SIMILAR PATTERNS OF AMINO ACIDS FOR 4RET_C_DGXC2005

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.
1bc5 CHEMOTAXIS RECEPTOR
METHYLTRANSFERASE

(Salmonella
enterica) 		PF01739
(CheR)
PF03705
(CheR_N) 		5 ALA A  88
GLU A 158
PHE A  85
LEU A  73
ARG A  29
 None
 1.19A 4retC-1bc5A:
undetectable		 4retC-1bc5A:
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.
1cfz HYDROGENASE 2
MATURATION PROTEASE

(Escherichia
coli) 		PF01750
(HycI) 		5 ASP A  62
LEU A  97
LEU A  26
GLY A  41
ALA A  44
 CD  A 163 ( 2.4A)
None
None
None
None
 1.18A 4retC-1cfzA:
undetectable		 4retC-1cfzA:
10.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ftg APOFLAVODOXIN

(Nostoc sp. PCC
7119) 		PF00258
(Flavodoxin_1) 		5 GLU A  16
ALA A  84
GLU A 166
PHE A  86
LEU A 143
 None
 1.17A 4retC-1ftgA:
undetectable		 4retC-1ftgA:
10.90
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.
1ftg APOFLAVODOXIN

(Nostoc sp. PCC
7119) 		PF00258
(Flavodoxin_1) 		5 GLU A  20
ALA A  84
GLU A 166
PHE A  86
LEU A 143
 None
 1.14A 4retC-1ftgA:
undetectable		 4retC-1ftgA:
10.90
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.
1j1w ISOCITRATE
DEHYDROGENASE

(Azotobacter
vinelandii) 		PF03971
(IDH) 		5 LEU A 680
LEU A  22
GLY A  31
GLU A 679
LEU A 617
 None
 1.15A 4retC-1j1wA:
0.0		 4retC-1j1wA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jx2 MYOSIN-2 HEAVY
CHAIN,DYNAMIN-A

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		5 LEU A 307
LEU A 432
GLU A 303
PHE A 292
LEU A 318
 None
 1.10A 4retC-1jx2A:
2.2		 4retC-1jx2A:
22.36
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.
1k1x 4-ALPHA-GLUCANOTRANS
FERASE

(Thermococcus
litoralis) 		PF03065
(Glyco_hydro_57)
PF09094
(DUF1925)
PF09095
(DUF1926) 		5 GLU A 216
LEU A 366
GLY A  20
PHE A  23
LEU A  54
 None
 1.20A 4retC-1k1xA:
0.6		 4retC-1k1xA:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k7h ALKALINE PHOSPHATASE

(Pandalus
borealis) 		PF00245
(Alk_phosphatase) 		5 ASP A 225
GLU A 165
GLY A 221
ALA A 212
LEU A 229
 None
 1.28A 4retC-1k7hA:
0.0		 4retC-1k7hA:
18.82
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.
1og6 HYPOTHETICAL
OXIDOREDUCTASE YDHF

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 GLU A 138
ASP A 102
GLY A  85
ALA A  87
LEU A 133
 None
 1.13A 4retC-1og6A:
undetectable		 4retC-1og6A:
14.89
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.
1og6 HYPOTHETICAL
OXIDOREDUCTASE YDHF

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 GLU A 138
ASP A 102
LEU A 168
GLY A  85
ALA A  87
 None
 1.26A 4retC-1og6A:
undetectable		 4retC-1og6A:
14.89
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.
1r1n FERRIC-IRON BINDING
PROTEIN

(Neisseria
gonorrhoeae) 		PF01547
(SBP_bac_1) 		5 LEU A  98
GLY A 251
ALA A 247
PHE A 248
ARG A  22
 None
 1.30A 4retC-1r1nA:
0.0		 4retC-1r1nA:
16.97
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.
1s1f PUTATIVE CYTOCHROME
P450

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 LEU A 361
GLU A 362
GLU A 265
PHE A 254
LEU A 144
 None
 1.14A 4retC-1s1fA:
undetectable		 4retC-1s1fA:
18.20
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.
1vcg ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Thermus
thermophilus) 		PF01070
(FMN_dh) 		5 GLU A  74
LEU A  80
LEU A  99
ALA A 285
LEU A  11
 None
None
None
FMN  A 501 (-2.9A)
None
 1.23A 4retC-1vcgA:
undetectable		 4retC-1vcgA:
15.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wlo SUFE PROTEIN

(Thermus
thermophilus) 		PF02657
(SufE) 		5 LEU A 119
GLU A  89
GLY A  80
ALA A  77
LEU A  10
 None
 1.17A 4retC-1wloA:
undetectable		 4retC-1wloA:
9.22
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.
1xmx HYPOTHETICAL PROTEIN
VC1899

(Vibrio cholerae) 		PF09002
(DUF1887) 		5 GLU A 250
LEU A 186
LEU A 164
GLY A 172
ALA A 176
 None
 1.09A 4retC-1xmxA:
5.4		 4retC-1xmxA:
15.57
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.
2aky ADENYLATE KINASE

(Saccharomyces
cerevisiae) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 LEU A  33
GLY A  85
ALA A  81
GLU A  75
ARG A  27
 None
 1.27A 4retC-2akyA:
2.4		 4retC-2akyA:
12.87
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.
2dhr FTSH

(Thermus
thermophilus) 		PF00004
(AAA)
PF01434
(Peptidase_M41) 		5 LEU A 312
GLU A 455
GLY A 448
GLU A 419
ARG A 503
 None
 1.23A 4retC-2dhrA:
undetectable		 4retC-2dhrA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f8l HYPOTHETICAL PROTEIN
LMO1582

(Listeria
monocytogenes) 		PF02384
(N6_Mtase) 		5 ASP A 124
LEU A 123
GLY A 181
PHE A 226
LEU A 197
 SAM  A 400 ( 4.8A)
None
SAM  A 400 (-3.6A)
SAM  A 400 (-4.9A)
None
 1.05A 4retC-2f8lA:
2.6		 4retC-2f8lA:
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.
2fjk FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Thermus
caldophilus) 		PF01116
(F_bP_aldolase) 		5 GLU A 297
GLY A  20
GLU A 130
PHE A  22
LEU A 256
 None
 1.25A 4retC-2fjkA:
undetectable		 4retC-2fjkA:
16.65
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.
2glx 1,5-ANHYDRO-D-FRUCTO
SE REDUCTASE

(Ensifer
adhaerens) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLU A 330
LEU A 218
GLY A 314
ALA A 182
ARG A 104
 None
 1.21A 4retC-2glxA:
5.1		 4retC-2glxA:
16.20
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.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
cruzi) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		5 GLN A 239
LEU A 456
GLU A 238
ALA A 436
PHE A 484
 None
 1.30A 4retC-2h2qA:
undetectable		 4retC-2h2qA:
19.98
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.
2i4c BICARBONATE
TRANSPORTER

(Synechocystis
sp. PCC 6803) 		PF13379
(NMT1_2) 		5 GLN A 298
GLY A 293
ALA A 289
PHE A  83
LEU A  63
 None
 1.25A 4retC-2i4cA:
undetectable		 4retC-2i4cA:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ic7 MALTOSE
TRANSACETYLASE

(Geobacillus
kaustophilus) 		PF00132
(Hexapep)
PF12464
(Mac)
PF14602
(Hexapep_2) 		5 ASP A  91
LEU A  90
GLY A  87
PHE A  67
LEU A  53
 None
 1.25A 4retC-2ic7A:
undetectable		 4retC-2ic7A:
11.10
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.
2khz C-MYC-RESPONSIVE
PROTEIN RCL

(Rattus
norvegicus) 		PF05014
(Nuc_deoxyrib_tr) 		5 GLU A  44
GLU A  50
GLY A  16
ALA A  81
PHE A  14
 None
 1.21A 4retC-2khzA:
2.5		 4retC-2khzA:
10.52
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.
2p2v ALPHA-2,3-SIALYLTRAN
SFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		5 LEU A 225
GLU A 172
GLY A 167
ALA A  22
LEU A 211
 None
 1.17A 4retC-2p2vA:
undetectable		 4retC-2p2vA:
13.96
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.
2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Aromatoleum
aromaticum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLU A 159
LEU A 357
LEU A 141
GLY A 328
ALA A 306
 None
 1.29A 4retC-2qdeA:
undetectable		 4retC-2qdeA:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium etli) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 GLU A 602
ASP A 599
LEU A 616
ALA A 982
PHE A 979
 None
 1.06A 4retC-2qf7A:
2.9		 4retC-2qf7A:
22.65
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.
2v6b L-LACTATE
DEHYDROGENASE

(Deinococcus
radiodurans) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A 251
ALA A  39
GLU A 259
LEU A  51
ARG A  58
 None
 1.24A 4retC-2v6bA:
undetectable		 4retC-2v6bA:
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.
2v8j PECTATE LYASE

(Yersinia
enterocolitica) 		PF06917
(Pectate_lyase_2) 		5 GLU A 486
LEU A  66
LEU A 536
GLY A  36
ALA A  20
 None
 1.22A 4retC-2v8jA:
undetectable		 4retC-2v8jA:
19.55
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.
2zwv PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF05175
(MTS) 		5 GLU A  73
LEU A  50
LEU A 269
ALA A 125
ARG A 113
 None
 1.18A 4retC-2zwvA:
undetectable		 4retC-2zwvA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zy2 L-ASPARTATE
4-CARBOXYLYASE

(Pseudomonas sp.
ATCC 19121) 		PF00155
(Aminotran_1_2) 		5 LEU A 130
GLU A  84
ALA A  60
PHE A  57
LEU A 103
 None
 1.15A 4retC-2zy2A:
undetectable		 4retC-2zy2A:
19.83
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.
3a55 PROTEIN-GLUTAMINASE

(Chryseobacterium
proteolyticum) 		no annotation 5 GLN A  48
LEU A  45
GLY A 155
ALA A 158
PHE A 280
 None
 1.21A 4retC-3a55A:
undetectable		 4retC-3a55A:
14.59
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.
3afl OLIGO ALGINATE LYASE

(Agrobacterium
fabrum) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		5 LEU A 658
LEU A 630
GLU A 632
ALA A 720
LEU A 734
 None
 1.20A 4retC-3aflA:
undetectable		 4retC-3aflA:
21.71
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.
3b89 16S RRNA METHYLASE

(Escherichia
coli) 		PF07091
(FmrO) 		5 ASP A 131
LEU A 155
LEU A  69
GLY A 135
ALA A  18
 5GP  A 500 (-3.1A)
None
None
None
None
 1.23A 4retC-3b89A:
2.2		 4retC-3b89A:
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.
3bc8 O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Mus musculus) 		PF05889
(SepSecS) 		5 GLN A 280
LEU A 123
GLY A 297
ALA A 135
PHE A 298
 None
 1.26A 4retC-3bc8A:
undetectable		 4retC-3bc8A:
18.13
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.
3bc9 ALPHA AMYLASE,
CATALYTIC REGION

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 GLU A 323
ASP A 305
GLU A 301
GLY A 284
ALA A 318
 CA  A 701 (-3.3A)
CA  A 701 ( 3.0A)
None
None
None
 1.22A 4retC-3bc9A:
undetectable		 4retC-3bc9A:
19.20
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.
3cx7 GLUTAMATE
TRANSPORTER
ASSOCIATED PROTEIN
48

(Rattus
norvegicus) 		PF09128
(RGS-like) 		5 GLN B 470
GLU B 463
LEU B 454
LEU B 474
PHE B 328
 None
 1.30A 4retC-3cx7B:
undetectable		 4retC-3cx7B:
11.76
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.
3dwc METALLOCARBOXYPEPTID
ASE

(Trypanosoma
cruzi) 		PF02074
(Peptidase_M32) 		5 GLN A 274
LEU A 457
GLY A 268
ALA A 302
ARG A 215
 None
 1.25A 4retC-3dwcA:
3.3		 4retC-3dwcA:
19.20
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.
3e74 ALLANTOINASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 ASP A 385
LEU A 427
LEU A  14
GLU A  15
GLY A  54
 None
 1.23A 4retC-3e74A:
undetectable		 4retC-3e74A:
20.19
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.
3err FUSION PROTEIN OF
MICROTUBULE BINDING
DOMAIN FROM MOUSE
CYTOPLASMIC DYNEIN
AND SERYL-TRNA
SYNTHETASE FROM
THERMUS THERMOPHILUS

(Mus musculus;
Thermus
thermophilus) 		PF00587
(tRNA-synt_2b)
PF12777
(MT) 		5 LEU A 362
LEU A  98
GLU A  95
GLY A 201
ALA A 232
 None
 1.20A 4retC-3errA:
3.0		 4retC-3errA:
19.67
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.
3euj CHROMOSOME PARTITION
PROTEIN MUKB, LINKER

([Haemophilus]
ducreyi) 		PF04310
(MukB)
PF13558
(SbcCD_C) 		5 LEU A  41
LEU A 178
GLY A 134
ALA A  81
LEU A 112
 None
 1.29A 4retC-3eujA:
undetectable		 4retC-3eujA:
19.03
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.
3ezy DEHYDROGENASE

(Thermotoga
maritima) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLU A  92
LEU A 116
GLY A 307
PHE A 120
ARG A 122
 None
 1.27A 4retC-3ezyA:
undetectable		 4retC-3ezyA:
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.
3fdd L-ASPARTATE-BETA-DEC
ARBOXYLASE

(Comamonas
testosteroni) 		PF00155
(Aminotran_1_2) 		5 LEU A 130
GLU A  84
ALA A  60
PHE A  57
LEU A 103
 None
 1.16A 4retC-3fddA:
undetectable		 4retC-3fddA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fpk FERREDOXIN-NADP
REDUCTASE

(Salmonella
enterica) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 LEU A  19
GLU A 245
GLY A 115
ALA A 143
LEU A 122
 None
FAD  A 301 ( 4.3A)
None
None
None
 1.20A 4retC-3fpkA:
undetectable		 4retC-3fpkA:
13.31
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.
3g5b NETRIN RECEPTOR
UNC5B

(Rattus
norvegicus) 		PF00531
(Death)
PF00791
(ZU5)
PF17217
(UPA) 		5 LEU A 907
GLU A 911
GLY A 570
LEU A 565
ARG A 555
 None
 1.21A 4retC-3g5bA:
undetectable		 4retC-3g5bA:
18.74
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.
3gmw BETA-LACTAMASE
INHIBITORY PROTEIN
BLIP-I

(Streptomyces
exfoliatus) 		PF07467
(BLIP) 		5 GLN B  11
GLU B   7
GLY B  25
ALA B  30
PHE B   4
 None
 1.26A 4retC-3gmwB:
undetectable		 4retC-3gmwB:
8.92
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.
3i6e MUCONATE
CYCLOISOMERASE I

(Ruegeria
pomeroyi) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLU A 341
LEU A 359
GLY A 306
ALA A 308
LEU A 368
 None
 1.07A 4retC-3i6eA:
undetectable		 4retC-3i6eA:
18.34
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.
3kfu NON-DISCRIMINATING
AND ARCHAEAL-TYPE
ASPARTYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 LEU A 270
GLU A 293
GLY A 300
ALA A 303
ARG A 396
 None
 1.16A 4retC-3kfuA:
undetectable		 4retC-3kfuA:
18.69
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.
3l6c SERINE RACEMASE

(Rattus
norvegicus) 		PF00291
(PALP) 		5 GLU A 283
GLU A  47
GLY A 289
ALA A 292
GLU A 266
 PLP  A 350 ( 3.8A)
None
None
None
None
 1.17A 4retC-3l6cA:
1.8		 4retC-3l6cA:
16.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3myb ENOYL-COA HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		5 GLU A  31
LEU A  68
LEU A   5
GLY A  65
ALA A 111
 None
None
None
None
GOL  A 300 (-3.6A)
 1.30A 4retC-3mybA:
undetectable		 4retC-3mybA:
14.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		7 ASP A 121
LEU A 125
GLY A 319
ALA A 323
GLU A 327
PHE A 783
LEU A 793
 OBN  A   1 (-3.4A)
None
OBN  A   1 ( 4.8A)
OBN  A   1 (-3.2A)
None
OBN  A   1 (-3.5A)
None
 0.96A 4retC-3n23A:
52.4		 4retC-3n23A:
97.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n23 SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		8 LEU A 125
GLU A 312
GLY A 319
ALA A 323
GLU A 327
PHE A 783
LEU A 793
ARG A 880
 None
None
OBN  A   1 ( 4.8A)
OBN  A   1 (-3.2A)
None
OBN  A   1 (-3.5A)
None
OBN  A   1 (-3.7A)
 0.97A 4retC-3n23A:
52.4		 4retC-3n23A:
97.16
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.
3n6r PROPIONYL-COA
CARBOXYLASE, ALPHA
SUBUNIT
PROPIONYL-COA
CARBOXYLASE, BETA
SUBUNIT

(Roseobacter
denitrificans;
Ruegeria
pomeroyi) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 GLN A 643
GLU B  76
LEU A 646
GLU A 645
ALA A 530
 None
 1.28A 4retC-3n6rA:
undetectable		 4retC-3n6rA:
22.21
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.
3ohm 1-PHOSPHATIDYLINOSIT
OL-4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		5 LEU B 464
LEU B 315
GLY B 461
ALA B 436
LEU B 354
 None
 1.04A 4retC-3ohmB:
undetectable		 4retC-3ohmB:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3om5 LEVANSUCRASE

(Bacillus
megaterium) 		PF02435
(Glyco_hydro_68) 		5 ASP A 231
LEU A 328
GLU A 327
GLY A 324
ALA A 322
 None
 1.07A 4retC-3om5A:
undetectable		 4retC-3om5A:
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.
3org CMCLC

(Cyanidioschyzon
merolae) 		PF00654
(Voltage_CLC) 		5 LEU A 102
LEU A 264
GLY A 251
ALA A 217
LEU A 174
 None
 1.21A 4retC-3orgA:
undetectable		 4retC-3orgA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pao ADENOSINE DEAMINASE

(Pseudomonas
aeruginosa) 		PF00962
(A_deaminase) 		5 GLN A 102
GLY A 166
ALA A 195
GLU A 171
ARG A 185
 None
 1.20A 4retC-3paoA:
undetectable		 4retC-3paoA:
17.92
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 5 LEU L 389
LEU L 291
GLY L 395
PHE L 341
LEU L 345
 None
 1.24A 4retC-3rkoL:
undetectable		 4retC-3rkoL:
21.25
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.
4bb9 GLUCOKINASE
REGULATORY PROTEIN

(Homo sapiens) 		no annotation 5 GLU A 424
LEU A 416
LEU A 397
ALA A 437
PHE A 453
 None
 1.30A 4retC-4bb9A:
4.8		 4retC-4bb9A:
21.87
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.
4bi9 3-KETOACYL-COA
THIOLASE, PUTATIVE

(Trypanosoma
brucei) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 LEU A 298
LEU A 344
GLY A 425
ALA A 165
PHE A 179
 None
 1.28A 4retC-4bi9A:
undetectable		 4retC-4bi9A:
17.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e1l ACETOACETYL-COA
THIOLASE 2

(Clostridioides
difficile) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLU A 318
LEU A 375
GLY A 355
ALA A 353
GLU A 116
 None
 1.30A 4retC-4e1lA:
undetectable		 4retC-4e1lA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hkm ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Xanthomonas
campestris) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N) 		5 GLU A 136
LEU A 128
GLU A 140
GLY A 152
ARG A  69
 None
 1.16A 4retC-4hkmA:
undetectable		 4retC-4hkmA:
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.
4hkt INOSITOL
2-DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLU A  92
LEU A 116
GLY A 307
PHE A 120
ARG A 122
 None
GOL  A 413 (-4.0A)
None
None
None
 1.27A 4retC-4hktA:
undetectable		 4retC-4hktA:
16.38
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.
4ihe THNT PROTEIN

(Streptomyces
cattleya) 		PF03576
(Peptidase_S58) 		5 LEU A 204
LEU A 213
GLY A 364
ALA A 362
LEU A 237
 None
 1.24A 4retC-4iheA:
undetectable		 4retC-4iheA:
16.99
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.
4iq4 NON-HAEM
BROMOPEROXIDASE
BPO-A2, MATRIX
PROTEIN 1

(Influenza A
virus;
Kitasatospora
aureofaciens) 		PF00561
(Abhydrolase_1)
PF00598
(Flu_M1) 		5 LEU A 322
LEU A 303
GLY A 344
GLU A 354
PHE A 362
 None
 1.31A 4retC-4iq4A:
2.2		 4retC-4iq4A:
18.10
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.
4jw1 EFFECTOR PROTEIN B

(Legionella
pneumophila) 		no annotation 5 GLN A  81
ASP A 256
LEU A 257
GLU A  83
GLY A  88
 None
 1.29A 4retC-4jw1A:
undetectable		 4retC-4jw1A:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k0r CRYPTOCHROME-1

(Mus musculus) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 ASP A  61
LEU A  62
LEU A 386
GLY A 258
LEU A 218
 None
 1.24A 4retC-4k0rA:
undetectable		 4retC-4k0rA:
21.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kjr CATION EXCHANGER
YFKE

(Bacillus
subtilis) 		PF01699
(Na_Ca_ex) 		5 GLN A 281
LEU A  73
GLU A  72
ALA A 259
LEU A 100
 None
 1.24A 4retC-4kjrA:
undetectable		 4retC-4kjrA:
15.52
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.
4kt1 R-SPONDIN-1

(Homo sapiens) 		PF15913
(Furin-like_2) 		5 ASP E  85
LEU E  64
GLU E  65
GLY E  82
ALA E 104
 None
 1.18A 4retC-4kt1E:
undetectable		 4retC-4kt1E:
6.35
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.
4n0p PILUS ASSEMBLY
PROTEIN CPAE

(Caulobacter
vibrioides) 		no annotation 5 ASP A 185
LEU A 193
GLU A 137
GLY A 162
ALA A 165
 None
 1.08A 4retC-4n0pA:
2.0		 4retC-4n0pA:
9.83
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.
4nbq POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Coxiella
burnetii) 		PF00013
(KH_1)
PF00575
(S1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		5 LEU A 354
GLU A 433
ALA A 413
PHE A 381
ARG A 429
 None
 1.28A 4retC-4nbqA:
undetectable		 4retC-4nbqA:
21.65
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.
4opf NRPS/PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 LEU A6197
GLU A6452
GLY A6342
GLU A6200
PHE A6132
 None
 1.29A 4retC-4opfA:
undetectable		 4retC-4opfA:
18.96
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		5 LEU A 356
GLU A 186
GLY A 192
ALA A 196
LEU A 441
 None
 1.26A 4retC-4pevA:
undetectable		 4retC-4pevA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qj4 1-PHOSPHATIDYLINOSIT
OL 4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		5 LEU B 464
LEU B 315
GLY B 461
ALA B 436
LEU B 354
 None
 1.24A 4retC-4qj4B:
undetectable		 4retC-4qj4B:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qny MITOGEN ACTIVATED
PROTEIN KINASE,
PUTATIVE

(Leishmania
donovani) 		PF00069
(Pkinase) 		5 GLN A 205
LEU A 137
GLY A 210
LEU A 286
ARG A 288
 None
 1.29A 4retC-4qnyA:
undetectable		 4retC-4qnyA:
17.99
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.
4qok MEL5 TCR CHAIN BETA

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU E  21
LEU E 103
GLY E 108
ALA E   9
PHE E  88
 None
 1.31A 4retC-4qokE:
undetectable		 4retC-4qokE:
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.
4u8h CRYPTOCHROME-2

(Mus musculus) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 ASP A  79
LEU A  80
LEU A 404
GLY A 276
LEU A 236
 None
 1.19A 4retC-4u8hA:
undetectable		 4retC-4u8hA:
18.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wmj GLUCOSE-6-PHOSPHATE
ISOMERASE

(Colias
eurytheme) 		PF00342
(PGI) 		5 LEU A 279
GLU A 294
ALA A 303
GLU A 498
LEU A 130
 None
 1.19A 4retC-4wmjA:
undetectable		 4retC-4wmjA:
22.29
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.
4wnr LEUCINE-RICH-REPEAT
PROTEIN

(Methanosarcina
barkeri) 		PF08477
(Roc)
PF16095
(COR) 		5 LEU A 429
LEU A 477
GLY A 454
GLU A 439
LEU A 413
 None
None
None
SO4  A 704 ( 4.4A)
None
 1.09A 4retC-4wnrA:
undetectable		 4retC-4wnrA:
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.
4zpj EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Sphaerobacter
thermophilus) 		PF13458
(Peripla_BP_6) 		5 GLU A  98
GLY A 361
ALA A 337
PHE A 351
LEU A 106
 None
 1.18A 4retC-4zpjA:
undetectable		 4retC-4zpjA:
17.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5aw4 NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 LEU A 800
GLU A 915
GLY A 865
ALA A 991
LEU A 983
 None
 1.29A 4retC-5aw4A:
47.8		 4retC-5aw4A:
87.45
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.
5f38 ACETYL-COA
ACETYLTRANSFERASE

(Escherichia
coli) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLU B 318
LEU B 375
GLY B 355
ALA B 353
GLU B 116
 None
None
CSX  B  88 ( 4.3A)
None
None
 1.29A 4retC-5f38B:
undetectable		 4retC-5f38B:
17.82
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.
5gp9 TRANSCRIPTIONAL
REGULATOR (TETR/ACRR
FAMILY)

(Bacillus
halodurans) 		PF00440
(TetR_N)
PF08359
(TetR_C_4) 		5 ASP A  79
LEU A 130
GLY A 138
PHE A 144
LEU A 189
 None
 1.20A 4retC-5gp9A:
undetectable		 4retC-5gp9A:
11.19
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.
5gw7 GLUCOSIDASE YGJK

(Escherichia
coli) 		PF01204
(Trehalase) 		5 GLU A 108
LEU A  87
LEU A 224
GLY A  52
PHE A  53
 None
 1.29A 4retC-5gw7A:
undetectable		 4retC-5gw7A:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hu4 CYSTEINE PROTEASE

(Listeria
monocytogenes) 		PF04203
(Sortase) 		5 LEU A  82
GLU A  83
GLY A  47
ALA A 110
GLU A 132
 None
 1.15A 4retC-5hu4A:
undetectable		 4retC-5hu4A:
8.92
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.
5i51 TRANSKETOLASE

(Scheffersomyces
stipitis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLN A 526
LEU A 565
LEU A 356
GLY A 560
ALA A 558
 None
 1.28A 4retC-5i51A:
undetectable		 4retC-5i51A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k8b 8-AMINO-3,8-DIDEOXY-
ALPHA-D-MANNO-OCTULO
SONATE TRANSAMINASE

(Shewanella
oneidensis) 		PF01041
(DegT_DnrJ_EryC1) 		5 GLN A 258
GLY A 164
ALA A 170
GLU A 156
LEU A 248
 None
 1.31A 4retC-5k8bA:
undetectable		 4retC-5k8bA:
17.36
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.
5mrw POTASSIUM-TRANSPORTI
NG ATPASE
ATP-BINDING SUBUNIT

(Escherichia
coli) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		5 GLU B 218
LEU B 636
GLY B 565
ALA B 298
ARG B 212
 None
 1.20A 4retC-5mrwB:
10.2		 4retC-5mrwB:
24.15
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.
5nmp ISATIN HYDROLASE

(Ralstonia
solanacearum) 		no annotation 5 ASP A 200
LEU A 228
GLU A 195
ALA A 179
GLU A 181
 None
 1.24A 4retC-5nmpA:
undetectable		 4retC-5nmpA:
7.03
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.
5ve8 KAP123

(Kluyveromyces
lactis) 		no annotation 5 GLU A 889
LEU A 904
GLU A 919
GLU A 903
LEU A 843
 None
 1.01A 4retC-5ve8A:
undetectable		 4retC-5ve8A:
22.23
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.
5x8h SHORT-CHAIN
DEHYDROGENASE
REDUCTASE

(Chryseobacterium
sp. CA49) 		no annotation 5 GLU A  48
ASP A  49
GLU A  40
GLY A  15
GLU A 218
 None
 1.19A 4retC-5x8hA:
3.3		 4retC-5x8hA:
14.01
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.
5xoy [LYSW]-LYSINE
HYDROLASE

(Thermus
thermophilus) 		PF01546
(Peptidase_M20) 		5 LEU A  41
GLY A 105
ALA A 102
LEU A 114
ARG A 113
 None
 1.25A 4retC-5xoyA:
undetectable		 4retC-5xoyA:
17.44
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		5 GLU C1760
LEU C1939
LEU C1752
GLU C1993
PHE C1900
 None
 1.19A 4retC-5y3rC:
undetectable		 4retC-5y3rC:
13.21
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.
5yw5 ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Francisella
tularensis) 		no annotation 5 LEU A 120
GLU A  61
GLY A  68
ALA A  72
PHE A  79
 None
 1.01A 4retC-5yw5A:
undetectable		 4retC-5yw5A:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6a91 -

(-) 		no annotation 5 LEU A1345
LEU A1055
GLY A1357
ALA A1329
ARG A1384
 None
PC1  A1609 ( 4.3A)
None
None
PC1  A1609 (-3.1A)
 1.18A 4retC-6a91A:
2.9		 4retC-6a91A:
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.
6az0 MITOCHONDRIAL INNER
MEMBRANE I-AAA
PROTEASE
SUPERCOMPLEX SUBUNIT
YME1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 365
GLY A 316
GLU A 292
PHE A 439
LEU A 429
 None
 1.30A 4retC-6az0A:
undetectable		 4retC-6az0A:
19.20
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.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 5 GLN A 506
LEU A 557
LEU A 527
GLU A 567
PHE A 237
 None
 1.18A 4retC-6azpA:
undetectable		 4retC-6azpA:
6.25
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.
6c66 CRISPR-ASSOCIATED
PROTEIN, CAS5E
FAMILY

(Thermobifida
fusca) 		no annotation 5 LEU M  27
GLY M  37
ALA M  40
GLU M 121
PHE M 207
 None
U  J   2 ( 3.3A)
A  J   1 ( 4.0A)
None
U  J   2 ( 4.1A)
 1.25A 4retC-6c66M:
undetectable		 4retC-6c66M:
6.07
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.
6dch SCOE PROTEIN

(Streptomyces
coeruleorubidus) 		no annotation 5 GLU A 281
ASP A 284
LEU A 286
GLU A 154
GLY A 158
 None
 1.16A 4retC-6dchA:
undetectable		 4retC-6dchA:
6.60
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.
6fai ESSENTIAL NUCLEAR
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU i 311
GLY i 339
ALA i 343
PHE i 371
LEU i 359
 None
None
G  21267 ( 3.2A)
None
None
 1.17A 4retC-6faii:
undetectable		 4retC-6faii:
5.99
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.
1a8p NADPH:FERREDOXIN
OXIDOREDUCTASE

(Azotobacter
vinelandii) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 ASN A 148
VAL A 144
THR A  18
ILE A  69
 None
None
None
FAD  A 259 (-3.6A)
 1.23A 4retC-1a8pA:
3.0		 4retC-1a8pA:
13.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ci3 PROTEIN (CYTOCHROME
F)

(Phormidium
laminosum) 		PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N) 		4 ASN M 173
VAL M 221
THR M 228
ILE M 214
 None
 1.50A 4retC-1ci3M:
undetectable		 4retC-1ci3M:
13.45
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.
1d0b INTERNALIN B

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4) 		4 ASN A 108
VAL A  91
THR A  56
ILE A  57
 None
 1.42A 4retC-1d0bA:
0.0		 4retC-1d0bA:
11.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e5f METHIONINE
GAMMA-LYASE

(Trichomonas
vaginalis) 		PF01053
(Cys_Met_Meta_PP) 		4 ASN A 185
VAL A 200
THR A 155
ILE A 164
 None
 1.50A 4retC-1e5fA:
2.1		 4retC-1e5fA:
18.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ekj BETA-CARBONIC
ANHYDRASE

(Pisum sativum) 		PF00484
(Pro_CA) 		4 ASN A 183
VAL A 217
THR A 199
ILE A 203
 None
None
CL  A2007 (-4.1A)
None
 1.31A 4retC-1ekjA:
undetectable		 4retC-1ekjA:
11.42
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.
1g3m ESTROGEN
SULFOTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		4 ASN A 130
VAL A 136
THR A 260
ILE A 259
 None
 1.48A 4retC-1g3mA:
0.0		 4retC-1g3mA:
14.30
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.
1g8x MYOSIN II HEAVY
CHAIN FUSED TO
ALPHA-ACTININ 3

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF00435
(Spectrin)
PF02736
(Myosin_N) 		4 ASN A 679
VAL A 124
THR A 178
ILE A 177
 None
 1.21A 4retC-1g8xA:
0.0		 4retC-1g8xA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gdh D-GLYCERATE
DEHYDROGENASE

(Hyphomicrobium
methylovorum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 ASN A 210
VAL A 236
THR A 105
ILE A 108
 None
 1.40A 4retC-1gdhA:
3.0		 4retC-1gdhA:
14.62
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.
1gpp ENDONUCLEASE PI-SCEI

(Saccharomyces
cerevisiae) 		PF05203
(Hom_end_hint) 		4 ASN A 448
VAL A 452
THR A   6
ILE A  18
 None
 1.47A 4retC-1gppA:
0.0		 4retC-1gppA:
12.28
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.
1jx2 MYOSIN-2 HEAVY
CHAIN,DYNAMIN-A

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		4 ASN A 690
VAL A 135
THR A 189
ILE A 188
 None
 0.99A 4retC-1jx2A:
2.5		 4retC-1jx2A:
22.36
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.
1jzt HYPOTHETICAL 27.5
KDA PROTEIN IN
SPX19-GCR2
INTERGENIC REGION

(Saccharomyces
cerevisiae) 		PF03853
(YjeF_N) 		4 ASN A  70
VAL A 137
THR A 176
ILE A 190
 None
 1.40A 4retC-1jztA:
3.2		 4retC-1jztA:
13.39
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.
1ny5 TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00072
(Response_reg)
PF00158
(Sigma54_activat) 		4 ASN A 282
VAL A 287
THR A 279
ILE A 240
 None
 1.39A 4retC-1ny5A:
undetectable		 4retC-1ny5A:
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.
1oxx ABC TRANSPORTER, ATP
BINDING PROTEIN

(Sulfolobus
solfataricus) 		PF00005
(ABC_tran) 		4 ASN K 245
VAL K 281
THR K 314
ILE K 313
 None
 1.33A 4retC-1oxxK:
undetectable		 4retC-1oxxK:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q5a EP-CADHERIN

(Mus musculus) 		PF00028
(Cadherin) 		4 ASN A 278
VAL A 302
THR A 245
ILE A 220
 None
None
NAG  A 802 (-2.1A)
NAG  A 802 ( 4.8A)
 1.46A 4retC-1q5aA:
undetectable		 4retC-1q5aA:
22.67
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.
1qaf PROTEIN (COPPER
AMINE OXIDASE)

(Escherichia
coli) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3)
PF07833
(Cu_amine_oxidN1) 		4 ASN A 465
VAL A 492
THR A 223
ILE A 246
 TPQ  A 466 ( 3.3A)
None
None
None
 1.26A 4retC-1qafA:
undetectable		 4retC-1qafA:
22.21
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.
1qnh PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Plasmodium
falciparum) 		PF00160
(Pro_isomerase) 		4 ASN A  17
VAL A 145
THR A 166
ILE A 165
 None
 1.05A 4retC-1qnhA:
undetectable		 4retC-1qnhA:
9.80
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.
1u9z RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE

(Methanocaldococcus
jannaschii) 		PF00156
(Pribosyltran)
PF13793
(Pribosyltran_N) 		4 ASN A 123
VAL A 279
THR A 121
ILE A 120
 None
 1.42A 4retC-1u9zA:
undetectable		 4retC-1u9zA:
14.91
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.
1vcw PROTEASE DEGS

(Escherichia
coli) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		4 ASN A 216
VAL A 206
THR A 192
ILE A 173
 None
 1.47A 4retC-1vcwA:
undetectable		 4retC-1vcwA:
15.00
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.
1woc PRIMOSOMAL
REPLICATION PROTEIN
N

(Escherichia
coli) 		PF00436
(SSB) 		4 ASN A  59
VAL A  74
THR A  63
ILE A  66
 None
 1.13A 4retC-1wocA:
undetectable		 4retC-1wocA:
8.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xhl SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY MEMBER
(5L265), PUTATIVE
TROPINONE
REDUCTASE-II

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		4 ASN A  92
VAL A  67
THR A 130
ILE A  77
 None
NDP  A1278 (-3.9A)
None
None
 1.23A 4retC-1xhlA:
undetectable		 4retC-1xhlA:
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.
1xr6 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		4 ASN A  71
VAL A 245
THR A 306
ILE A 303
 None
 1.21A 4retC-1xr6A:
undetectable		 4retC-1xr6A:
18.41
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.
1yfo RECEPTOR PROTEIN
TYROSINE PHOSPHATASE
ALPHA

(Mus musculus) 		PF00102
(Y_phosphatase) 		4 ASN A 422
VAL A 328
THR A 324
ILE A 319
 None
 1.47A 4retC-1yfoA:
2.0		 4retC-1yfoA:
14.61
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.
1yi7 BETA-XYLOSIDASE,
FAMILY 43 GLYCOSYL
HYDROLASE

(Clostridium
acetobutylicum) 		PF04616
(Glyco_hydro_43) 		4 ASN A 514
VAL A 396
THR A 420
ILE A 421
 None
 1.33A 4retC-1yi7A:
undetectable		 4retC-1yi7A:
18.28
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.
1yz4 DUAL SPECIFICITY
PHOSPHATASE-LIKE 15
ISOFORM A

(Homo sapiens) 		PF00782
(DSPc) 		4 ASN A 128
VAL A  55
THR A  97
ILE A  98
 None
 1.26A 4retC-1yz4A:
3.4		 4retC-1yz4A:
10.24
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.
1yz4 DUAL SPECIFICITY
PHOSPHATASE-LIKE 15
ISOFORM A

(Homo sapiens) 		PF00782
(DSPc) 		4 ASN A 128
VAL A  61
THR A  97
ILE A  98
 None
 1.37A 4retC-1yz4A:
3.4		 4retC-1yz4A:
10.24
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.
1z3z DIALKYLGLYCINE
DECARBOXYLASE

(Burkholderia
cepacia) 		PF00202
(Aminotran_3) 		4 ASN A 394
VAL A 404
THR A 383
ILE A 382
 None
 1.23A 4retC-1z3zA:
undetectable		 4retC-1z3zA:
19.48
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.
2ayu NUCLEOSOME ASSEMBLY
PROTEIN

(Saccharomyces
cerevisiae) 		PF00956
(NAP) 		4 ASN A 314
VAL A 283
THR A 202
ILE A 203
 None
 1.33A 4retC-2ayuA:
undetectable		 4retC-2ayuA:
17.14
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.
2bht CYSTEINE SYNTHASE B

(Escherichia
coli) 		PF00291
(PALP) 		4 ASN A 270
VAL A 196
THR A 167
ILE A 166
 None
 1.27A 4retC-2bhtA:
2.1		 4retC-2bhtA:
15.50
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.
2cjq RNA-DIRECTED RNA
POLYMERASE

(Pestivirus A) 		PF00998
(RdRP_3) 		4 ASN A 117
VAL A 104
THR A 391
ILE A 390
 None
 1.47A 4retC-2cjqA:
undetectable		 4retC-2cjqA:
21.23
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.
2fqd BLUE COPPER OXIDASE
CUEO

(Escherichia
coli) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASN A 487
VAL A 516
THR A 450
ILE A 447
 CIT  A 701 (-3.5A)
None
None
None
 1.43A 4retC-2fqdA:
undetectable		 4retC-2fqdA:
19.62
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.
2g6z DUAL SPECIFICITY
PROTEIN PHOSPHATASE
5

(Homo sapiens) 		PF00782
(DSPc) 		4 ASN A 303
VAL A 230
THR A 272
ILE A 273
 None
 1.25A 4retC-2g6zA:
4.1		 4retC-2g6zA:
10.78
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.
2i44 SERINE-THREONINE
PHOSPHATASE 2C

(Toxoplasma
gondii) 		PF00481
(PP2C) 		4 ASN A 297
VAL A 303
THR A 324
ILE A 269
 None
 1.34A 4retC-2i44A:
undetectable		 4retC-2i44A:
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.
2jfn GLUTAMATE RACEMASE

(Escherichia
coli) 		PF01177
(Asp_Glu_race) 		4 ASN A  93
VAL A 201
THR A 144
ILE A 148
 GLU  A1287 (-4.0A)
None
None
None
 1.37A 4retC-2jfnA:
2.3		 4retC-2jfnA:
15.95
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.
2pyh POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 4

(Azotobacter
vinelandii) 		PF12708
(Pectate_lyase_3) 		4 ASN A 288
VAL A 252
THR A 261
ILE A 260
 None
 1.49A 4retC-2pyhA:
undetectable		 4retC-2pyhA:
16.82
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.
2r3u PROTEASE DEGS

(Escherichia
coli) 		PF13365
(Trypsin_2) 		4 ASN A 216
VAL A 206
THR A 192
ILE A 173
 None
 1.48A 4retC-2r3uA:
undetectable		 4retC-2r3uA:
12.55
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.
2rkc HEMAGGLUTININ

(Measles
morbillivirus) 		PF00423
(HN) 		4 ASN A 513
VAL A 525
THR A 455
ILE A 467
 None
 1.26A 4retC-2rkcA:
undetectable		 4retC-2rkcA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vbf BRANCHED-CHAIN
ALPHA-KETOACID
DECARBOXYLASE

(Lactococcus
lactis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 ASN A 141
VAL A   4
THR A 135
ILE A 162
 ASN  A 141 ( 0.6A)
VAL  A   4 ( 0.6A)
THR  A 135 ( 0.8A)
ILE  A 162 ( 0.7A)
 1.27A 4retC-2vbfA:
2.4		 4retC-2vbfA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vx2 ENOYL-COA HYDRATASE
DOMAIN-CONTAINING
PROTEIN 3

(Homo sapiens) 		PF00378
(ECH_1) 		4 ASN A  58
VAL A  93
THR A 233
ILE A 236
 None
 1.46A 4retC-2vx2A:
undetectable		 4retC-2vx2A:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w4g MYOSIN HEAVY CHAIN,
SKELETAL MUSCLE,
ADULT

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		4 ASN M 698
VAL M 124
THR M 178
ILE M 177
 None
 1.06A 4retC-2w4gM:
undetectable		 4retC-2w4gM:
23.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wqw INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		4 ASN A 108
VAL A  91
THR A  56
ILE A  57
 None
 1.33A 4retC-2wqwA:
undetectable		 4retC-2wqwA:
14.89
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.
2x9q CYCLODIPEPTIDE
SYNTHETASE

(Mycobacterium
tuberculosis) 		PF16715
(CDPS) 		4 ASN A 251
VAL A 116
THR A 240
ILE A 243
 None
 1.43A 4retC-2x9qA:
4.0		 4retC-2x9qA:
13.96
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.
2z2r NUCLEOSOME ASSEMBLY
PROTEIN

(Saccharomyces
cerevisiae) 		PF00956
(NAP) 		4 ASN A 314
VAL A 283
THR A 202
ILE A 203
 None
 1.37A 4retC-2z2rA:
2.1		 4retC-2z2rA:
15.17
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.
3a1n NDP-SUGAR EPIMERASE

(Thermoplasma
volcanium) 		PF01370
(Epimerase) 		4 ASN A 235
VAL A 115
THR A 129
ILE A 130
 None
 1.33A 4retC-3a1nA:
3.4		 4retC-3a1nA:
14.93
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.
3alx HEMAGGLUTININ,LINKER
,CDW150

(Measles
morbillivirus;
Saguinus
oedipus;
synthetic
construct) 		PF00423
(HN)
PF06214
(SLAM) 		4 ASN A 513
VAL A 525
THR A 455
ILE A 467
 None
 1.28A 4retC-3alxA:
undetectable		 4retC-3alxA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3do6 FORMATE--TETRAHYDROF
OLATE LIGASE

(Thermotoga
maritima) 		PF01268
(FTHFS) 		4 ASN A  71
VAL A 284
THR A 247
ILE A  64
 None
 1.47A 4retC-3do6A:
undetectable		 4retC-3do6A:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eua PUTATIVE
FRUCTOSE-AMINOACID-6
-PHOSPHATE DEGLYCASE

(Bacillus
subtilis) 		PF01380
(SIS) 		4 ASN A 181
VAL A 301
THR A 273
ILE A 246
 None
 1.25A 4retC-3euaA:
5.8		 4retC-3euaA:
15.56
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.
3f81 DUAL SPECIFICITY
PROTEIN PHOSPHATASE
3

(Homo sapiens) 		PF00782
(DSPc) 		4 ASN A 163
VAL A   9
THR A 133
ILE A 136
 None
 1.34A 4retC-3f81A:
3.6		 4retC-3f81A:
10.90
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.
3h5l PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC TRANSPORTER

(Ruegeria
pomeroyi) 		PF13458
(Peripla_BP_6) 		4 ASN A 210
VAL A 223
THR A 199
ILE A 198
 None
 1.08A 4retC-3h5lA:
2.9		 4retC-3h5lA:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ju8 SUCCINYLGLUTAMIC
SEMIALDEHYDE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00171
(Aldedh) 		4 ASN A 432
VAL A 257
THR A 266
ILE A 267
 None
 1.41A 4retC-3ju8A:
2.8		 4retC-3ju8A:
18.91
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.
3kl0 GLUCURONOXYLANASE
XYNC

(Bacillus
subtilis) 		PF17189
(Glyco_hydro_30C) 		4 ASN A 289
VAL A 328
THR A 356
ILE A 355
 None
 0.98A 4retC-3kl0A:
undetectable		 4retC-3kl0A:
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.
3lgi PROTEASE DEGS

(Escherichia
coli) 		PF13365
(Trypsin_2) 		4 ASN A 216
VAL A  58
THR A 169
ILE A 168
 None
 1.30A 4retC-3lgiA:
undetectable		 4retC-3lgiA:
14.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lgi PROTEASE DEGS

(Escherichia
coli) 		PF13365
(Trypsin_2) 		4 ASN A 216
VAL A 206
THR A 192
ILE A 173
 None
 1.47A 4retC-3lgiA:
undetectable		 4retC-3lgiA:
14.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3odm PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Clostridium
perfringens) 		PF14010
(PEPcase_2) 		4 ASN A  87
VAL A 122
THR A 127
ILE A 176
 None
 1.27A 4retC-3odmA:
undetectable		 4retC-3odmA:
21.82
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.
3t6w LACCASE

(Steccherinum
ochraceum) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASN A  75
VAL A 466
THR A 474
ILE A 471
 None
 1.34A 4retC-3t6wA:
undetectable		 4retC-3t6wA:
18.29
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.
3uwc NUCLEOTIDE-SUGAR
AMINOTRANSFERASE

(Coxiella
burnetii) 		PF01041
(DegT_DnrJ_EryC1) 		4 ASN A  83
VAL A 340
THR A 132
ILE A 284
 None
 1.42A 4retC-3uwcA:
undetectable		 4retC-3uwcA:
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.
3w9i MULTIDRUG RESISTANCE
PROTEIN MEXB

(Pseudomonas
aeruginosa) 		PF00873
(ACR_tran) 		4 ASN A  83
VAL A  57
THR A  89
ILE A  90
 None
 1.45A 4retC-3w9iA:
undetectable		 4retC-3w9iA:
23.95
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.
3x0t UNCHARACTERIZED
PROTEIN

(Vibrio
parahaemolyticus) 		no annotation 4 ASN A  99
VAL A  17
THR A  52
ILE A  53
 None
 1.47A 4retC-3x0tA:
undetectable		 4retC-3x0tA:
7.54
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.
4asm BETA-AGARASE D

(Zobellia
galactanivorans) 		no annotation 4 ASN B  57
VAL B  40
THR B 119
ILE B 118
 None
 0.80A 4retC-4asmB:
undetectable		 4retC-4asmB:
16.35
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.
4c3o HYDROGENASE-1 LARGE
SUBUNIT

(Salmonella
enterica) 		PF00374
(NiFeSe_Hases) 		4 ASN A  14
VAL A  47
THR A  44
ILE A  43
 None
 0.94A 4retC-4c3oA:
undetectable		 4retC-4c3oA:
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.
4d3y LEGUMAIN

(Cricetulus
griseus) 		PF01650
(Peptidase_C13) 		4 ASN A 201
VAL A 168
THR A 213
ILE A 191
 None
 1.24A 4retC-4d3yA:
2.5		 4retC-4d3yA:
17.73
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.
4d61 EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
GTP-BINDING SUBUNIT
ERF3A

(Homo sapiens) 		PF01201
(Ribosomal_S8e) 		4 ASN i 490
VAL i 271
THR i 284
ILE i 285
 None
 1.11A 4retC-4d61i:
undetectable		 4retC-4d61i:
17.91
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.
4eyv PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Serendipita
indica) 		PF00160
(Pro_isomerase) 		4 ASN A  16
VAL A 138
THR A 159
ILE A 158
 None
 0.92A 4retC-4eyvA:
undetectable		 4retC-4eyvA:
11.44
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.
4hnl MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Enterococcus
gallinarum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ASN A 324
VAL A 319
THR A 308
ILE A 312
 None
 1.42A 4retC-4hnlA:
undetectable		 4retC-4hnlA:
17.92
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.
4l22 PHOSPHORYLASE

(Streptococcus
mutans) 		PF00343
(Phosphorylase) 		4 ASN A  67
VAL A 578
THR A 416
ILE A 415
 None
 0.93A 4retC-4l22A:
2.7		 4retC-4l22A:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pfy ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		4 ASN A 181
VAL A 163
THR A  53
ILE A  54
 None
 1.01A 4retC-4pfyA:
undetectable		 4retC-4pfyA:
17.87
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.
4phb UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		PF14262
(Cthe_2159) 		4 ASN A  38
VAL A  53
THR A  72
ILE A  41
 None
 1.43A 4retC-4phbA:
undetectable		 4retC-4phbA:
15.71
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.
4ppy PUTATIVE
ACYLHYDROLASE

(Bacteroides
fragilis) 		PF13472
(Lipase_GDSL_2) 		4 ASN A  59
VAL A 212
THR A 151
ILE A 170
 None
 1.36A 4retC-4ppyA:
2.5		 4retC-4ppyA:
11.99
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.
4psj OR464

(synthetic
construct) 		PF12354
(Internalin_N)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 ASN A  80
VAL A  63
THR A  28
ILE A  29
 None
 1.38A 4retC-4psjA:
undetectable		 4retC-4psjA:
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.
4qiw DNA-DIRECTED RNA
POLYMERASE
DNA-DIRECTED RNA
POLYMERASE SUBUNIT P

(Thermococcus
kodakarensis) 		PF00562
(RNA_pol_Rpb2_6)
PF03604
(DNA_RNApol_7kD)
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 ASN B  96
VAL B 690
THR B 857
ILE P  34
 None
 1.39A 4retC-4qiwB:
undetectable		 4retC-4qiwB:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r5c LEUCINE RICH REPEAT
PROTEIN

(synthetic
construct) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 ASN A  72
VAL A  55
THR A  20
ILE A  21
 None
 1.39A 4retC-4r5cA:
undetectable		 4retC-4r5cA:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r5d LEUCINE RICH REPEAT
PROTEIN

(synthetic
construct) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 ASN A  72
VAL A  55
THR A  20
ILE A  21
 None
 1.41A 4retC-4r5dA:
undetectable		 4retC-4r5dA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r6f LEUCINE RICH REPEAT
DLRR_I

(synthetic
construct) 		PF12354
(Internalin_N)
PF13855
(LRR_8) 		4 ASN A  72
VAL A  55
THR A  20
ILE A  21
 None
 1.40A 4retC-4r6fA:
undetectable		 4retC-4r6fA:
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.
4r6g LEUCINE RICH REPEATS
DLRR_K

(synthetic
construct) 		PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 ASN A  72
VAL A  55
THR A  20
ILE A  21
 None
 1.35A 4retC-4r6gA:
undetectable		 4retC-4r6gA:
19.79
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.
4rp8 ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA

(Escherichia
coli) 		PF03611
(EIIC-GAT) 		4 ASN A 232
VAL A 327
THR A 284
ILE A 283
 None
 1.32A 4retC-4rp8A:
2.8		 4retC-4rp8A:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uip REPEBODY (RAC1)

(Eptatretus
burgeri;
Listeria
monocytogenes;
synthetic
construct) 		PF11921
(DUF3439)
PF12354
(Internalin_N)
PF13855
(LRR_8) 		4 ASN B  74
VAL B  57
THR B  22
ILE B  23
 None
 1.38A 4retC-4uipB:
undetectable		 4retC-4uipB:
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.
4wd2 AROMATIC-AMINO-ACID
TRANSAMINASE TYRB

(Burkholderia
cenocepacia) 		PF00155
(Aminotran_1_2) 		4 ASN A 242
VAL A 228
THR A  97
ILE A  95
 None
 1.21A 4retC-4wd2A:
undetectable		 4retC-4wd2A:
16.91
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.
4xgt FRQ-INTERACTING RNA
HELICASE

(Neurospora
crassa) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT)
PF13234
(rRNA_proc-arch) 		4 ASN A 237
VAL A 257
THR A 269
ILE A 272
 None
 1.16A 4retC-4xgtA:
2.3		 4retC-4xgtA:
21.65
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.
4yzo PUTATIVE ACYL-COA
ACYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 ASN A 160
VAL A 296
THR A 274
ILE A 153
 None
 1.45A 4retC-4yzoA:
undetectable		 4retC-4yzoA:
18.58
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.
4yzo PUTATIVE ACYL-COA
ACYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 ASN A 160
VAL A 296
THR A 274
ILE A 275
 None
 1.38A 4retC-4yzoA:
undetectable		 4retC-4yzoA:
18.58
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.
4zxz LEVOGLUCOSAN KINASE

(Lipomyces
starkeyi) 		PF03702
(AnmK) 		4 ASN A 332
VAL A 296
THR A 303
ILE A 302
 None
 0.99A 4retC-4zxzA:
undetectable		 4retC-4zxzA:
19.47
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.
5bnn CAPSID PROTEIN VP1
CAPSID PROTEIN VP3
CAPSID PROTEIN VP4

(Enterovirus D) 		PF00073
(Rhv)
PF02226
(Pico_P1A) 		4 ASN A  36
VAL D  66
THR C 164
ILE C 163
 None
 1.18A 4retC-5bnnA:
undetectable		 4retC-5bnnA:
14.47
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.
5c70 GLUCURONIDASE

(Aspergillus
oryzae) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		4 ASN A 286
VAL A 239
THR A 190
ILE A 199
 None
 1.28A 4retC-5c70A:
undetectable		 4retC-5c70A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dpt PLECKSTRIN HOMOLOGY
DOMAIN-CONTAINING
FAMILY M MEMBER 1,
GAMMA-AMINOBUTYRIC
ACID
RECEPTOR-ASSOCIATED
PROTEIN-LIKE
1,GAMMA-AMINOBUTYRIC
ACID
RECEPTOR-ASSOCIATED
PROTEIN-LIKE 1

(Homo sapiens) 		PF02991
(Atg8) 		4 ASN A 105
VAL A  64
THR A  90
ILE A  91
 None
 1.37A 4retC-5dptA:
undetectable		 4retC-5dptA:
9.15
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.
5e02 FRQ-INTERACTING RNA
HELICASE

(Neurospora
crassa) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT)
PF13234
(rRNA_proc-arch) 		4 ASN A 237
VAL A 257
THR A 269
ILE A 272
 None
None
A  C   4 ( 4.7A)
None
 1.23A 4retC-5e02A:
undetectable		 4retC-5e02A:
22.28
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.
5jh5 LYSINE-SPECIFIC
DEMETHYLASE 2B

(Homo sapiens) 		PF00646
(F-box) 		4 ASN A1108
VAL A1155
THR A1134
ILE A1136
 None
 1.48A 4retC-5jh5A:
undetectable		 4retC-5jh5A:
15.01
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.
5lsp HEPATOCYTE GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF01437
(PSI)
PF01833
(TIG) 		4 ASN A 686
VAL A 626
THR A 582
ILE A 583
 None
 1.44A 4retC-5lspA:
undetectable		 4retC-5lspA:
12.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5urb METHIONINE--TRNA
LIGASE

(Acinetobacter
baumannii) 		PF08264
(Anticodon_1)
PF09334
(tRNA-synt_1g) 		4 ASN A 327
VAL A 538
THR A 337
ILE A 339
 None
 1.47A 4retC-5urbA:
undetectable		 4retC-5urbA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w4t CADHERIN 23

(Danio rerio) 		no annotation 4 ASN C   8
VAL C  93
THR C  28
ILE C  27
 None
 1.05A 4retC-5w4tC:
undetectable		 4retC-5w4tC:
6.30
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.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 4 ASN A 208
VAL A 205
THR A 240
ILE A 241
 None
 1.19A 4retC-5yfbA:
undetectable		 4retC-5yfbA:
5.48
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.
6apx MALTOSE-BINDING
PERIPLASMIC
PROTEIN,DUAL
SPECIFICITY PROTEIN
PHOSPHATASE 1

(Escherichia
coli;
Homo sapiens) 		no annotation 4 ASN A1298
VAL A1225
THR A1267
ILE A1268
 None
 1.23A 4retC-6apxA:
4.5		 4retC-6apxA:
21.24
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.
6c90 EXOSOME RNA HELICASE
MTR4,EXOSOME RNA
HELICASE MTR4

(Homo sapiens) 		no annotation 4 ASN A 196
VAL A 216
THR A 228
ILE A 231
 None
 1.10A 4retC-6c90A:
2.0		 4retC-6c90A:
9.11