-4.4A)
ADP  A 501 (-3.8A)
None
None
 0.86A 2zxwN-4bizA:
3.1
2zxwW-4bizA:
undetectable		 2zxwN-4bizA:
17.40
2zxwW-4bizA:
10.77
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.
4bkw ZINC FINGER FYVE
DOMAIN-CONTAINING
PROTEIN 9

(Homo sapiens) 		PF11979
(DUF3480) 		4 ILE A1137
PHE A1203
ARG A1143
MET A1147
 None
 1.14A 2zxwN-4bkwA:
undetectable
2zxwW-4bkwA:
undetectable		 2zxwN-4bkwA:
23.28
2zxwW-4bkwA:
7.16
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.
4cx9 CYTOCHROME C, CLASS
II

(Shewanella
frigidimarina) 		PF01322
(Cytochrom_C_2) 		4 ILE A  19
PHE A  16
MET A  85
THR A  86
 HEC  A1129 (-4.9A)
HEC  A1129 (-3.4A)
HEC  A1129 (-4.0A)
None
 1.22A 2zxwN-4cx9A:
3.0
2zxwW-4cx9A:
undetectable		 2zxwN-4cx9A:
11.29
2zxwW-4cx9A:
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.
4elx 1,4-DIHYDROXY-2-NAPH
THOYL-COA SYNTHASE

(Escherichia
coli) 		PF00378
(ECH_1) 		4 ILE A  37
LEU A  74
ARG A  64
THR A 117
 None
 1.12A 2zxwN-4elxA:
undetectable
2zxwW-4elxA:
undetectable		 2zxwN-4elxA:
18.85
2zxwW-4elxA:
14.67
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.
4eto PROTEIN S100-A4

(Homo sapiens) 		PF01023
(S_100) 		4 ILE A  82
LEU A  79
PHE A  78
THR A  39
 None
 1.08A 2zxwN-4etoA:
undetectable
2zxwW-4etoA:
undetectable		 2zxwN-4etoA:
9.45
2zxwW-4etoA:
22.99
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.
4fb5 PROBABLE
OXIDOREDUCTASE
PROTEIN

(Rhizobium etli) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ILE A 271
LEU A 283
PHE A 281
ARG A 139
 None
 1.13A 2zxwN-4fb5A:
undetectable
2zxwW-4fb5A:
undetectable		 2zxwN-4fb5A:
20.61
2zxwW-4fb5A:
11.29
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.
4gu3 OUTER CAPSID PROTEIN
SIGMA-1

(Mammalian
orthoreovirus) 		PF01664
(Reo_sigma1) 		4 ILE A 463
LEU A 367
PHE A 369
ARG A 429
 None
 1.10A 2zxwN-4gu3A:
undetectable
2zxwW-4gu3A:
undetectable		 2zxwN-4gu3A:
17.29
2zxwW-4gu3A:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gv1 RAC-ALPHA
SERINE/THREONINE-PRO
TEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		4 LEU A 379
PHE A 407
ARG A 249
MET A 343
 None
 1.01A 2zxwN-4gv1A:
undetectable
2zxwW-4gv1A:
undetectable		 2zxwN-4gv1A:
20.00
2zxwW-4gv1A:
10.00
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.
4i5s PUTATIVE HISTIDINE
KINASE COVS
VICK-LIKE PROTEIN

(Streptococcus
mutans) 		PF00512
(HisKA)
PF00989
(PAS)
PF02518
(HATPase_c) 		4 ILE A 321
LEU A 360
MET A 328
THR A 329
 None
 1.08A 2zxwN-4i5sA:
undetectable
2zxwW-4i5sA:
2.3		 2zxwN-4i5sA:
20.74
2zxwW-4i5sA:
8.31
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.
4i96 RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR) 		4 ILE A 282
LEU A 262
ARG A 289
THR A 286
 None
 1.06A 2zxwN-4i96A:
undetectable
2zxwW-4i96A:
undetectable		 2zxwN-4i96A:
19.34
2zxwW-4i96A:
11.57
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.
4kc5 RHIE PROTEIN

(Paraburkholderia
rhizoxinica) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 ILE A3361
LEU A3395
PHE A3446
ARG A3345
 None
 1.13A 2zxwN-4kc5A:
undetectable
2zxwW-4kc5A:
undetectable		 2zxwN-4kc5A:
19.34
2zxwW-4kc5A:
4.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m1a HYPOTHETICAL PROTEIN

(Sebaldella
termitidis) 		PF08921
(DUF1904) 		4 ILE A  73
PHE A  77
ARG A   5
THR A  37
 None
 0.78A 2zxwN-4m1aA:
undetectable
2zxwW-4m1aA:
undetectable		 2zxwN-4m1aA:
12.03
2zxwW-4m1aA:
20.16
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.
4o5p UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF09994
(DUF2235) 		4 ILE A 272
LEU A 326
PHE A 325
THR A 303
 None
 0.97A 2zxwN-4o5pA:
undetectable
2zxwW-4o5pA:
undetectable		 2zxwN-4o5pA:
19.53
2zxwW-4o5pA:
5.27
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.
4odb OUTER CAPSID PROTEIN
SIGMA-1

(Mammalian
orthoreovirus) 		PF01664
(Reo_sigma1) 		4 ILE A 463
LEU A 367
PHE A 369
ARG A 429
 None
 1.13A 2zxwN-4odbA:
undetectable
2zxwW-4odbA:
undetectable		 2zxwN-4odbA:
13.36
2zxwW-4odbA:
13.25
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.
4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		4 ILE A 477
LEU A 475
ARG A 415
THR A 390
 None
 1.21A 2zxwN-4ozyA:
undetectable
2zxwW-4ozyA:
undetectable		 2zxwN-4ozyA:
20.85
2zxwW-4ozyA:
10.75
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.
4pbv NT-3 GROWTH FACTOR
RECEPTOR

(Gallus gallus) 		PF00047
(ig)
PF13855
(LRR_8)
PF16920
(TPKR_C2) 		4 LEU A 146
PHE A 147
ARG A 156
THR A 109
 None
 1.06A 2zxwN-4pbvA:
undetectable
2zxwW-4pbvA:
undetectable		 2zxwN-4pbvA:
18.97
2zxwW-4pbvA:
11.94
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.
4pl0 MICROCIN-J25 EXPORT
ATP-BINDING/PERMEASE
PROTEIN MCJD

(Escherichia
coli) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		4 ILE A 523
LEU A 520
ARG A 493
THR A 425
 None
 1.13A 2zxwN-4pl0A:
1.4
2zxwW-4pl0A:
undetectable		 2zxwN-4pl0A:
21.25
2zxwW-4pl0A:
6.21
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.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		4 ILE A 338
LEU A 610
PHE A 607
THR A 565
 None
None
None
SO4  A 917 (-4.1A)
 1.05A 2zxwN-4qmeA:
3.4
2zxwW-4qmeA:
undetectable		 2zxwN-4qmeA:
19.71
2zxwW-4qmeA:
5.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4s3l MAJOR PILIN PROTEIN

(Streptococcus
pneumoniae) 		no annotation 4 ILE A  64
LEU A 214
PHE A 215
THR A  86
 None
 1.11A 2zxwN-4s3lA:
undetectable
2zxwW-4s3lA:
undetectable		 2zxwN-4s3lA:
20.38
2zxwW-4s3lA:
11.15
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.
4w1w ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00202
(Aminotran_3) 		4 ILE A 110
LEU A 266
PHE A 267
THR A 286
 None
 0.91A 2zxwN-4w1wA:
0.5
2zxwW-4w1wA:
undetectable		 2zxwN-4w1wA:
22.73
2zxwW-4w1wA:
7.23
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.
4w97 HTH-TYPE
TRANSCRIPTIONAL
REPRESSOR KSTR2

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		4 LEU A  69
PHE A  70
ARG A 132
MET A 134
 None
None
UCA  A 301 (-4.1A)
None
 1.07A 2zxwN-4w97A:
undetectable
2zxwW-4w97A:
undetectable		 2zxwN-4w97A:
17.49
2zxwW-4w97A:
19.71
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.
4z2a FURIN

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF01483
(P_proprotein) 		4 ILE A 452
LEU A 568
ARG A 448
THR A 482
 None
 1.12A 2zxwN-4z2aA:
undetectable
2zxwW-4z2aA:
undetectable		 2zxwN-4z2aA:
19.93
2zxwW-4z2aA:
8.46
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.
4zo0 PROTEIN REP68

(Adeno-associated
dependoparvovirus
A) 		PF08724
(Rep_N) 		4 ILE A   9
PHE A 132
ARG A 119
THR A  65
 None
 0.76A 2zxwN-4zo0A:
undetectable
2zxwW-4zo0A:
undetectable		 2zxwN-4zo0A:
16.50
2zxwW-4zo0A:
17.78
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.
5b7c S-CRYSTALLIN OCTVUS4

(Octopus
vulgaris) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 ILE A  92
PHE A  91
ARG A 145
MET A 149
 None
 1.15A 2zxwN-5b7cA:
undetectable
2zxwW-5b7cA:
undetectable		 2zxwN-5b7cA:
16.73
2zxwW-5b7cA:
17.01
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.
5cvv (ISO)EUGENOL
O-METHYLTRANSFERASE

(Clarkia breweri) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 ILE A 297
PHE A 201
MET A 191
THR A 190
 None
 0.96A 2zxwN-5cvvA:
undetectable
2zxwW-5cvvA:
undetectable		 2zxwN-5cvvA:
21.65
2zxwW-5cvvA:
10.54
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.
5d73 GLUTATHIONE
S-TRANSFERASE

(Wuchereria
bancrofti) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 LEU A 125
PHE A 128
ARG A  95
THR A  99
 None
None
GSH  A 301 (-3.8A)
None
 1.04A 2zxwN-5d73A:
undetectable
2zxwW-5d73A:
undetectable		 2zxwN-5d73A:
16.63
2zxwW-5d73A:
15.92
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.
5dfm MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TELOMERASE-A
SSOCIATED PROTEIN 19

(Escherichia
coli;
Tetrahymena
thermophila) 		PF13416
(SBP_bac_8) 		4 ILE A 499
LEU A 509
PHE A 474
THR A 385
 None
None
None
SO4  A 604 (-4.0A)
 0.97A 2zxwN-5dfmA:
undetectable
2zxwW-5dfmA:
undetectable		 2zxwN-5dfmA:
21.09
2zxwW-5dfmA:
6.93
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.
5ei0 SERPIN A12

(Homo sapiens) 		PF00079
(Serpin) 		4 ILE A 262
PHE A 272
ARG A 310
MET A 360
 None
 1.19A 2zxwN-5ei0A:
undetectable
2zxwW-5ei0A:
undetectable		 2zxwN-5ei0A:
21.11
2zxwW-5ei0A:
9.93
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.
5f59 HISTONE-LYSINE
N-METHYLTRANSFERASE
2C

(Homo sapiens) 		PF00856
(SET) 		4 ILE A4801
TYR A4762
MET A4765
THR A4767
 None
 0.97A 2zxwN-5f59A:
undetectable
2zxwW-5f59A:
undetectable		 2zxwN-5f59A:
13.20
2zxwW-5f59A:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gk2 KETOSYNTHASE STLD

(Photorhabdus
laumondii) 		PF08541
(ACP_syn_III_C) 		4 ILE A  48
TYR A  53
MET A  24
THR A  23
 None
 0.96A 2zxwN-5gk2A:
undetectable
2zxwW-5gk2A:
undetectable		 2zxwN-5gk2A:
19.85
2zxwW-5gk2A:
8.50
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.
5gmh TOLL-LIKE RECEPTOR 7

(Macaca mulatta) 		PF00560
(LRR_1)
PF13306
(LRR_5)
PF13855
(LRR_8) 		4 ILE A  80
PHE A 123
ARG A  97
THR A  71
 None
 1.03A 2zxwN-5gmhA:
undetectable
2zxwW-5gmhA:
undetectable		 2zxwN-5gmhA:
20.57
2zxwW-5gmhA:
5.42
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.
5gmx CARBOXYLESTERASE

(uncultured
bacterium) 		PF00144
(Beta-lactamase) 		4 ILE A   7
LEU A  48
PHE A  22
THR A  65
 None
 1.15A 2zxwN-5gmxA:
undetectable
2zxwW-5gmxA:
undetectable		 2zxwN-5gmxA:
22.64
2zxwW-5gmxA:
9.90
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.
5h6s AMIDASE

(Microbacterium
sp. HM58-2) 		PF01425
(Amidase) 		4 ILE A 170
ARG A 235
MET A 237
THR A 238
 None
 1.19A 2zxwN-5h6sA:
undetectable
2zxwW-5h6sA:
undetectable		 2zxwN-5h6sA:
20.08
2zxwW-5h6sA:
7.69
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.
5huq LACTATE RACEMIZATION
OPERON PROTEIN LARA

(Lactobacillus
plantarum) 		PF09861
(DUF2088) 		4 ILE A 293
PHE A 374
MET A 300
THR A 301
 None
 1.09A 2zxwN-5huqA:
undetectable
2zxwW-5huqA:
undetectable		 2zxwN-5huqA:
20.72
2zxwW-5huqA:
8.56
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.
5lki TCDA1

(Photorhabdus
luminescens) 		PF03538
(VRP1) 		4 PHE A1136
ARG A1602
MET A1596
THR A1585
 None
 1.13A 2zxwN-5lkiA:
5.5
2zxwW-5lkiA:
1.4		 2zxwN-5lkiA:
11.55
2zxwW-5lkiA:
2.12
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.
5m8i CUGBP ELAV-LIKE
FAMILY MEMBER 2

(Homo sapiens) 		no annotation 4 ILE A  95
LEU A 100
PHE A  93
MET A  48
 None
 1.15A 2zxwN-5m8iA:
undetectable
2zxwW-5m8iA:
undetectable		 2zxwN-5m8iA:
12.57
2zxwW-5m8iA:
18.75
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.
5mr5 GDNF FAMILY RECEPTOR
ALPHA-2

(Homo sapiens) 		no annotation 4 LEU C 339
PHE C 338
MET C 305
THR C 306
 None
 1.21A 2zxwN-5mr5C:
undetectable
2zxwW-5mr5C:
undetectable		 2zxwN-5mr5C:
undetectable
2zxwW-5mr5C:
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Mus musculus) 		PF06090
(Ins_P5_2-kin) 		4 LEU A 452
TYR A 392
ARG A 393
THR A 397
 5MY  A 502 (-4.6A)
None
None
None
 1.16A 2zxwN-5mwlA:
undetectable
2zxwW-5mwlA:
undetectable		 2zxwN-5mwlA:
19.60
2zxwW-5mwlA:
8.96
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.
5nzg UDP-GLUCOSE
PYROPHOSPHORYLASE

(Leishmania
major) 		no annotation 4 ILE A 194
LEU A 198
MET A 321
THR A 320
 None
 1.12A 2zxwN-5nzgA:
undetectable
2zxwW-5nzgA:
undetectable		 2zxwN-5nzgA:
undetectable
2zxwW-5nzgA:
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.
5o5a PEREGRIN

(Homo sapiens) 		no annotation 4 TYR A 687
ARG A 686
MET A 678
THR A 677
 None
 1.14A 2zxwN-5o5aA:
undetectable
2zxwW-5o5aA:
undetectable		 2zxwN-5o5aA:
undetectable
2zxwW-5o5aA:
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.
5tiw SULFOTRANSFERASE

(Schistosoma
haematobium) 		no annotation 4 LEU A  92
ARG A  82
MET A 113
THR A 112
 None
 1.02A 2zxwN-5tiwA:
undetectable
2zxwW-5tiwA:
undetectable		 2zxwN-5tiwA:
16.34
2zxwW-5tiwA:
12.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v6h PDZ
DOMAIN-CONTAINING
PROTEIN GIPC2

(Mus musculus) 		no annotation 4 LEU A 253
PHE A 299
MET A 269
THR A 268
 None
 1.21A 2zxwN-5v6hA:
undetectable
2zxwW-5v6hA:
undetectable		 2zxwN-5v6hA:
9.94
2zxwW-5v6hA:
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.
5w5f TAIL TUBE PROTEIN
GP19

(Enterobacteria
phage T4 sensu
lato) 		PF06841
(Phage_T4_gp19) 		4 ILE A  25
LEU A  28
PHE A  32
THR A  70
 None
 1.15A 2zxwN-5w5fA:
undetectable
2zxwW-5w5fA:
undetectable		 2zxwN-5w5fA:
15.76
2zxwW-5w5fA:
16.22
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.
5w5f TAIL TUBE PROTEIN
GP19

(Enterobacteria
phage T4 sensu
lato) 		PF06841
(Phage_T4_gp19) 		4 ILE A  25
LEU A  28
PHE A  32
THR A 156
 None
 0.99A 2zxwN-5w5fA:
undetectable
2zxwW-5w5fA:
undetectable		 2zxwN-5w5fA:
15.76
2zxwW-5w5fA:
16.22
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.
5x4r S PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus) 		no annotation 4 ILE A 250
LEU A 273
TYR A 144
THR A 178
 NAG  A 502 ( 4.3A)
None
None
None
 1.03A 2zxwN-5x4rA:
undetectable
2zxwW-5x4rA:
undetectable		 2zxwN-5x4rA:
19.89
2zxwW-5x4rA:
9.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x9a CALAXIN

(Ciona
intestinalis) 		no annotation 4 LEU A 182
PHE A  90
ARG A  48
MET A  57
 None
 1.12A 2zxwN-5x9aA:
undetectable
2zxwW-5x9aA:
undetectable		 2zxwN-5x9aA:
undetectable
2zxwW-5x9aA:
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.
5xh9 EXTRACELLULAR
INVERTASE

(Aspergillus
kawachii) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 ILE A  88
LEU A  67
ARG A 193
THR A 272
 None
 1.09A 2zxwN-5xh9A:
undetectable
2zxwW-5xh9A:
undetectable		 2zxwN-5xh9A:
23.14
2zxwW-5xh9A:
7.58
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Komagataella
phaffii;
Komagataella
phaffii) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		4 ILE B1212
PHE A1413
ARG A 329
MET A 305
 None
 1.07A 2zxwN-5xogB:
undetectable
2zxwW-5xogB:
undetectable		 2zxwN-5xogB:
17.56
2zxwW-5xogB:
4.16
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.
5xoh BERGAPTOL
O-METHYLTRANSFERASE

(Peucedanum
praeruptorum) 		no annotation 4 ILE A 289
PHE A 193
MET A 183
THR A 182
 None
 1.01A 2zxwN-5xohA:
0.6
2zxwW-5xohA:
undetectable		 2zxwN-5xohA:
undetectable
2zxwW-5xohA:
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.
5xoz TRYPSIN PROTEIN
INHIBITOR 2

(Cicer arietinum) 		no annotation 4 ILE A 161
LEU A 148
PHE A 135
THR A  56
 None
 1.13A 2zxwN-5xozA:
undetectable
2zxwW-5xozA:
undetectable		 2zxwN-5xozA:
undetectable
2zxwW-5xozA:
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.
5xu1 ABC TRANSPORTER
ATP-BINDING PROTEIN

(Streptococcus
pneumoniae) 		no annotation 4 ILE A  88
LEU A 167
PHE A  90
THR A  59
 None
 0.78A 2zxwN-5xu1A:
undetectable
2zxwW-5xu1A:
undetectable		 2zxwN-5xu1A:
undetectable
2zxwW-5xu1A:
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.
6caj TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA

(Homo sapiens) 		no annotation 4 ILE C  45
ARG C  66
MET C  68
THR C  69
 None
 1.08A 2zxwN-6cajC:
2.2
2zxwW-6cajC:
undetectable		 2zxwN-6cajC:
undetectable
2zxwW-6cajC:
undetectable