SIMILAR PATTERNS OF AMINO ACIDS FOR 3LM8_A_VIBA223_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b48 PROTEIN (GLUTATHIONE
S-TRANSFERASE)

(Mus musculus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 LEU A 198
LEU A 161
SER A  18
THR A  99
 None
 0.97A 3lm8A-1b48A:
undetectable
3lm8C-1b48A:
undetectable		 3lm8A-1b48A:
23.75
3lm8C-1b48A:
23.75
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.
1c3e GLYCINAMIDE
RIBONUCLEOTIDE
TRANSFORMYLASE

(Escherichia
coli) 		PF00551
(Formyl_trans_N) 		4 LEU A   6
LEU A  71
ASN A  36
ASP A  68
 None
 1.02A 3lm8A-1c3eA:
4.9
3lm8C-1c3eA:
5.7		 3lm8A-1c3eA:
24.81
3lm8C-1c3eA:
24.81
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.
1c3e GLYCINAMIDE
RIBONUCLEOTIDE
TRANSFORMYLASE

(Escherichia
coli) 		PF00551
(Formyl_trans_N) 		4 TYR A 100
LEU A  85
LEU A  92
SER A  98
 None
NHR  A 220 ( 4.8A)
NHR  A 220 (-3.9A)
None
 1.03A 3lm8A-1c3eA:
4.9
3lm8C-1c3eA:
5.7		 3lm8A-1c3eA:
24.81
3lm8C-1c3eA:
24.81
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.
1e69 CHROMOSOME
SEGREGATION SMC
PROTEIN

(Thermotoga
maritima) 		PF02463
(SMC_N) 		4 LEU A1089
LEU A1103
SER A1126
ASN A1125
 None
 1.05A 3lm8A-1e69A:
undetectable
3lm8C-1e69A:
undetectable		 3lm8A-1e69A:
23.53
3lm8C-1e69A:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h2b ALCOHOL
DEHYDROGENASE

(Aeropyrum
pernix) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 LEU A 290
LEU A 281
SER A 307
ASP A 260
 None
 0.99A 3lm8A-1h2bA:
2.8
3lm8C-1h2bA:
3.6		 3lm8A-1h2bA:
20.77
3lm8C-1h2bA:
20.77
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.
1hwn EBULIN

(Sambucus ebulus) 		PF00161
(RIP) 		4 LEU A 178
LEU A  10
SER A   7
THR A  66
 None
 0.86A 3lm8A-1hwnA:
undetectable
3lm8C-1hwnA:
undetectable		 3lm8A-1hwnA:
21.58
3lm8C-1hwnA:
21.58
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.
1k2w SORBITOL
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		PF13561
(adh_short_C2) 		4 LEU A   9
LEU A  58
ASN A  85
THR A  61
 None
 0.95A 3lm8A-1k2wA:
3.7
3lm8C-1k2wA:
3.0		 3lm8A-1k2wA:
22.63
3lm8C-1k2wA:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n8y PROTOONCOPROTEIN

(Rattus
norvegicus) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		4 LEU C 424
LEU C 432
ASN C 477
THR C 458
 None
 1.05A 3lm8A-1n8yC:
undetectable
3lm8C-1n8yC:
undetectable		 3lm8A-1n8yC:
15.84
3lm8C-1n8yC:
15.84
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.
1nxo DNA-BINDING RESPONSE
REGULATOR

(Streptococcus
pneumoniae) 		PF00072
(Response_reg) 		4 LEU A 108
LEU A  76
SER A  79
ASP A  97
 None
 0.81A 3lm8A-1nxoA:
2.7
3lm8C-1nxoA:
2.6		 3lm8A-1nxoA:
25.35
3lm8C-1nxoA:
25.35
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.
1osm OMPK36

(Klebsiella
pneumoniae) 		PF00267
(Porin_1) 		4 LEU A 292
LEU A 276
ASN A 256
THR A 229
 None
None
None
D12  A 349 (-3.2A)
 1.05A 3lm8A-1osmA:
undetectable
3lm8C-1osmA:
undetectable		 3lm8A-1osmA:
21.02
3lm8C-1osmA:
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.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		4 LEU A 348
LEU A 341
SER A 243
ASN A 245
 None
 0.79A 3lm8A-1qonA:
undetectable
3lm8C-1qonA:
undetectable		 3lm8A-1qonA:
17.58
3lm8C-1qonA:
17.58
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.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE

(Vibrio sp.
PA-44) 		PF00082
(Peptidase_S8) 		4 SER A 158
ASN A 159
ASP A 161
THR A 165
 None
 0.97A 3lm8A-1s2nA:
2.4
3lm8C-1s2nA:
2.4		 3lm8A-1s2nA:
20.00
3lm8C-1s2nA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sj7 TALIN 1

(Mus musculus) 		PF09141
(Talin_middle) 		4 LEU A 495
SER A 501
ASN A 500
THR A 578
 None
 0.87A 3lm8A-1sj7A:
undetectable
3lm8C-1sj7A:
undetectable		 3lm8A-1sj7A:
17.67
3lm8C-1sj7A:
17.67
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.
1svv THREONINE ALDOLASE

(Leishmania
major) 		PF01212
(Beta_elim_lyase) 		4 TYR A 161
LEU A 198
SER A 152
ASN A 153
 None
 1.00A 3lm8A-1svvA:
undetectable
3lm8C-1svvA:
undetectable		 3lm8A-1svvA:
23.90
3lm8C-1svvA:
23.90
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.
1tjr BX1

(Zea mays) 		PF00290
(Trp_syntA) 		4 TYR A 107
LEU A 125
LEU A 321
SER A 315
 None
None
None
SO4  A 347 (-2.6A)
 0.96A 3lm8A-1tjrA:
undetectable
3lm8C-1tjrA:
undetectable		 3lm8A-1tjrA:
20.22
3lm8C-1tjrA:
20.22
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.
1tuh HYPOTHETICAL PROTEIN
EGC068

(uncultured
bacterium) 		PF12680
(SnoaL_2) 		4 LEU A  90
SER A  37
ASN A  36
THR A  42
 None
 1.04A 3lm8A-1tuhA:
undetectable
3lm8C-1tuhA:
undetectable		 3lm8A-1tuhA:
19.11
3lm8C-1tuhA:
19.11
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.
1ut9 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		4 TYR A 268
SER A 235
ASN A 234
THR A 256
 None
 0.81A 3lm8A-1ut9A:
undetectable
3lm8C-1ut9A:
undetectable		 3lm8A-1ut9A:
17.02
3lm8C-1ut9A:
17.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 LEU A 457
LEU A 488
SER A 490
ASP A 479
 EDO  A9081 (-4.5A)
IOD  A9033 (-4.6A)
None
None
 1.05A 3lm8A-1xc6A:
2.5
3lm8C-1xc6A:
undetectable		 3lm8A-1xc6A:
11.11
3lm8C-1xc6A:
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.
1yq1 GLUTATHIONE
S-TRANSFERASE

(Caenorhabditis
elegans) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 LEU A 166
LEU A 186
SER A 192
ASN A 191
ASP A 159
 None
 1.45A 3lm8A-1yq1A:
undetectable
3lm8C-1yq1A:
undetectable		 3lm8A-1yq1A:
20.69
3lm8C-1yq1A:
20.69
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.
2azk GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Sulfolobus
solfataricus) 		PF00348
(polyprenyl_synt) 		4 LEU A 135
LEU A 186
SER A 172
THR A 181
 None
 0.91A 3lm8A-2azkA:
undetectable
3lm8C-2azkA:
undetectable		 3lm8A-2azkA:
21.52
3lm8C-2azkA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ch1 3-HYDROXYKYNURENINE
TRANSAMINASE

(Anopheles
gambiae) 		PF00266
(Aminotran_5) 		4 LEU A 373
LEU A 294
SER A 364
THR A 316
 None
 0.99A 3lm8A-2ch1A:
2.4
3lm8C-2ch1A:
2.4		 3lm8A-2ch1A:
20.40
3lm8C-2ch1A:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2czq CUTINASE-LIKE
PROTEIN

(Cryptococcus
sp. S-2) 		PF01083
(Cutinase) 		4 LEU A 113
LEU A  95
SER A 151
THR A 100
 None
 1.00A 3lm8A-2czqA:
2.7
3lm8C-2czqA:
undetectable		 3lm8A-2czqA:
21.54
3lm8C-2czqA:
21.54
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.
2dkh 3-HYDROXYBENZOATE
HYDROXYLASE

(Comamonas
testosteroni) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		4 TYR A 392
LEU A 376
SER A 369
ASN A 371
 None
 0.96A 3lm8A-2dkhA:
undetectable
3lm8C-2dkhA:
undetectable		 3lm8A-2dkhA:
16.69
3lm8C-2dkhA:
16.69
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.
2f6h MYOSIN-2

(Saccharomyces
cerevisiae) 		PF01843
(DIL) 		4 LEU X  99
SER X 172
ASN X 174
ASP X 167
 None
 0.95A 3lm8A-2f6hX:
undetectable
3lm8C-2f6hX:
undetectable		 3lm8A-2f6hX:
18.40
3lm8C-2f6hX:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fxv XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Bacillus
subtilis) 		PF00156
(Pribosyltran) 		4 LEU A  92
LEU A 114
SER A 146
THR A  52
 None
 1.00A 3lm8A-2fxvA:
2.8
3lm8C-2fxvA:
2.3		 3lm8A-2fxvA:
24.48
3lm8C-2fxvA:
24.48
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.
2hqr PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Helicobacter
pylori) 		PF00072
(Response_reg)
PF00486
(Trans_reg_C) 		4 LEU A 105
LEU A  72
SER A  75
ASP A  93
 None
 1.04A 3lm8A-2hqrA:
undetectable
3lm8C-2hqrA:
2.3		 3lm8A-2hqrA:
21.95
3lm8C-2hqrA:
21.95
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.
2ljv DISINTEGRIN
RHODOSTOMIN

(Calloselasma
rhodostoma) 		PF00200
(Disintegrin) 		4 LEU A  21
ASN A  11
ASP A   5
THR A  18
 None
 1.03A 3lm8A-2ljvA:
undetectable
3lm8C-2ljvA:
undetectable		 3lm8A-2ljvA:
12.61
3lm8C-2ljvA:
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.
2lqj MG2+ TRANSPORT
PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 4 LEU A 207
LEU A 197
SER A 172
ASN A 174
 None
 1.03A 3lm8A-2lqjA:
undetectable
3lm8C-2lqjA:
undetectable		 3lm8A-2lqjA:
14.29
3lm8C-2lqjA:
14.29
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.
2msv MIXED LINEAGE KINASE
DOMAIN-LIKE PROTEIN

(Homo sapiens) 		no annotation 4 TYR A  23
LEU A  97
LEU A  89
SER A  83
 None
 1.01A 3lm8A-2msvA:
undetectable
3lm8C-2msvA:
undetectable		 3lm8A-2msvA:
20.18
3lm8C-2msvA:
20.18
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.
2o2g DIENELACTONE
HYDROLASE

(Trichormus
variabilis) 		PF01738
(DLH) 		4 LEU A  93
LEU A  72
SER A  46
ASP A  80
 None
 0.76A 3lm8A-2o2gA:
2.5
3lm8C-2o2gA:
undetectable		 3lm8A-2o2gA:
20.60
3lm8C-2o2gA:
20.60
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.
2o3b NUCLEASE

(Nostoc sp. PCC
7120) 		PF01223
(Endonuclease_NS) 		4 LEU A 103
SER A  72
ASN A  71
THR A 195
 None
 1.03A 3lm8A-2o3bA:
undetectable
3lm8C-2o3bA:
undetectable		 3lm8A-2o3bA:
21.59
3lm8C-2o3bA:
21.59
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.
2p1n TRANSPORT INHIBITOR
RESPONSE 1 PROTEIN

(Arabidopsis
thaliana) 		PF12937
(F-box-like) 		4 LEU B 203
LEU B 189
SER B 192
ASN B 219
 None
 0.96A 3lm8A-2p1nB:
undetectable
3lm8C-2p1nB:
undetectable		 3lm8A-2p1nB:
14.81
3lm8C-2p1nB:
14.81
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.
2px9 SUMO-ACTIVATING
ENZYME SUBUNIT 2

(Homo sapiens) 		PF10585
(UBA_e1_thiolCys) 		4 LEU A 313
LEU A 321
ASN A 360
ASP A 353
 None
 0.92A 3lm8A-2px9A:
undetectable
3lm8C-2px9A:
undetectable		 3lm8A-2px9A:
21.54
3lm8C-2px9A:
21.54
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.
2qlp DEOXYCYTIDINE
TRIPHOSPHATE
DEAMINASE

(Mycobacterium
tuberculosis) 		PF00692
(dUTPase) 		4 LEU A  36
LEU A 128
SER A 131
THR A 114
 None
 1.05A 3lm8A-2qlpA:
undetectable
3lm8C-2qlpA:
undetectable		 3lm8A-2qlpA:
23.21
3lm8C-2qlpA:
23.21
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.
2vhl N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Bacillus
subtilis) 		PF01979
(Amidohydro_1) 		4 LEU A 276
LEU A 278
SER A 344
ASN A 346
 None
 0.95A 3lm8A-2vhlA:
undetectable
3lm8C-2vhlA:
undetectable		 3lm8A-2vhlA:
20.25
3lm8C-2vhlA:
20.25
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.
2w6d DYNAMIN FAMILY
PROTEIN

(Nostoc
punctiforme) 		PF00350
(Dynamin_N) 		4 LEU A 231
SER A  62
ASN A  64
ASP A  57
 None
 1.04A 3lm8A-2w6dA:
undetectable
3lm8C-2w6dA:
undetectable		 3lm8A-2w6dA:
15.88
3lm8C-2w6dA:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w6d DYNAMIN FAMILY
PROTEIN

(Nostoc
punctiforme) 		PF00350
(Dynamin_N) 		4 LEU A 338
SER A  62
ASN A  64
ASP A  57
 None
 0.81A 3lm8A-2w6dA:
undetectable
3lm8C-2w6dA:
undetectable		 3lm8A-2w6dA:
15.88
3lm8C-2w6dA:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z2b DIHYDROOROTASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		4 LEU A 116
LEU A  80
SER A  83
THR A  50
 None
KCX  A 102 ( 3.8A)
None
None
 0.83A 3lm8A-2z2bA:
undetectable
3lm8C-2z2bA:
undetectable		 3lm8A-2z2bA:
23.58
3lm8C-2z2bA:
23.58
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.
3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE

(Neospora
caninum) 		PF01150
(GDA1_CD39) 		4 LEU A 271
LEU A 265
SER A 297
ASP A 294
 None
 1.00A 3lm8A-3agrA:
undetectable
3lm8C-3agrA:
undetectable		 3lm8A-3agrA:
16.89
3lm8C-3agrA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bz5 INTERNALIN-J

(Listeria
monocytogenes) 		PF12799
(LRR_4) 		4 LEU A 120
LEU A 130
SER A 133
ASN A 135
 None
 1.05A 3lm8A-3bz5A:
undetectable
3lm8C-3bz5A:
undetectable		 3lm8A-3bz5A:
16.70
3lm8C-3bz5A:
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.
3bz5 INTERNALIN-J

(Listeria
monocytogenes) 		PF12799
(LRR_4) 		4 LEU A 226
LEU A 236
SER A 239
ASN A 241
 None
 0.98A 3lm8A-3bz5A:
undetectable
3lm8C-3bz5A:
undetectable		 3lm8A-3bz5A:
16.70
3lm8C-3bz5A:
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.
3bz5 INTERNALIN-J

(Listeria
monocytogenes) 		PF12799
(LRR_4) 		4 LEU A 353
LEU A 363
SER A 366
ASN A 368
 None
 0.96A 3lm8A-3bz5A:
undetectable
3lm8C-3bz5A:
undetectable		 3lm8A-3bz5A:
16.70
3lm8C-3bz5A:
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.
3c8j NATURAL KILLER CELL
RECEPTOR LY49C

(Mus musculus) 		PF00059
(Lectin_C)
PF08391
(Ly49) 		4 TYR A 195
LEU A 175
LEU A 186
SER A 236
 None
 1.05A 3lm8A-3c8jA:
undetectable
3lm8C-3c8jA:
undetectable		 3lm8A-3c8jA:
18.80
3lm8C-3c8jA:
18.80
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.
3cnc FIBER PROTEIN

(Human
mastadenovirus
B) 		PF00541
(Adeno_knob) 		4 LEU A 186
LEU A 225
SER A 323
THR A 306
 None
 1.05A 3lm8A-3cncA:
undetectable
3lm8C-3cncA:
undetectable		 3lm8A-3cncA:
20.82
3lm8C-3cncA:
20.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cq9 UNCHARACTERIZED
PROTEIN LP_1622

(Lactobacillus
plantarum) 		PF04263
(TPK_catalytic) 		4 TYR A 174
LEU A 169
SER A 189
ASN A 190
 None
 1.03A 3lm8A-3cq9A:
23.8
3lm8C-3cq9A:
23.3		 3lm8A-3cq9A:
41.35
3lm8C-3cq9A:
41.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cq9 UNCHARACTERIZED
PROTEIN LP_1622

(Lactobacillus
plantarum) 		PF04263
(TPK_catalytic) 		4 TYR A 174
LEU A 176
SER A 189
ASN A 190
 None
 0.40A 3lm8A-3cq9A:
23.8
3lm8C-3cq9A:
23.3		 3lm8A-3cq9A:
41.35
3lm8C-3cq9A:
41.35
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.
3eqq BENZENE
1,2-DIOXYGENASE
SUBUNIT ALPHA

(Pseudomonas
putida) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 TYR A  36
LEU A  41
LEU A  23
ASP A  32
 None
 0.97A 3lm8A-3eqqA:
undetectable
3lm8C-3eqqA:
undetectable		 3lm8A-3eqqA:
20.75
3lm8C-3eqqA:
20.75
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.
3fiw PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N)
PF02909
(TetR_C) 		4 TYR A  44
LEU A  51
LEU A  30
SER A  40
 None
 0.92A 3lm8A-3fiwA:
undetectable
3lm8C-3fiwA:
undetectable		 3lm8A-3fiwA:
21.67
3lm8C-3fiwA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fsn RETINAL PIGMENT
EPITHELIUM-SPECIFIC
65 KDA PROTEIN

(Bos taurus) 		PF03055
(RPE65) 		4 TYR A 137
LEU A 529
ASN A 135
THR A 153
 None
 0.90A 3lm8A-3fsnA:
undetectable
3lm8C-3fsnA:
undetectable		 3lm8A-3fsnA:
17.42
3lm8C-3fsnA:
17.42
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.
3g8k LECTIN-RELATED NK
CELL RECEPTOR LY49L1

(Mus musculus) 		PF00059
(Lectin_C) 		4 TYR A 198
LEU A 178
LEU A 189
SER A 239
 None
 0.94A 3lm8A-3g8kA:
undetectable
3lm8C-3g8kA:
undetectable		 3lm8A-3g8kA:
19.72
3lm8C-3g8kA:
19.72
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.
3g8l LECTIN-RELATED NK
CELL RECEPTOR LY49L1

(Mus musculus) 		PF00059
(Lectin_C)
PF08391
(Ly49) 		4 TYR A 198
LEU A 178
LEU A 189
SER A 239
 None
 0.82A 3lm8A-3g8lA:
undetectable
3lm8C-3g8lA:
undetectable		 3lm8A-3g8lA:
22.13
3lm8C-3g8lA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hzt CALCIUM-DEPENDENT
PROTEIN KINASE 3

(Toxoplasma
gondii) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 TYR A 149
LEU A 151
LEU A 223
THR A 115
 None
GOL  A   1 (-3.4A)
GOL  A   1 (-4.6A)
None
 0.80A 3lm8A-3hztA:
undetectable
3lm8C-3hztA:
undetectable		 3lm8A-3hztA:
18.11
3lm8C-3hztA:
18.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ihk THIAMIN
PYROPHOSPHOKINASE

(Streptococcus
mutans) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 TYR A 169
LEU A 171
SER A 184
ASN A 185
 None
 0.79A 3lm8A-3ihkA:
11.4
3lm8C-3ihkA:
21.2		 3lm8A-3ihkA:
34.35
3lm8C-3ihkA:
34.35
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.
3ip1 ALCOHOL
DEHYDROGENASE,
ZINC-CONTAINING

(Thermotoga
maritima) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 LEU A 231
LEU A 285
SER A 242
THR A 288
 None
 0.96A 3lm8A-3ip1A:
4.3
3lm8C-3ip1A:
3.8		 3lm8A-3ip1A:
20.82
3lm8C-3ip1A:
20.82
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.
3jze DIHYDROOROTASE

(Salmonella
enterica) 		PF01979
(Amidohydro_1) 		4 LEU A 127
LEU A  81
SER A  84
THR A  51
 None
KCX  A 103 ( 3.7A)
None
None
 0.92A 3lm8A-3jzeA:
undetectable
3lm8C-3jzeA:
undetectable		 3lm8A-3jzeA:
21.45
3lm8C-3jzeA:
21.45
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.
3ksy SON OF SEVENLESS
HOMOLOG 1

(Homo sapiens) 		PF00125
(Histone)
PF00169
(PH)
PF00617
(RasGEF)
PF00618
(RasGEF_N)
PF00621
(RhoGEF) 		4 LEU A1009
LEU A 833
SER A 876
THR A 828
 None
 0.99A 3lm8A-3ksyA:
undetectable
3lm8C-3ksyA:
undetectable		 3lm8A-3ksyA:
11.73
3lm8C-3ksyA:
11.73
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.
3lk6 LIPOPROTEIN YBBD

(Bacillus
subtilis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		4 LEU A 132
LEU A 164
SER A 158
ASP A 172
 None
 1.01A 3lm8A-3lk6A:
2.1
3lm8C-3lk6A:
undetectable		 3lm8A-3lk6A:
15.88
3lm8C-3lk6A:
15.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mel THIAMIN
PYROPHOSPHOKINASE
FAMILY PROTEIN

(Enterococcus
faecalis) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 TYR A 174
LEU A 176
SER A 189
ASN A 190
 None
 0.54A 3lm8A-3melA:
24.7
3lm8C-3melA:
24.2		 3lm8A-3melA:
38.16
3lm8C-3melA:
38.16
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.
3od1 ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT

(Bacillus
halodurans) 		PF13393
(tRNA-synt_His) 		4 TYR A 110
LEU A  68
LEU A  48
THR A  45
 None
 1.01A 3lm8A-3od1A:
undetectable
3lm8C-3od1A:
undetectable		 3lm8A-3od1A:
20.65
3lm8C-3od1A:
20.65
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.
3swe UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Haemophilus
influenzae) 		PF00275
(EPSP_synthase) 		4 TYR A 401
LEU A 408
LEU A 380
SER A 375
 None
 1.04A 3lm8A-3sweA:
undetectable
3lm8C-3sweA:
undetectable		 3lm8A-3sweA:
20.61
3lm8C-3sweA:
20.61
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.
3win HA3

(Clostridium
botulinum) 		PF03505
(Clenterotox) 		4 TYR E 558
LEU E 620
SER E 595
THR E 625
 None
 0.98A 3lm8A-3winE:
3.0
3lm8C-3winE:
undetectable		 3lm8A-3winE:
19.87
3lm8C-3winE:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wpe TOLL-LIKE RECEPTOR 9

(Bos taurus) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		4 LEU A 690
LEU A 730
SER A 708
ASN A 709
 None
 0.86A 3lm8A-3wpeA:
undetectable
3lm8C-3wpeA:
undetectable		 3lm8A-3wpeA:
13.78
3lm8C-3wpeA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wxb UNCHARACTERIZED
PROTEIN

(Gallus gallus) 		PF00106
(adh_short) 		4 LEU A  10
LEU A  66
ASN A  95
THR A  69
 None
None
None
NDP  A 300 ( 4.0A)
 0.93A 3lm8A-3wxbA:
undetectable
3lm8C-3wxbA:
2.1		 3lm8A-3wxbA:
21.00
3lm8C-3wxbA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aq2 HOMOGENTISATE
1,2-DIOXYGENASE

(Pseudomonas
putida) 		PF04209
(HgmA) 		4 LEU A 166
LEU A  64
SER A  48
ASN A 268
 None
 0.96A 3lm8A-4aq2A:
undetectable
3lm8C-4aq2A:
undetectable		 3lm8A-4aq2A:
16.17
3lm8C-4aq2A:
16.17
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.
4ccz METHIONINE SYNTHASE

(Homo sapiens) 		PF00809
(Pterin_bind)
PF02574
(S-methyl_trans) 		4 LEU A 192
LEU A  33
ASN A 259
ASP A  34
 None
 0.83A 3lm8A-4cczA:
undetectable
3lm8C-4cczA:
undetectable		 3lm8A-4cczA:
17.67
3lm8C-4cczA:
17.67
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.
4gq2 NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		4 LEU M 819
LEU M 742
SER M 738
ASN M 737
 None
 1.04A 3lm8A-4gq2M:
undetectable
3lm8C-4gq2M:
undetectable		 3lm8A-4gq2M:
13.24
3lm8C-4gq2M:
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.
4h79 CRISPR-ASSOCIATED
PROTEIN, CSE2 FAMILY

(Thermobifida
fusca) 		PF09485
(CRISPR_Cse2) 		4 TYR A 165
LEU A 172
LEU A 149
THR A 154
 None
 1.00A 3lm8A-4h79A:
undetectable
3lm8C-4h79A:
undetectable		 3lm8A-4h79A:
17.75
3lm8C-4h79A:
17.75
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.
4p8s RETICULON-4
RECEPTOR-LIKE 2

(Rattus
norvegicus) 		PF13855
(LRR_8) 		4 LEU A  75
LEU A 113
SER A  91
ASN A  92
 None
 0.96A 3lm8A-4p8sA:
undetectable
3lm8C-4p8sA:
undetectable		 3lm8A-4p8sA:
20.42
3lm8C-4p8sA:
20.42
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.
4qaw XYN30D

(Paenibacillus
barcinonensis) 		PF03422
(CBM_6)
PF17189
(Glyco_hydro_30C) 		4 TYR A 473
LEU A 510
SER A 481
THR A 515
 None
 1.05A 3lm8A-4qawA:
3.8
3lm8C-4qawA:
4.3		 3lm8A-4qawA:
18.09
3lm8C-4qawA:
18.09
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.
4ruw ENDONUCLEASE/EXONUCL
EASE/PHOSPHATASE

(Beutenbergia
cavernae) 		PF03372
(Exo_endo_phos) 		4 LEU A 435
LEU A 350
SER A 353
THR A 405
 None
 1.00A 3lm8A-4ruwA:
undetectable
3lm8C-4ruwA:
undetectable		 3lm8A-4ruwA:
16.52
3lm8C-4ruwA:
16.52
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.
4tx1 ESTERASE

(Sinorhizobium
meliloti) 		PF13472
(Lipase_GDSL_2) 		4 TYR A  15
LEU A  11
ASN A  49
ASP A 187
 None
 0.82A 3lm8A-4tx1A:
undetectable
3lm8C-4tx1A:
2.4		 3lm8A-4tx1A:
21.16
3lm8C-4tx1A:
21.16
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.
4xhc ALPHA-L-RHAMNOSIDASE

(Klebsiella
oxytoca) 		PF17389
(Bac_rhamnosid6H) 		4 LEU A  50
SER A 505
ASP A 482
THR A 206
 None
 0.93A 3lm8A-4xhcA:
undetectable
3lm8C-4xhcA:
undetectable		 3lm8A-4xhcA:
14.44
3lm8C-4xhcA:
14.44
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.
4xmm NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		no annotation 4 LEU E 664
LEU E 679
SER E 704
ASN E 706
 None
 1.03A 3lm8A-4xmmE:
undetectable
3lm8C-4xmmE:
undetectable		 3lm8A-4xmmE:
11.96
3lm8C-4xmmE:
11.96
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.
4z61 PHYTOSULFOKINE
RECEPTOR 1

(Daucus carota) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 LEU A 445
LEU A 430
SER A 457
THR A 408
 None
 1.04A 3lm8A-4z61A:
undetectable
3lm8C-4z61A:
undetectable		 3lm8A-4z61A:
14.33
3lm8C-4z61A:
14.33
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.
4zbt ACETOACETATE
DECARBOXYLASE

(Streptomyces
bingchenggensis) 		PF06314
(ADC) 		4 TYR A  24
LEU A 250
LEU A 209
THR A 255
 PYR  A 301 ( 4.2A)
None
None
None
 0.87A 3lm8A-4zbtA:
undetectable
3lm8C-4zbtA:
undetectable		 3lm8A-4zbtA:
21.40
3lm8C-4zbtA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a9t PUTATIVE
DEHYDROGENASE

(Amycolatopsis
orientalis) 		PF03446
(NAD_binding_2) 		4 TYR A  76
LEU A  79
LEU A  69
ASP A  73
 None
 1.03A 3lm8A-5a9tA:
2.6
3lm8C-5a9tA:
2.3		 3lm8A-5a9tA:
21.36
3lm8C-5a9tA:
21.36
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.
5ce5 TRIACYLGLYCEROL
LIPASE

(Geobacillus
thermocatenulatus) 		no annotation 4 TYR A 377
LEU A 378
LEU A  42
THR A  51
 None
 1.05A 3lm8A-5ce5A:
undetectable
3lm8C-5ce5A:
undetectable		 3lm8A-5ce5A:
20.97
3lm8C-5ce5A:
20.97
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.
5end 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE FABG

(Vibrio cholerae) 		PF13561
(adh_short_C2) 		4 LEU A  13
LEU A  62
ASN A  89
THR A  65
 None
 0.96A 3lm8A-5endA:
2.8
3lm8C-5endA:
2.5		 3lm8A-5endA:
22.01
3lm8C-5endA:
22.01
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.
5fk0 COATOMER SUBUNIT
DELTA

(Saccharomyces
cerevisiae) 		PF00928
(Adap_comp_sub) 		4 LEU A 318
LEU A 334
SER A 365
THR A 361
 None
 0.97A 3lm8A-5fk0A:
undetectable
3lm8C-5fk0A:
undetectable		 3lm8A-5fk0A:
19.86
3lm8C-5fk0A:
19.86
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.
5gr8 LEUCINE-RICH REPEAT
RECEPTOR-LIKE
PROTEIN KINASE PEPR1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		4 LEU A 119
LEU A 104
SER A 131
THR A  83
 None
None
None
NAG  A 806 ( 4.6A)
 0.90A 3lm8A-5gr8A:
undetectable
3lm8C-5gr8A:
undetectable		 3lm8A-5gr8A:
15.89
3lm8C-5gr8A:
15.89
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.
5h2v IMPORTIN SUBUNIT
BETA-3

(Saccharomyces
cerevisiae) 		PF13513
(HEAT_EZ) 		4 LEU A 996
LEU A1012
SER A1006
THR A1052
 None
 0.98A 3lm8A-5h2vA:
undetectable
3lm8C-5h2vA:
undetectable		 3lm8A-5h2vA:
12.63
3lm8C-5h2vA:
12.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h5x PUTATIVE
OXIDOREDUCTASE

(Streptomyces
coelicolor) 		PF13561
(adh_short_C2) 		4 LEU A  23
LEU A  75
ASN A 102
THR A  78
 None
NAI  A 301 (-4.7A)
None
NAI  A 301 ( 4.4A)
 1.00A 3lm8A-5h5xA:
3.0
3lm8C-5h5xA:
2.8		 3lm8A-5h5xA:
23.61
3lm8C-5h5xA:
23.61
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.
5hz1 PROBABLE LRR
RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE
AT4G26540

(Arabidopsis
thaliana) 		PF13855
(LRR_8) 		4 LEU B  88
LEU B 129
SER B 102
THR B 150
 None
 0.93A 3lm8A-5hz1B:
undetectable
3lm8C-5hz1B:
undetectable		 3lm8A-5hz1B:
16.01
3lm8C-5hz1B:
16.01
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.
5ifk PURINE NUCLEOSIDE
PHOSPHORYLASE

(Kluyveromyces
lactis) 		PF01048
(PNP_UDP_1) 		4 LEU A 298
LEU A 142
SER A  42
THR A 255
 None
None
None
HPA  A 401 (-4.0A)
 0.92A 3lm8A-5ifkA:
undetectable
3lm8C-5ifkA:
undetectable		 3lm8A-5ifkA:
19.56
3lm8C-5ifkA:
19.56
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.
5j68 ASTROTACTIN-2

(Homo sapiens) 		PF01823
(MACPF) 		4 LEU A1078
LEU A1263
ASP A1049
THR A1123
 None
 0.80A 3lm8A-5j68A:
undetectable
3lm8C-5j68A:
undetectable		 3lm8A-5j68A:
16.06
3lm8C-5j68A:
16.06
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.
5jne E3 SUMO-PROTEIN
LIGASE
SIZ1,UBIQUITIN-LIKE
PROTEIN SMT3

(Saccharomyces
cerevisiae) 		PF02891
(zf-MIZ)
PF11976
(Rad60-SLD)
PF14324
(PINIT) 		4 LEU A 478
LEU A 459
SER A 462
ASP A 520
 None
 1.02A 3lm8A-5jneA:
3.3
3lm8C-5jneA:
3.2		 3lm8A-5jneA:
22.22
3lm8C-5jneA:
22.22
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.
5lcx (-)-ISOPIPERITENONE
REDUCTASE

(Mentha x
piperita) 		PF00106
(adh_short) 		4 LEU A   9
LEU A  65
ASN A  92
THR A  68
 None
None
None
NAP  A 400 (-2.9A)
 0.90A 3lm8A-5lcxA:
2.6
3lm8C-5lcxA:
2.6		 3lm8A-5lcxA:
20.55
3lm8C-5lcxA:
20.55
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.
5opt ACTIVATED PROTEIN
KINASE C RECEPTOR,
PUTATIVE

(Trypanosoma
cruzi) 		no annotation 4 LEU p 265
LEU p 210
SER p 213
ASP p 224
 None
 1.05A 3lm8A-5optp:
undetectable
3lm8C-5optp:
undetectable		 3lm8A-5optp:
22.16
3lm8C-5optp:
22.16
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.
5u2g PENICILLIN-BINDING
PROTEIN 1A

(Haemophilus
influenzae) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB) 		4 LEU A 549
SER A 493
ASN A 492
THR A 731
 None
None
None
CL  A 910 (-4.2A)
 1.04A 3lm8A-5u2gA:
undetectable
3lm8C-5u2gA:
undetectable		 3lm8A-5u2gA:
13.84
3lm8C-5u2gA:
13.84
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		4 LEU A  18
LEU A 361
SER A 354
ASP A 333
 None
 0.99A 3lm8A-5ux5A:
2.7
3lm8C-5ux5A:
2.6		 3lm8A-5ux5A:
12.30
3lm8C-5ux5A:
12.30
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.
5w6l RTX
REPEAT-CONTAINING
CYTOTOXIN

(Vibrio
vulnificus) 		no annotation 4 LEU A3825
LEU A3837
SER A3832
ASP A3838
 LEU  A3825 ( 0.6A)
LEU  A3837 ( 0.5A)
SER  A3832 ( 0.0A)
ASP  A3838 ( 0.6A)
 1.02A 3lm8A-5w6lA:
undetectable
3lm8C-5w6lA:
undetectable		 3lm8A-5w6lA:
21.31
3lm8C-5w6lA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wtf VP1

(Hepatovirus A) 		PF12944
(HAV_VP) 		4 LEU A 123
LEU A  95
SER A 250
THR A 144
 None
 0.98A 3lm8A-5wtfA:
3.7
3lm8C-5wtfA:
3.5		 3lm8A-5wtfA:
20.48
3lm8C-5wtfA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wth POLYPROTEIN

(Hepatovirus A) 		PF12944
(HAV_VP) 		4 LEU A 123
LEU A  95
SER A 250
THR A 144
 None
 1.05A 3lm8A-5wthA:
2.5
3lm8C-5wthA:
2.4		 3lm8A-5wthA:
21.89
3lm8C-5wthA:
21.89
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.
5wve APOPTOTIC
PROTEASE-ACTIVATING
FACTOR 1

(Homo sapiens) 		PF00400
(WD40)
PF00931
(NB-ARC) 		4 TYR A 435
LEU A 389
LEU A 400
THR A 408
 None
 1.01A 3lm8A-5wveA:
undetectable
3lm8C-5wveA:
undetectable		 3lm8A-5wveA:
10.18
3lm8C-5wveA:
10.18
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.
5x06 DNAA REGULATORY
INACTIVATOR HDA

(Escherichia
coli) 		no annotation 4 LEU E  48
LEU E  34
SER E  28
ASN E  27
 None
 1.05A 3lm8A-5x06E:
undetectable
3lm8C-5x06E:
undetectable		 3lm8A-5x06E:
15.35
3lm8C-5x06E:
15.35
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.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus) 		no annotation 4 LEU A 693
LEU A 733
SER A 711
ASN A 712
 None
None
NAG  A 914 ( 4.1A)
None
 0.94A 3lm8A-5zlnA:
undetectable
3lm8C-5zlnA:
undetectable		 3lm8A-5zlnA:
17.05
3lm8C-5zlnA:
17.05
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.
6b7k ENDO-ALPHA-(1->5)-L-
ARABINANASE

(Bacillus
licheniformis) 		no annotation 4 TYR A  82
LEU A  84
SER A 107
THR A  22
 None
 0.80A 3lm8A-6b7kA:
undetectable
3lm8C-6b7kA:
undetectable		 3lm8A-6b7kA:
14.86
3lm8C-6b7kA:
14.86
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.
6epi ZETA_1 TOXIN

(Neisseria
gonorrhoeae) 		no annotation 4 LEU B 234
SER B 221
ASN B 216
THR B 118
 None
 0.97A 3lm8A-6epiB:
undetectable
3lm8C-6epiB:
4.4		 3lm8A-6epiB:
18.22
3lm8C-6epiB:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fml INO80
RUVB-LIKE HELICASE

(Chaetomium
thermophilum) 		no annotation 5 LEU G1458
LEU D 259
SER D 251
ASN D 250
THR D 264
 None
 1.43A 3lm8A-6fmlG:
undetectable
3lm8C-6fmlG:
undetectable		 3lm8A-6fmlG:
14.86
3lm8C-6fmlG:
14.86