SIMILAR PATTERNS OF AMINO ACIDS FOR 5LJC_A_RTLA201

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.
1c2r CYTOCHROME C2

(Rhodobacter
capsulatus) 		no annotation 5 TYR A  75
LEU A  87
ALA A  92
TYR A  53
ILE A  57
 HEM  A 120 (-4.6A)
None
None
HEM  A 120 (-4.7A)
HEM  A 120 (-4.2A)
 1.23A 5ljcA-1c2rA:
undetectable		 5ljcA-1c2rA:
21.83
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.
1cvr GINGIPAIN R

(Porphyromonas
gingivalis) 		PF01364
(Peptidase_C25)
PF03785
(Peptidase_C25_C) 		5 ALA A 145
LEU A 205
TYR A 208
ILE A 148
LEU A 260
 None
 1.00A 5ljcA-1cvrA:
undetectable		 5ljcA-1cvrA:
14.84
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.
1czi CHYMOSIN

(Bos taurus) 		PF00026
(Asp) 		5 PHE E  27
LEU E 103
SER E  61
PHE E  64
ILE E  43
 None
 1.26A 5ljcA-1cziE:
undetectable		 5ljcA-1cziE:
15.48
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.
1d6m DNA TOPOISOMERASE
III

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		5 ALA A 301
LEU A 307
PHE A 305
TYR A 403
ILE A 406
 None
 1.29A 5ljcA-1d6mA:
undetectable		 5ljcA-1d6mA:
12.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ggl PROTEIN (CELLULAR
RETINOL-BINDING
PROTEIN III)

(Homo sapiens) 		PF00061
(Lipocalin) 		8 TYR A  19
ALA A  33
LEU A  36
PRO A  38
SER A  55
PHE A  57
TYR A  60
LEU A 117
 None
 0.74A 5ljcA-1gglA:
23.2		 5ljcA-1gglA:
54.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ggl PROTEIN (CELLULAR
RETINOL-BINDING
PROTEIN III)

(Homo sapiens) 		PF00061
(Lipocalin) 		8 TYR A  19
ALA A  33
LEU A  36
SER A  55
PHE A  57
ARG A  58
TYR A  60
LEU A 117
 None
 0.82A 5ljcA-1gglA:
23.2		 5ljcA-1gglA:
54.81
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.
1gzv GLUCOSE-6-PHOSPHATE
ISOMERASE

(Sus scrofa) 		PF00342
(PGI) 		5 TYR A 493
LEU A  43
ALA A 315
LEU A 318
ILE A 476
 None
 1.19A 5ljcA-1gzvA:
undetectable		 5ljcA-1gzvA:
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.
1h3j PEROXIDASE

(Coprinopsis
cinerea) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		5 PRO A  45
SER A  44
ARG A  51
ILE A  52
LEU A  32
 None
HEM  A1344 ( 4.5A)
HEM  A1344 (-4.4A)
None
None
 1.17A 5ljcA-1h3jA:
undetectable		 5ljcA-1h3jA:
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.
1inl SPERMIDINE SYNTHASE

(Thermotoga
maritima) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 PHE A 141
ALA A 130
LEU A 134
PHE A  60
LEU A 109
 None
 1.11A 5ljcA-1inlA:
undetectable		 5ljcA-1inlA:
17.79
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.
1k6d ACETATE
COA-TRANSFERASE
ALPHA SUBUNIT

(Escherichia
coli) 		PF01144
(CoA_trans) 		5 PHE A  15
LEU A   8
ALA A  11
ARG A  34
LEU A  49
 None
 1.25A 5ljcA-1k6dA:
undetectable		 5ljcA-1k6dA:
19.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lpj RETINOL-BINDING
PROTEIN IV, CELLULAR

(Homo sapiens) 		PF00061
(Lipocalin) 		8 PHE A  16
TYR A  19
ALA A  33
LEU A  36
PRO A  38
SER A  55
ARG A  58
LEU A 117
 None
 0.78A 5ljcA-1lpjA:
24.4		 5ljcA-1lpjA:
56.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mx8 CELLULAR
RETINOL-BINDING
PROTEIN I, HOLO

(Rattus
norvegicus) 		PF00061
(Lipocalin) 		5 PHE A  16
TYR A  19
ALA A  33
SER A  55
PHE A  57
 RTL  A 135 ( 4.6A)
None
RTL  A 135 ( 3.9A)
RTL  A 135 ( 4.4A)
None
 1.21A 5ljcA-1mx8A:
19.7		 5ljcA-1mx8A:
95.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mx8 CELLULAR
RETINOL-BINDING
PROTEIN I, HOLO

(Rattus
norvegicus) 		PF00061
(Lipocalin) 		9 PHE A  16
TYR A  19
LEU A  29
ALA A  33
LEU A  36
PRO A  38
ARG A  58
TYR A  60
ILE A  77
 RTL  A 135 ( 4.6A)
None
RTL  A 135 (-3.8A)
RTL  A 135 ( 3.9A)
RTL  A 135 ( 4.6A)
RTL  A 135 ( 4.4A)
None
RTL  A 135 ( 4.6A)
RTL  A 135 (-3.5A)
 0.89A 5ljcA-1mx8A:
19.7		 5ljcA-1mx8A:
95.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mx8 CELLULAR
RETINOL-BINDING
PROTEIN I, HOLO

(Rattus
norvegicus) 		PF00061
(Lipocalin) 		8 PHE A  16
TYR A  19
LEU A  29
ALA A  33
LEU A  36
SER A  55
TYR A  60
ILE A  77
 RTL  A 135 ( 4.6A)
None
RTL  A 135 (-3.8A)
RTL  A 135 ( 3.9A)
RTL  A 135 ( 4.6A)
RTL  A 135 ( 4.4A)
RTL  A 135 ( 4.6A)
RTL  A 135 (-3.5A)
 0.94A 5ljcA-1mx8A:
19.7		 5ljcA-1mx8A:
95.52
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.
1o4s ASPARTATE
AMINOTRANSFERASE

(Thermotoga
maritima) 		PF00155
(Aminotran_1_2) 		5 PHE A 106
TYR A 126
LEU A 246
ALA A 105
LEU A 109
 None
 1.16A 5ljcA-1o4sA:
undetectable		 5ljcA-1o4sA:
17.81
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.
1or8 PROTEIN ARGININE
N-METHYLTRANSFERASE
1

(Rattus
norvegicus) 		PF13649
(Methyltransf_25) 		5 LEU A 156
SER A 154
PHE A 151
ILE A 272
LEU A  84
 None
None
None
None
SAH  A 354 (-4.2A)
 1.25A 5ljcA-1or8A:
2.1		 5ljcA-1or8A:
16.81
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.
1oxj RNA-BINDING PROTEIN
SMAUG

(Drosophila
melanogaster) 		PF00536
(SAM_1)
PF09246
(PHAT) 		5 TYR A 622
LEU A 692
ALA A 745
SER A 740
ILE A 702
 None
 1.27A 5ljcA-1oxjA:
undetectable		 5ljcA-1oxjA:
24.16
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.
1p6f NATURAL CYTOTOXICITY
TRIGGERING RECEPTOR
1

(Homo sapiens) 		no annotation 5 SER A  89
PHE A   9
TYR A  75
ILE A  26
LEU A  45
 None
 1.29A 5ljcA-1p6fA:
undetectable		 5ljcA-1p6fA:
16.25
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.
1q5d P450 EPOXIDASE

(Sorangium
cellulosum) 		PF00067
(p450) 		5 TYR A 149
LEU A 291
ALA A 266
LEU A 270
LEU A 413
 None
 1.19A 5ljcA-1q5dA:
undetectable		 5ljcA-1q5dA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yga HYPOTHETICAL 37.9
KDA PROTEIN IN
BIO3-HXT17
INTERGENIC REGION

(Saccharomyces
cerevisiae) 		PF01263
(Aldose_epim) 		5 LEU A 163
ALA A 168
LEU A  77
ARG A  65
ILE A 171
 None
 1.19A 5ljcA-1ygaA:
undetectable		 5ljcA-1ygaA:
16.96
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.
2ap1 PUTATIVE REGULATOR
PROTEIN

(Salmonella
enterica) 		PF00480
(ROK) 		5 LEU A 232
ALA A 164
LEU A 165
PHE A 172
ILE A 185
 None
 1.00A 5ljcA-2ap1A:
undetectable		 5ljcA-2ap1A:
17.80
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		5 PHE A 263
LEU A 177
ALA A 267
TYR A 191
ILE A 189
 None
 1.24A 5ljcA-2c4mA:
undetectable		 5ljcA-2c4mA:
10.04
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.
2cxn GLUCOSE-6-PHOSPHATE
ISOMERASE

(Mus musculus) 		PF00342
(PGI) 		5 TYR A 494
LEU A  44
ALA A 316
LEU A 319
ILE A 477
 None
 1.29A 5ljcA-2cxnA:
undetectable		 5ljcA-2cxnA:
13.95
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.
2mh9 BLOOM SYNDROME
PROTEIN

(Homo sapiens) 		PF09382
(RQC) 		5 PHE A  80
LEU A  53
ALA A  76
ILE A  64
LEU A 107
 None
 1.16A 5ljcA-2mh9A:
undetectable		 5ljcA-2mh9A:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2po4 VIRION RNA
POLYMERASE

(Escherichia
virus N4) 		no annotation 5 ALA A 568
LEU A 571
PRO A 979
ILE A 920
LEU A1036
 None
 1.11A 5ljcA-2po4A:
undetectable		 5ljcA-2po4A:
7.61
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.
2pth PEPTIDYL-TRNA
HYDROLASE

(Escherichia
coli) 		PF01195
(Pept_tRNA_hydro) 		5 LEU A  95
PHE A 148
ARG A  19
ILE A 161
LEU A 132
 None
 1.26A 5ljcA-2pthA:
undetectable		 5ljcA-2pthA:
19.29
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.
2qmx PREPHENATE
DEHYDRATASE

(Chlorobaculum
tepidum) 		PF00800
(PDT) 		5 LEU A 262
ALA A 214
LEU A 215
PHE A 218
TYR A 243
 None
 1.14A 5ljcA-2qmxA:
undetectable		 5ljcA-2qmxA:
17.69
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.
2qvl DIACYLGLYCEROL
KINASE DGKB

(Staphylococcus
aureus) 		PF00781
(DAGK_cat) 		6 PHE A 133
LEU A 268
ALA A 137
LEU A 196
PHE A 194
LEU A 285
 None
 1.19A 5ljcA-2qvlA:
undetectable		 5ljcA-2qvlA:
18.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rcq RETINOL-BINDING
PROTEIN II, CELLULAR

(Homo sapiens) 		PF00061
(Lipocalin) 		6 PHE A  16
TYR A  19
ALA A  33
SER A  55
ARG A  58
LEU A 117
 None
None
None
None
SO4  A 152 (-3.1A)
None
 0.91A 5ljcA-2rcqA:
23.9		 5ljcA-2rcqA:
52.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rcq RETINOL-BINDING
PROTEIN II, CELLULAR

(Homo sapiens) 		PF00061
(Lipocalin) 		6 PHE A  16
TYR A  19
SER A  55
PHE A  57
ARG A  58
LEU A 117
 None
None
None
None
SO4  A 152 (-3.1A)
None
 0.89A 5ljcA-2rcqA:
23.9		 5ljcA-2rcqA:
52.86
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.
2v15 DNA PROTECTION
DURING STARVATION
PROTEIN

(Streptococcus
suis) 		PF00210
(Ferritin) 		5 TYR A  65
LEU A  36
ALA A  39
LEU A 100
ILE A 155
 None
 1.17A 5ljcA-2v15A:
undetectable		 5ljcA-2v15A:
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.
2v7s PROBABLE CONSERVED
LIPOPROTEIN LPPA

(Mycobacterium
tuberculosis) 		PF16708
(LppA) 		5 LEU A  70
ALA A  74
LEU A 185
PHE A 175
ILE A 120
 None
 1.05A 5ljcA-2v7sA:
undetectable		 5ljcA-2v7sA:
20.91
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.
2yw4 4-HYDROXY-2-OXOGLUTA
RATE
ALDOLASE/2-DEYDRO-3-
DEOXYPHOSPHOGLUCONAT
E ALDOLASE

(Thermus
thermophilus) 		PF01081
(Aldolase) 		5 ALA A 197
LEU A 200
PRO A 166
ILE A 160
LEU A 171
 None
 1.26A 5ljcA-2yw4A:
undetectable		 5ljcA-2yw4A:
21.84
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.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		5 ALA A 187
LEU A 186
ARG A 149
ILE A 150
LEU A 207
 None
ACT  A1001 (-4.6A)
None
None
None
 1.20A 5ljcA-2yxeA:
undetectable		 5ljcA-2yxeA:
22.27
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.
3a9s D-ARABINOSE
ISOMERASE

(Aeribacillus
pallidus) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		5 ALA A 173
LEU A 172
PRO A  12
TYR A   7
ILE A 300
 None
 1.26A 5ljcA-3a9sA:
undetectable		 5ljcA-3a9sA:
13.50
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.
3hmf PROTEIN POLYBROMO-1

(Homo sapiens) 		PF00439
(Bromodomain) 		5 PHE A 208
ALA A 273
SER A 267
PHE A 270
TYR A 262
 None
 1.20A 5ljcA-3hmfA:
undetectable		 5ljcA-3hmfA:
21.53
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.
3kux PUTATIVE
OXIDOREDUCTASE

(Yersinia pestis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 PHE A 212
LEU A 195
ALA A 214
LEU A 225
ILE A 330
 None
 1.13A 5ljcA-3kuxA:
undetectable		 5ljcA-3kuxA:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ky9 PROTO-ONCOGENE VAV

(Homo sapiens) 		PF00130
(C1_1)
PF00169
(PH)
PF00621
(RhoGEF)
PF11971
(CAMSAP_CH) 		5 LEU A  70
PRO A  64
SER A  67
PHE A  69
ILE A  75
 None
 1.23A 5ljcA-3ky9A:
undetectable		 5ljcA-3ky9A:
12.05
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.
3kyd SUMO-ACTIVATING
ENZYME SUBUNIT 1

(Homo sapiens) 		PF00899
(ThiF) 		5 PHE A 328
TYR A 164
ALA A 219
ILE A 139
LEU A 310
 None
EDO  A 347 (-4.6A)
None
None
None
 1.26A 5ljcA-3kydA:
undetectable		 5ljcA-3kydA:
18.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nr3 PMP2 PROTEIN

(Homo sapiens) 		PF00061
(Lipocalin) 		5 PHE A  17
TYR A  20
PRO A  39
SER A  56
PHE A  58
 None
None
SO4  A 903 ( 4.8A)
PLM  A 901 (-3.7A)
None
 0.96A 5ljcA-3nr3A:
19.9		 5ljcA-3nr3A:
35.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o0y LIPOPROTEIN

(Colwellia
psychrerythraea) 		PF05960
(DUF885) 		5 LEU A 207
ALA A 203
LEU A 200
PRO A 195
ILE A 181
 None
 1.17A 5ljcA-3o0yA:
undetectable		 5ljcA-3o0yA:
12.19
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.
3orq N5-CARBOXYAMINOIMIDA
ZOLE RIBONUCLEOTIDE
SYNTHETASE

(Staphylococcus
aureus) 		PF02222
(ATP-grasp)
PF02826
(2-Hacid_dh_C) 		5 PHE A 255
ALA A 234
LEU A 194
PHE A 206
ILE A 241
 None
 1.25A 5ljcA-3orqA:
undetectable		 5ljcA-3orqA:
15.62
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.
3ppb PUTATIVE TETR FAMILY
TRANSCRIPTION
REGULATOR

(Shewanella
loihica) 		PF00440
(TetR_N) 		5 PHE A 187
LEU A  81
ALA A  85
LEU A  88
ILE A 135
 PG4  A 216 (-4.7A)
None
PG4  A 216 ( 4.1A)
PG4  A 216 (-3.8A)
None
 0.66A 5ljcA-3ppbA:
undetectable		 5ljcA-3ppbA:
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.
3ure ALPHA-LYTIC PROTEASE

(Lysobacter
enzymogenes) 		PF00089
(Trypsin) 		5 LEU A 242
ALA A 209
SER A 198
ILE A 234
LEU A 180
 None
 1.28A 5ljcA-3ureA:
undetectable		 5ljcA-3ureA:
18.23
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.
3v2i PEPTIDYL-TRNA
HYDROLASE

(Burkholderia
thailandensis) 		PF01195
(Pept_tRNA_hydro) 		5 LEU A  95
PHE A 157
ARG A  19
ILE A 170
LEU A 131
 None
CIT  A 202 (-4.8A)
CIT  A 202 (-2.8A)
None
None
 1.22A 5ljcA-3v2iA:
undetectable		 5ljcA-3v2iA:
18.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wbg FATTY ACID-BINDING
PROTEIN, HEART

(Homo sapiens) 		PF00061
(Lipocalin) 		5 PHE A  16
TYR A  19
ALA A  33
SER A  55
LEU A 115
 2AN  A 201 ( 4.9A)
2AN  A 201 (-4.8A)
2AN  A 201 (-3.8A)
2AN  A 201 (-3.2A)
None
 0.75A 5ljcA-3wbgA:
20.5		 5ljcA-3wbgA:
33.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wbg FATTY ACID-BINDING
PROTEIN, HEART

(Homo sapiens) 		PF00061
(Lipocalin) 		5 TYR A  19
ALA A  33
PRO A  38
SER A  55
LEU A 115
 2AN  A 201 (-4.8A)
2AN  A 201 (-3.8A)
2AN  A 201 ( 4.3A)
2AN  A 201 (-3.2A)
None
 0.83A 5ljcA-3wbgA:
20.5		 5ljcA-3wbgA:
33.76
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.
3wx7 CHITIN
OLIGOSACCHARIDE
DEACETYLASE

(Vibrio
parahaemolyticus) 		PF01522
(Polysacc_deac_1) 		5 TYR A  59
ALA A  56
PHE A 325
TYR A 331
ILE A 287
 None
 1.23A 5ljcA-3wx7A:
undetectable		 5ljcA-3wx7A:
16.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4a60 FATTY ACID-BINDING
PROTEIN 9 TESTIS
LIPID-BINDING
PROTEIN, TLBP,
TESTIS-TYPE FATTY
ACID-BINDING
PROTEIN, T-FABP

(Homo sapiens) 		PF00061
(Lipocalin) 		5 PHE A  17
TYR A  20
ALA A  34
PRO A  39
SER A  56
 None
None
NA  A1132 ( 4.0A)
None
NA  A1132 (-2.9A)
 0.78A 5ljcA-4a60A:
19.4		 5ljcA-4a60A:
32.50
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.
4amm DYNE8

(Micromonospora
chersina) 		PF00698
(Acyl_transf_1) 		5 PHE A 873
LEU A 510
ALA A 514
LEU A 517
LEU A 640
 None
 1.05A 5ljcA-4ammA:
undetectable		 5ljcA-4ammA:
12.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ay9 FOLLICLE-STIMULATING
HORMONE RECEPTOR

(Homo sapiens) 		PF01462
(LRRNT)
PF12369
(GnHR_trans)
PF13306
(LRR_5) 		5 PHE X 214
LEU X 195
PRO X 220
ILE X 225
LEU X 261
 None
 1.18A 5ljcA-4ay9X:
undetectable		 5ljcA-4ay9X:
14.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4azp FATTY ACID-BINDING
PROTEIN, EPIDERMAL

(Mus musculus) 		PF00061
(Lipocalin) 		5 PHE A  19
TYR A  22
LEU A  32
ALA A  36
SER A  58
 None
None
A9M  A1136 ( 4.1A)
A9M  A1136 (-3.4A)
A9M  A1136 ( 4.1A)
 0.99A 5ljcA-4azpA:
20.8		 5ljcA-4azpA:
34.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cyj PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN3-LIKE PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 LEU A 409
ALA A 380
LEU A 381
TYR A 373
ILE A 407
 None
 1.27A 5ljcA-4cyjA:
undetectable		 5ljcA-4cyjA:
16.47
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.
4gbr BETA-2 ADRENERGIC
RECEPTOR

(Homo sapiens) 		PF00001
(7tm_1) 		5 PHE A 308
TYR A 298
ALA A 307
LEU A 311
ILE A  58
 None
 1.25A 5ljcA-4gbrA:
undetectable		 5ljcA-4gbrA:
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.
4gnk 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 355
SER B 132
PHE B 136
TYR B  77
LEU B  80
 None
 1.14A 5ljcA-4gnkB:
undetectable		 5ljcA-4gnkB:
7.95
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.
4hbk ALDO-KETO REDUCTASE
FAMILY 1, MEMBER B4
(ALDOSE REDUCTASE)

(Schistosoma
japonicum) 		PF00248
(Aldo_ket_red) 		5 LEU A  65
ALA A  61
LEU A  58
ARG A  40
TYR A  39
 None
 1.30A 5ljcA-4hbkA:
undetectable		 5ljcA-4hbkA:
15.70
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.
4l7m PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermococcus
onnurineus) 		PF13646
(HEAT_2) 		5 LEU A 114
ALA A 117
LEU A 142
ILE A 155
LEU A 208
 None
 1.15A 5ljcA-4l7mA:
undetectable		 5ljcA-4l7mA:
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.
4li2 LEUCINE-RICH
REPEAT-CONTAINING
G-PROTEIN COUPLED
RECEPTOR 4

(Xenopus
tropicalis) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 209
LEU A 250
PRO A 251
SER A 249
PHE A 224
 None
 1.21A 5ljcA-4li2A:
undetectable		 5ljcA-4li2A:
15.31
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.
4mdv ANNEXIN

(Schistosoma
mansoni) 		PF00191
(Annexin) 		5 LEU A 339
LEU A 312
SER A 301
ILE A 294
LEU A 113
 None
 1.24A 5ljcA-4mdvA:
undetectable		 5ljcA-4mdvA:
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.
4n18 D-ISOMER SPECIFIC
2-HYDROXYACID
DEHYDROGENASE FAMILY
PROTEIN

(Klebsiella
pneumoniae) 		PF02826
(2-Hacid_dh_C) 		5 ALA A 284
SER A  46
TYR A  44
ILE A   4
LEU A 300
 None
 1.25A 5ljcA-4n18A:
undetectable		 5ljcA-4n18A:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nz5 DEACETYLASE DA1

(Vibrio cholerae) 		PF01522
(Polysacc_deac_1) 		5 TYR A  63
ALA A  60
PHE A 329
TYR A 335
ILE A 291
 None
 1.29A 5ljcA-4nz5A:
undetectable		 5ljcA-4nz5A:
14.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4okj 3'-5'
EXORIBONUCLEASE
RV2179C/MT2234.1

(Mycobacterium
tuberculosis) 		PF16473
(DUF5051) 		5 LEU A 120
PHE A 153
ARG A   2
TYR A   3
LEU A  99
 None
 1.24A 5ljcA-4okjA:
undetectable		 5ljcA-4okjA:
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.
4oxi ENTEROBACTIN
SYNTHETASE COMPONENT
F-RELATED PROTEIN

(Vibrio cholerae) 		PF00501
(AMP-binding) 		5 LEU A 409
ALA A 122
ARG A  79
ILE A 105
LEU A 141
 None
 1.24A 5ljcA-4oxiA:
undetectable		 5ljcA-4oxiA:
13.63
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.
4p6b EST-Y29

(metagenome) 		PF00144
(Beta-lactamase) 		5 PHE A 273
LEU A 289
LEU A 324
PRO A  62
LEU A 263
 None
 1.28A 5ljcA-4p6bA:
undetectable		 5ljcA-4p6bA:
14.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 PHE A 972
ALA A 970
LEU A 981
PHE A 984
ILE A1002
 None
 1.30A 5ljcA-4ptfA:
undetectable		 5ljcA-4ptfA:
7.97
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.
4sbv SOUTHERN BEAN MOSAIC
VIRUS COAT PROTEIN

(Southern bean
mosaic virus) 		PF00729
(Viral_coat) 		5 ALA A 182
ARG A 116
TYR A 117
ILE A 185
LEU A  78
 None
 1.12A 5ljcA-4sbvA:
undetectable		 5ljcA-4sbvA:
15.85
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.
4sbv SOUTHERN BEAN MOSAIC
VIRUS COAT PROTEIN

(Southern bean
mosaic virus) 		PF00729
(Viral_coat) 		5 PHE A 170
ARG A 116
TYR A 117
ILE A 185
LEU A  78
 None
 1.13A 5ljcA-4sbvA:
undetectable		 5ljcA-4sbvA:
15.85
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.
4u8u GLOBIN A CHAIN

(Glossoscolex
paulistus) 		PF00042
(Globin) 		5 PHE A  41
ALA A  47
LEU A  50
ILE A 113
LEU A  68
 None
HEM  A 201 ( 3.8A)
HEM  A 201 (-4.0A)
HEM  A 201 (-3.6A)
None
 1.14A 5ljcA-4u8uA:
undetectable		 5ljcA-4u8uA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wqm TOLUENE-4-MONOOXYGEN
ASE ELECTRON
TRANSFER COMPONENT

(Pseudomonas
mendocina) 		PF00111
(Fer2)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 LEU A   9
ALA A  25
LEU A  26
ILE A  46
LEU A  56
 None
 1.23A 5ljcA-4wqmA:
undetectable		 5ljcA-4wqmA:
18.38
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.
4yfj AMINOGLYCOSIDE
3'-N-ACETYLTRANSFERA
SE

(Pseudomonas
aeruginosa) 		PF00583
(Acetyltransf_1) 		5 TYR A 142
LEU A 129
ALA A 133
LEU A 136
TYR A  93
 None
 1.29A 5ljcA-4yfjA:
undetectable		 5ljcA-4yfjA:
18.23
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.
4zlg PUTATIVE B-GLYCAN
PHOSPHORYLASE

(Saccharophagus
degradans) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 PHE A 633
ARG A 702
TYR A 701
ILE A 705
LEU A 321
 None
 1.16A 5ljcA-4zlgA:
undetectable		 5ljcA-4zlgA:
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.
5aa6 VANADIUM-DEPENDENT
BROMOPEROXIDASE 2

(Ascophyllum
nodosum) 		no annotation 5 TYR A 583
LEU A 556
ALA A 464
PHE A 465
TYR A 458
 None
 1.21A 5ljcA-5aa6A:
undetectable		 5ljcA-5aa6A:
12.84
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.
5csa ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00364
(Biotin_lipoyl)
PF08326
(ACC_central) 		5 LEU A1086
ALA A1101
PRO A1067
SER A1051
ILE A1076
 None
 1.17A 5ljcA-5csaA:
undetectable		 5ljcA-5csaA:
9.18
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.
5df0 AC-CHIA

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 ALA A 369
LEU A 373
SER A 352
ILE A 361
LEU A 522
 None
 1.12A 5ljcA-5df0A:
undetectable		 5ljcA-5df0A:
15.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f15 4-AMINO-4-DEOXY-L-AR
ABINOSE (L-ARA4N)
TRANSFERASE

(Cupriavidus
metallidurans) 		PF13231
(PMT_2) 		5 PHE A  34
LEU A 433
ALA A 437
PHE A 137
LEU A  39
 MPG  A 602 (-4.6A)
None
MPG  A 602 ( 3.7A)
None
None
 1.20A 5ljcA-5f15A:
undetectable		 5ljcA-5f15A:
11.65
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.
5f4z EPOXIDE HYDROLASE

(Streptomyces
carzinostaticus) 		PF06441
(EHN) 		5 PHE A 106
LEU A 377
LEU A 129
PHE A 127
LEU A 134
 None
 1.29A 5ljcA-5f4zA:
undetectable		 5ljcA-5f4zA:
14.84
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.
5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3

(Arabidopsis
thaliana) 		PF00311
(PEPcase) 		5 LEU A 714
PHE A 818
TYR A 813
ILE A 823
LEU A 806
 None
 1.28A 5ljcA-5fdnA:
undetectable		 5ljcA-5fdnA:
9.67
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.
5fei DISTAL TUBE PROTEIN

(Bacillus virus
phi29) 		PF16838
(Caud_tail_N) 		5 PRO A 543
SER A 126
PHE A 560
ILE A 573
LEU A 583
 None
 1.15A 5ljcA-5feiA:
undetectable		 5ljcA-5feiA:
12.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5gkb FATTY ACID BINDIN
PROTEIN, ISOFORM B

(Drosophila
melanogaster) 		PF00061
(Lipocalin) 		5 PHE A  16
TYR A  19
LEU A  36
PRO A  38
SER A  55
 None
 0.80A 5ljcA-5gkbA:
19.5		 5ljcA-5gkbA:
36.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gmh TOLL-LIKE RECEPTOR 7

(Macaca mulatta) 		PF00560
(LRR_1)
PF13306
(LRR_5)
PF13855
(LRR_8) 		5 LEU A 533
LEU A 565
PHE A 538
ILE A 573
LEU A 621
 None
 1.05A 5ljcA-5gmhA:
undetectable		 5ljcA-5gmhA:
10.36
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.
5hp5 PROTEIN-ARGININE
DEIMINASE TYPE-1

(Homo sapiens) 		PF03068
(PAD)
PF08526
(PAD_N)
PF08527
(PAD_M) 		5 ALA A 104
LEU A 105
PRO A  34
ARG A  67
LEU A   9
 None
 1.07A 5ljcA-5hp5A:
undetectable		 5ljcA-5hp5A:
11.70
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.
5jpn COMPLEMENT C4-A

(Homo sapiens) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		5 LEU A  76
ALA A  83
LEU A  85
PHE A  74
LEU A 510
 None
 1.25A 5ljcA-5jpnA:
undetectable		 5ljcA-5jpnA:
11.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1g 1-CYS PEROXIREDOXIN

(Vibrio
vulnificus) 		PF08534
(Redoxin) 		5 LEU A  70
ALA A  72
LEU A  97
ILE A 129
LEU A 110
 None
 1.08A 5ljcA-5k1gA:
undetectable		 5ljcA-5k1gA:
20.96
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.
5llb POLYPHOSPHATE KINASE
2

(Francisella
tularensis) 		no annotation 5 PHE C  43
LEU C 115
LEU C  40
TYR C 238
ILE C 160
 None
 1.24A 5ljcA-5llbC:
undetectable		 5ljcA-5llbC:
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.
5mdh MALATE DEHYDROGENASE

(Sus scrofa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A  85
ALA A  83
LEU A  80
PHE A  77
LEU A  64
 None
 1.19A 5ljcA-5mdhA:
undetectable		 5ljcA-5mdhA:
18.02
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.
5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC

(Pseudomonas
protegens) 		no annotation 5 ALA C 147
LEU C 150
TYR C 155
ILE C 306
LEU C 169
 None
 1.25A 5ljcA-5mg5C:
undetectable		 5ljcA-5mg5C:
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.
5mrr LYTIC ENDOPEPTIDASE
PREPROENZYME

(Lysobacter sp.
XL1) 		no annotation 5 LEU A 196
ALA A 155
SER A 147
ILE A 188
LEU A 132
 None
 1.23A 5ljcA-5mrrA:
undetectable		 5ljcA-5mrrA:
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.
5nyw PROTEASOME SUBUNIT

(Yersinia
bercovieri) 		no annotation 5 PHE A  14
TYR A 198
ALA A   5
LEU A 115
PHE A 146
 None
 1.20A 5ljcA-5nywA:
undetectable		 5ljcA-5nywA:
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.
5o6u UNCHARACTERIZED
PROTEIN

(Shewanella
putrefaciens) 		no annotation 5 LEU C  89
PRO C 131
SER C 130
ILE C 112
LEU C 247
 None
None
U  A  18 ( 4.6A)
None
None
 1.27A 5ljcA-5o6uC:
undetectable		 5ljcA-5o6uC:
18.59
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.
5o6u UNCHARACTERIZED
PROTEIN

(Shewanella
putrefaciens) 		no annotation 6 LEU C 132
PRO C 131
SER C 130
ARG C 117
ILE C 112
LEU C 247
 None
None
U  A  18 ( 4.6A)
A  A  20 ( 3.4A)
None
None
 1.43A 5ljcA-5o6uC:
undetectable		 5ljcA-5o6uC:
18.59
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.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT) 		5 PHE T 363
TYR T 359
LEU T 367
PRO T 326
TYR T 321
 None
 1.21A 5ljcA-5ojsT:
undetectable		 5ljcA-5ojsT:
3.18
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.
5u9c DTDP-4-DEHYDRORHAMNO
SE REDUCTASE

(Yersinia
enterocolitica) 		PF04321
(RmlD_sub_bind) 		5 PHE A  60
LEU A 147
LEU A 196
PHE A 199
ILE A 204
 None
 1.16A 5ljcA-5u9cA:
undetectable		 5ljcA-5u9cA:
16.61
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.
5yim SDEA

(Legionella
pneumophila) 		no annotation 5 PHE A 965
TYR A 962
PRO A 997
SER A 998
LEU A 946
 None
 1.16A 5ljcA-5yimA:
undetectable		 5ljcA-5yimA:
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.
6ao7 ACETYLTRANSFERASE

(Elizabethkingia
anophelis) 		PF00583
(Acetyltransf_1) 		5 ALA A  24
LEU A  23
TYR A  18
ILE A  31
LEU A  42
 ACO  A 201 (-3.4A)
ACO  A 201 (-4.7A)
None
None
None
 1.28A 5ljcA-6ao7A:
undetectable		 5ljcA-6ao7A:
16.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bpc RETICULOCYTE BINDING
PROTEIN 2, PUTATIVE

(Plasmodium
vivax) 		no annotation 5 TYR A 347
LEU A 440
ARG A 387
TYR A 177
ILE A 384
 None
 1.30A 5ljcA-6bpcA:
undetectable		 5ljcA-6bpcA:
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.
6cau UDP-N-ACETYLMURAMATE
--L-ALANINE LIGASE

(Acinetobacter
baumannii) 		no annotation 5 PHE A 220
ALA A 178
LEU A 188
PRO A 190
ILE A 194
 None
 1.19A 5ljcA-6cauA:
undetectable		 5ljcA-6cauA:
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.
6d04 RETICULOCYTE BINDING
PROTEIN 2, PUTATIVE

(Plasmodium
vivax) 		no annotation 5 TYR E 347
SER E 439
ARG E 387
TYR E 177
ILE E 384
 None
 1.17A 5ljcA-6d04E:
undetectable		 5ljcA-6d04E:
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.
6evj RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza A
virus) 		no annotation 5 ALA B 320
LEU B 319
PRO B 341
ARG B 334
ILE B 325
 None
 0.96A 5ljcA-6evjB:
undetectable		 5ljcA-6evjB:
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.
6f4e CATALYTIC DOMAIN OF
BOTULINUM NEUROTOXIN
X

(Clostridium
botulinum) 		no annotation 5 PHE A 388
LEU A 403
ALA A 218
PRO A 221
TYR A 373
 None
 1.27A 5ljcA-6f4eA:
undetectable		 5ljcA-6f4eA:
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.
6g21 PROBABLE FERULOYL
ESTERASE B-2

(Aspergillus
oryzae) 		no annotation 5 TYR A 325
LEU A  92
LEU A 133
PRO A 353
PHE A 136
 None
 1.24A 5ljcA-6g21A:
undetectable		 5ljcA-6g21A:
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.
1ewk METABOTROPIC
GLUTAMATE RECEPTOR
SUBTYPE 1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 LEU A 300
ILE A 340
THR A 339
MET A 215
 None
 1.40A 5ljcA-1ewkA:
0.0		 5ljcA-1ewkA:
14.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ggl PROTEIN (CELLULAR
RETINOL-BINDING
PROTEIN III)

(Homo sapiens) 		PF00061
(Lipocalin) 		4 LEU A  20
LYS A  40
THR A  53
TRP A 106
 None
 0.34A 5ljcA-1gglA:
23.2		 5ljcA-1gglA:
54.81
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.
1hfo MIGRATION INHIBITORY
FACTOR

(Trichinella
spiralis) 		PF01187
(MIF) 		4 LEU A  19
ILE A  89
THR A   7
MET A  94
 None
 1.38A 5ljcA-1hfoA:
undetectable		 5ljcA-1hfoA:
20.92
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.
1llc L-LACTATE
DEHYDROGENASE

(Lactobacillus
casei) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 LEU A 285
ILE A 191
THR A 165
MET A 315
 None
 1.47A 5ljcA-1llcA:
0.0		 5ljcA-1llcA:
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.
1lo9 4-HYDROXYBENZOYL-COA
THIOESTERASE

(Pseudomonas sp.
CBS3) 		no annotation 4 LEU A  44
ILE A  80
THR A  82
MET A   7
 None
 0.87A 5ljcA-1lo9A:
1.0		 5ljcA-1lo9A:
17.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lpj RETINOL-BINDING
PROTEIN IV, CELLULAR

(Homo sapiens) 		PF00061
(Lipocalin) 		5 LYS A  40
ILE A  51
THR A  53
TRP A 106
MET A 119
 None
 0.69A 5ljcA-1lpjA:
24.4		 5ljcA-1lpjA:
56.39
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.
1mlz 7,8-DIAMINO-PELARGON
IC ACID
AMINOTRANSFERASE

(Escherichia
coli) 		PF00202
(Aminotran_3) 		4 LEU A 272
ILE A 365
THR A 254
MET A 400
 None
 1.22A 5ljcA-1mlzA:
0.0		 5ljcA-1mlzA:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nzy 4-CHLOROBENZOYL
COENZYME A
DEHALOGENASE

(Pseudomonas sp.
CBS3) 		PF00378
(ECH_1) 		4 LEU B  66
ILE B  93
THR B 146
MET B  92
 BCA  B 272 (-3.8A)
None
BCA  B 272 (-4.3A)
None
 1.39A 5ljcA-1nzyB:
0.0		 5ljcA-1nzyB:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oh9 ACETYLGLUTAMATE
KINASE

(Escherichia
coli) 		PF00696
(AA_kinase) 		4 ILE A 256
THR A 254
MET A 196
MET A 214
 None
None
None
ADP  A1259 (-4.5A)
 1.21A 5ljcA-1oh9A:
undetectable		 5ljcA-1oh9A:
19.01
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.
1qgu PROTEIN (NITROGENASE
MOLYBDENUM IRON
PROTEIN)

(Klebsiella
pneumoniae) 		PF00148
(Oxidored_nitro) 		4 LEU A 240
ILE A 280
MET A 277
TRP A 251
 None
 1.09A 5ljcA-1qguA:
undetectable		 5ljcA-1qguA:
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.
1r0l 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Zymomonas
mobilis) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		4 LEU A 292
ILE A 172
THR A 174
MET A 249
 None
 1.00A 5ljcA-1r0lA:
undetectable		 5ljcA-1r0lA:
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.
1rf5 5-ENOLPYRUVYLSHIKIMA
TE-3-PHOSPHATE
SYNTHASE

(Streptococcus
pneumoniae) 		PF00275
(EPSP_synthase) 		4 LEU A 373
ILE A 344
MET A 365
MET A 389
 None
 1.42A 5ljcA-1rf5A:
undetectable		 5ljcA-1rf5A:
17.15
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.
1saw HYPOTHETICAL PROTEIN
FLJ36880

(Homo sapiens) 		PF01557
(FAA_hydrolase) 		4 LEU A 148
ILE A 173
MET A  91
MET A 165
 None
 1.29A 5ljcA-1sawA:
undetectable		 5ljcA-1sawA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u5q SERINE/THREONINE
PROTEIN KINASE TAO2

(Rattus
norvegicus) 		PF00069
(Pkinase) 		4 LEU A 218
ILE A 315
THR A 297
MET A 312
 None
 1.47A 5ljcA-1u5qA:
undetectable		 5ljcA-1u5qA:
18.00
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.
1uz4 MAN5A

(Cellvibrio
mixtus) 		PF00150
(Cellulase) 		4 LEU A 116
ILE A  74
TRP A 378
MET A  46
 None
 1.17A 5ljcA-1uz4A:
undetectable		 5ljcA-1uz4A:
14.19
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.
1x55 ASPARAGINYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 LEU A 149
ILE A 358
MET A 349
MET A 250
 None
 0.68A 5ljcA-1x55A:
undetectable		 5ljcA-1x55A:
15.90
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.
1ydm HYPOTHETICAL PROTEIN
YQGN

(Bacillus
subtilis) 		PF01812
(5-FTHF_cyc-lig) 		4 LEU A 144
ILE A  72
THR A  47
MET A  82
 None
 1.22A 5ljcA-1ydmA:
undetectable		 5ljcA-1ydmA:
22.47
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.
1zbe COAT PROTEIN VP1

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		4 LEU 1 183
ILE 1  42
THR 1  56
MET 1 178
 None
 1.21A 5ljcA-1zbe1:
undetectable		 5ljcA-1zbe1:
18.89
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.
2a1x PHYTANOYL-COA
DIOXYGENASE

(Homo sapiens) 		PF05721
(PhyH) 		4 LEU A 174
ILE A 199
MET A 250
TRP A 193
 None
None
None
AKG  A 451 (-3.9A)
 1.28A 5ljcA-2a1xA:
undetectable		 5ljcA-2a1xA:
18.87
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.
2a1x PHYTANOYL-COA
DIOXYGENASE

(Homo sapiens) 		PF05721
(PhyH) 		4 LEU A 209
ILE A 199
MET A 250
TRP A 193
 None
None
None
AKG  A 451 (-3.9A)
 1.27A 5ljcA-2a1xA:
undetectable		 5ljcA-2a1xA:
18.87
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.
2a8x DIHYDROLIPOYL
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 LEU A 125
ILE A 106
THR A 107
MET A 101
 None
 1.19A 5ljcA-2a8xA:
undetectable		 5ljcA-2a8xA:
16.16
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.
2am2 UDP-N-ACETYLMURAMOYL
ALANINE-D-GLUTAMYL-L
YSINE-D-ALANYL-D-ALA
NINE LIGASE, MURF
PROTEIN

(Streptococcus
pneumoniae) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 LEU A 214
ILE A 167
MET A 159
MET A 209
 None
 1.09A 5ljcA-2am2A:
undetectable		 5ljcA-2am2A:
15.33
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.
2b24 NAPHTHALENE
DIOXYGENASE LARGE
SUBUNIT

(Rhodococcus sp.
NCIMB 12038) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 LEU A 428
ILE A 199
MET A 334
TRP A 326
 None
 1.06A 5ljcA-2b24A:
1.0		 5ljcA-2b24A:
14.68
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.
2b81 LUCIFERASE-LIKE
MONOOXYGENASE

(Bacillus cereus) 		PF00296
(Bac_luciferase) 		4 LEU A 295
ILE A 247
MET A 215
TRP A  59
 None
 1.39A 5ljcA-2b81A:
undetectable		 5ljcA-2b81A:
18.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2cbr PROTEIN (CRABP-I)

(Bos taurus) 		PF00061
(Lipocalin) 		4 LEU A  19
ILE A  63
THR A  61
TRP A 109
 None
 1.00A 5ljcA-2cbrA:
20.2		 5ljcA-2cbrA:
41.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d3l GLUCAN
1,4-ALPHA-MALTOHEXAO
SIDASE

(Bacillus sp.
707) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 LEU A 405
ILE A 389
THR A 358
MET A 430
 None
 1.18A 5ljcA-2d3lA:
undetectable		 5ljcA-2d3lA:
14.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dkh 3-HYDROXYBENZOATE
HYDROXYLASE

(Comamonas
testosteroni) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		4 LEU A 306
ILE A 288
TRP A 314
MET A 233
 None
 1.37A 5ljcA-2dkhA:
undetectable		 5ljcA-2dkhA:
11.91
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.
2dsj PYRIMIDINE-NUCLEOSID
E (THYMIDINE)
PHOSPHORYLASE

(Thermus
thermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		4 LEU A 259
ILE A 120
THR A 119
TRP A 129
 None
 1.16A 5ljcA-2dsjA:
undetectable		 5ljcA-2dsjA:
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.
2np0 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 ILE A 963
THR A 950
TRP A 961
MET A 955
 None
 1.43A 5ljcA-2np0A:
undetectable		 5ljcA-2np0A:
7.11
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.
2p88 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Bacillus cereus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A 115
ILE A   3
THR A  38
MET A  36
 None
 1.28A 5ljcA-2p88A:
undetectable		 5ljcA-2p88A:
13.55
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.
2rjt BETA-KETOACYL-ACP
SYNTHASE II

(Streptococcus
pneumoniae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 LEU A 322
ILE A 351
THR A 350
MET A 354
 None
 1.38A 5ljcA-2rjtA:
undetectable		 5ljcA-2rjtA:
16.59
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.
2vk9 ALPHA-TOXIN

(Clostridium
novyi) 		PF12918
(TcdB_N)
PF12919
(TcdA_TcdB) 		4 LEU A 412
LYS A 185
ILE A 181
MET A 178
 None
 1.11A 5ljcA-2vk9A:
undetectable		 5ljcA-2vk9A:
13.41
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.
2x12 FIMBRIAE-ASSOCIATED
PROTEIN FAP1

(Streptococcus
parasanguinis) 		no annotation 4 ILE A 377
THR A 310
MET A 379
TRP A 282
 None
 1.34A 5ljcA-2x12A:
undetectable		 5ljcA-2x12A:
18.39
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.
2xdf PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Escherichia
coli) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		4 LEU A 561
ILE A 451
THR A 453
MET A 501
 None
 1.46A 5ljcA-2xdfA:
undetectable		 5ljcA-2xdfA:
13.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zba TRICHOTHECENE
3-O-ACETYLTRANSFERAS
E

(Fusarium
sporotrichioides) 		PF02458
(Transferase) 		4 LEU A 273
THR A 281
MET A 442
MET A 420
 None
 1.46A 5ljcA-2zbaA:
undetectable		 5ljcA-2zbaA:
16.36
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.
2zet RAS-RELATED PROTEIN
RAB-27B

(Mus musculus) 		PF00071
(Ras) 		4 LEU A  97
ILE A  44
THR A  85
TRP A  73
 None
 1.45A 5ljcA-2zetA:
undetectable		 5ljcA-2zetA:
22.97
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.
3aiv BETA-GLUCOSIDASE

(Secale cereale) 		PF00232
(Glyco_hydro_1) 		4 LEU A 236
ILE A 307
MET A 303
TRP A 289
 None
 1.43A 5ljcA-3aivA:
undetectable		 5ljcA-3aivA:
12.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b3d PUTATIVE MORPHINE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		4 LEU A 207
LYS A 177
ILE A 180
THR A 175
 None
 1.38A 5ljcA-3b3dA:
undetectable		 5ljcA-3b3dA:
16.93
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.
3b5n SYNAPTOBREVIN
HOMOLOG 1
PROTEIN SSO1
PROTEIN TRANSPORT
PROTEIN SEC9

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00957
(Synaptobrevin)
PF00804
(Syntaxin)
PF05739
(SNARE)
no annotation 		4 LEU C 462
ILE A  36
THR A  39
MET B 207
 None
 1.08A 5ljcA-3b5nC:
undetectable		 5ljcA-3b5nC:
18.98
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.
3but UNCHARACTERIZED
PROTEIN AF_0446

(Archaeoglobus
fulgidus) 		PF03168
(LEA_2) 		4 LEU A 124
ILE A  94
THR A  92
MET A  43
 None
 1.41A 5ljcA-3butA:
undetectable		 5ljcA-3butA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3deu TRANSCRIPTIONAL
REGULATOR SLYA

(Salmonella
enterica) 		PF01047
(MarR) 		4 LEU A  68
ILE A 108
MET A 104
TRP A  35
 None
 1.43A 5ljcA-3deuA:
undetectable		 5ljcA-3deuA:
19.53
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.
3drk OLIGOPEPTIDE-BINDING
PROTEIN OPPA

(Lactococcus
lactis) 		PF00496
(SBP_bac_5) 		4 LEU A 387
ILE A 468
MET A 305
TRP A 433
 None
 1.28A 5ljcA-3drkA:
undetectable		 5ljcA-3drkA:
12.52
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.
3fd3 CHROMOSOME
REPLICATION
INITIATION INHIBITOR
PROTEIN

(Agrobacterium
fabrum) 		PF03466
(LysR_substrate) 		4 LEU A 315
ILE A 145
THR A 119
MET A 307
 None
 1.15A 5ljcA-3fd3A:
undetectable		 5ljcA-3fd3A:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fii BOTULINUM NEUROTOXIN
TYPE F

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		4 LEU A 236
ILE A 139
MET A  22
TRP A  44
 None
 1.37A 5ljcA-3fiiA:
undetectable		 5ljcA-3fiiA:
16.09
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.
3gb4 DDMC

(Stenotrophomonas
maltophilia) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 LEU A 158
ILE A 331
TRP A 222
MET A 228
 D3M  A 601 ( 4.0A)
None
None
None
 1.43A 5ljcA-3gb4A:
1.9		 5ljcA-3gb4A:
17.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h6t GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 LEU A 127
THR A 143
TRP A 159
MET A 162
 None
GLU  A 264 (-3.6A)
None
None
 1.42A 5ljcA-3h6tA:
undetectable		 5ljcA-3h6tA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hbc CHOLOYLGLYCINE
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF02275
(CBAH) 		4 LEU A  99
ILE A 125
MET A 121
TRP A  74
 None
GOL  A   5 (-4.5A)
None
None
 1.39A 5ljcA-3hbcA:
undetectable		 5ljcA-3hbcA:
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.
3io1 AMINOBENZOYL-GLUTAMA
TE UTILIZATION
PROTEIN

(Klebsiella
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 LEU A 158
ILE A  57
MET A 192
MET A 117
 None
 1.24A 5ljcA-3io1A:
undetectable		 5ljcA-3io1A:
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.
3is5 CALCIUM-DEPENDENT
PROTEIN KINASE

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		4 LEU A 218
ILE A 319
MET A 373
MET A 244
 None
 1.31A 5ljcA-3is5A:
undetectable		 5ljcA-3is5A:
17.89
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.
3k0s DNA MISMATCH REPAIR
PROTEIN MUTS

(Escherichia
coli) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 LEU A 283
ILE A 653
THR A 655
MET A 269
 None
 0.68A 5ljcA-3k0sA:
undetectable		 5ljcA-3k0sA:
9.72
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.
3kfu NON-DISCRIMINATING
AND ARCHAEAL-TYPE
ASPARTYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 LEU A 139
ILE A 346
THR A 347
MET A 241
 None
 1.43A 5ljcA-3kfuA:
undetectable		 5ljcA-3kfuA:
15.93
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.
3m2r METHYL-COENZYME M
REDUCTASE I SUBUNIT
BETA

(Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		4 LEU B 106
ILE B  42
THR B  45
MET B 178
 None
 1.03A 5ljcA-3m2rB:
undetectable		 5ljcA-3m2rB:
14.78
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.
3mpn TRANSPORTER

(Aquifex
aeolicus) 		PF00209
(SNF) 		4 LEU A 396
THR A 479
MET A 476
TRP A 406
 BOG  A 705 ( 4.1A)
None
None
None
 1.34A 5ljcA-3mpnA:
undetectable		 5ljcA-3mpnA:
14.97
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.
3oqp PUTATIVE
ISOCHORISMATASE

(Paraburkholderia
xenovorans) 		PF00857
(Isochorismatase) 		4 LEU A  99
ILE A  36
THR A 114
MET A  40
 None
 1.19A 5ljcA-3oqpA:
undetectable		 5ljcA-3oqpA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qtp ENOLASE 1

(Entamoeba
histolytica) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 LEU A 135
ILE A 109
THR A 353
MET A  92
 None
 1.47A 5ljcA-3qtpA:
undetectable		 5ljcA-3qtpA:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t7b ACETYLGLUTAMATE
KINASE

(Yersinia pestis) 		PF00696
(AA_kinase) 		4 ILE A 255
THR A 253
MET A 195
MET A 213
 None
 1.19A 5ljcA-3t7bA:
undetectable		 5ljcA-3t7bA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tc3 UV DAMAGE
ENDONUCLEASE

(Sulfolobus
acidocaldarius) 		PF03851
(UvdE) 		4 LEU A  45
ILE A  63
THR A  62
MET A 132
 None
 1.08A 5ljcA-3tc3A:
undetectable		 5ljcA-3tc3A:
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.
3tpf ORNITHINE
CARBAMOYLTRANSFERASE

(Campylobacter
jejuni) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		4 LEU A 261
ILE A 135
THR A 134
TRP A 161
 None
 1.26A 5ljcA-3tpfA:
undetectable		 5ljcA-3tpfA:
16.83
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.
3vu9 CHROMOSOME
SEGREGATION IN
MEIOSIS PROTEIN 2

(Saccharomyces
cerevisiae) 		PF16834
(CSM2) 		4 LEU B 139
ILE B 159
THR B 161
MET B 149
 None
 1.13A 5ljcA-3vu9B:
undetectable		 5ljcA-3vu9B:
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.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		4 LEU A 245
ILE A 321
THR A 322
MET A 371
 None
 1.41A 5ljcA-3x3yA:
1.6		 5ljcA-3x3yA:
11.54
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.
4a0h ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Arabidopsis
thaliana) 		PF00202
(Aminotran_3)
PF13500
(AAA_26) 		4 LEU A 102
ILE A  57
THR A 134
TRP A 138
 None
 1.19A 5ljcA-4a0hA:
undetectable		 5ljcA-4a0hA:
10.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a0w T-COMPLEX PROTEIN 1
SUBUNIT BETA

(Bos taurus) 		PF00118
(Cpn60_TCP1) 		4 LEU A 128
ILE A 480
THR A 481
MET A 475
 None
 1.43A 5ljcA-4a0wA:
undetectable		 5ljcA-4a0wA:
13.47
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.
4ag4 EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1

(Homo sapiens) 		PF00754
(F5_F8_type_C) 		4 LEU A  91
ILE A 141
TRP A 132
MET A 159
 None
 1.45A 5ljcA-4ag4A:
undetectable		 5ljcA-4ag4A:
15.67
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.
4euk HISTIDINE KINASE 5
HISTIDINE-CONTAINING
PHOSPHOTRANSFER
PROTEIN 1

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		PF00072
(Response_reg)
PF01627
(Hpt) 		4 LEU B  30
ILE A 904
MET A 883
MET A 796
 None
 0.98A 5ljcA-4eukB:
undetectable		 5ljcA-4eukB:
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.
4gh4 CAPSID PROTEIN VP1

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		4 LEU A 184
ILE A  42
THR A  56
MET A 179
 None
 1.15A 5ljcA-4gh4A:
undetectable		 5ljcA-4gh4A:
21.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4i9r CELLULAR RETINOIC
ACID-BINDING PROTEIN
2

(Homo sapiens) 		PF00061
(Lipocalin) 		4 LEU A  19
ILE A  63
TRP A 109
MET A 123
 None
RET  A 201 ( 4.7A)
RET  A 201 (-3.7A)
RET  A 201 (-4.6A)
 1.02A 5ljcA-4i9rA:
19.6		 5ljcA-4i9rA:
43.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4i9r CELLULAR RETINOIC
ACID-BINDING PROTEIN
2

(Homo sapiens) 		PF00061
(Lipocalin) 		4 LEU A  22
ILE A  63
TRP A 109
MET A 123
 None
RET  A 201 ( 4.7A)
RET  A 201 (-3.7A)
RET  A 201 (-4.6A)
 1.45A 5ljcA-4i9rA:
19.6		 5ljcA-4i9rA:
43.57
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.
4nnb OBCA, OXALATE
BIOSYNTHETIC
COMPONENT A

(Burkholderia
glumae) 		PF05853
(BKACE) 		4 LEU A 274
ILE A 211
THR A 210
MET A 214
 None
 1.44A 5ljcA-4nnbA:
undetectable		 5ljcA-4nnbA:
12.50
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.
4rgy ESTERASE

(uncultured
bacterium FLS12) 		PF00756
(Esterase) 		4 LEU A   3
ILE A 253
TRP A  58
MET A  77
 None
 1.23A 5ljcA-4rgyA:
undetectable		 5ljcA-4rgyA:
17.41
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.
4rp8 ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA

(Escherichia
coli) 		PF03611
(EIIC-GAT) 		4 LEU A  62
ILE A 335
THR A 334
MET A 240
 None
 1.42A 5ljcA-4rp8A:
undetectable		 5ljcA-4rp8A:
13.73
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.
4rvc ABC TRANSPORTER
ATP-BINDING PROTEIN

(Geobacillus
kaustophilus) 		PF00005
(ABC_tran) 		4 LEU A 174
ILE A  35
THR A 191
MET A  31
 None
 1.35A 5ljcA-4rvcA:
undetectable		 5ljcA-4rvcA:
19.31
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.
4rye D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Mycobacterium
tuberculosis) 		PF00768
(Peptidase_S11) 		4 ILE A  37
THR A 274
TRP A  45
MET A 256
 None
 1.17A 5ljcA-4ryeA:
undetectable		 5ljcA-4ryeA:
15.99
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.
4wzb NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		4 LEU A 242
ILE A 282
MET A 279
TRP A 253
 None
 1.06A 5ljcA-4wzbA:
undetectable		 5ljcA-4wzbA:
13.74
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.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 LEU A 298
ILE A 196
THR A 237
MET A 193
 None
 0.96A 5ljcA-4xb3A:
undetectable		 5ljcA-4xb3A:
14.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		4 LEU A1102
ILE A1084
THR A1141
MET A1068
 None
 1.29A 5ljcA-4xqkA:
undetectable		 5ljcA-4xqkA:
6.59
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.
4xuv GLYCOSIDE HYDROLASE
FAMILY 105 PROTEIN

(Thielavia
terrestris) 		PF07470
(Glyco_hydro_88) 		4 LEU A 257
ILE A  58
MET A 365
TRP A 227
 None
 1.04A 5ljcA-4xuvA:
undetectable		 5ljcA-4xuvA:
15.99
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.
5aoq TORSO

(Bombyx mori) 		no annotation 4 LEU A  18
ILE A  47
TRP A 113
MET A  80
 None
 1.47A 5ljcA-5aoqA:
undetectable		 5ljcA-5aoqA:
18.61
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.
5bnn CAPSID PROTEIN VP2
CAPSID PROTEIN VP3
CAPSID PROTEIN VP4

(Enterovirus D;
Enterovirus D;
Enterovirus D) 		PF00073
(Rhv)
PF00073
(Rhv)
PF02226
(Pico_P1A) 		4 LEU D  60
THR C 116
MET C 118
TRP B 177
 None
 1.25A 5ljcA-5bnnD:
undetectable		 5ljcA-5bnnD:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5brq GLYCOSIDE HYDROLASE
FAMILY 13

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 LEU A 236
ILE A 260
MET A 314
MET A 255
 None
 1.28A 5ljcA-5brqA:
undetectable		 5ljcA-5brqA:
13.35
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		4 LEU A 232
ILE A 156
THR A 204
MET A 110
 None
 1.46A 5ljcA-5bzaA:
undetectable		 5ljcA-5bzaA:
13.70
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.
5cg0 BETA-GLUCOSIDASE

(Spodoptera
frugiperda) 		PF00232
(Glyco_hydro_1) 		4 ILE A 134
THR A 135
MET A 129
MET A 442
 None
 1.46A 5ljcA-5cg0A:
undetectable		 5ljcA-5cg0A:
13.04
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1

(Pseudomonas
stutzeri) 		PF00115
(COX1) 		4 LEU A 113
ILE A 132
TRP A 128
MET A 187
 None
 1.17A 5ljcA-5djqA:
undetectable		 5ljcA-5djqA:
12.92
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.
5evl BETA-LACTAMASE

(Chromobacterium
violaceum) 		PF00144
(Beta-lactamase) 		4 LEU A 120
LYS A 315
ILE A  66
THR A 316
 None
SO4  A 403 (-3.2A)
None
SO4  A 403 (-4.0A)
 1.41A 5ljcA-5evlA:
1.0		 5ljcA-5evlA:
16.29
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.
5gxf ACRYLYL-COA
REDUCTASE ACUI

(Ruegeria
pomeroyi) 		PF00107
(ADH_zinc_N) 		4 LEU A 141
ILE A 204
THR A 156
MET A 236
 None
 1.21A 5ljcA-5gxfA:
undetectable		 5ljcA-5gxfA:
17.33
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.
5ict GLUTAMATE RECEPTOR 1

(Drosophila
melanogaster) 		PF10613
(Lig_chan-Glu_bd) 		4 LEU A 133
THR A 149
TRP A 165
MET A 168
 None
GLU  A 301 (-3.4A)
None
None
 1.43A 5ljcA-5ictA:
undetectable		 5ljcA-5ictA:
20.30
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.
5jzg CAPSID PROTEIN VP0

(Rhinovirus C) 		PF00073
(Rhv)
PF02226
(Pico_P1A) 		4 LEU C 148
ILE C 311
THR C 176
TRP C 144
 None
 1.22A 5ljcA-5jzgC:
undetectable		 5ljcA-5jzgC:
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.
5k0u CAPSID PROTEIN VP2

(Rhinovirus C) 		PF00073
(Rhv) 		4 LEU C  82
ILE C 245
THR C 110
TRP C  78
 None
 1.24A 5ljcA-5k0uC:
undetectable		 5ljcA-5k0uC:
16.79
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.
5koj NITROGENASE PROTEIN
ALPHA CHAIN

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro) 		4 LEU A 258
ILE A 298
MET A 295
TRP A 269
 None
 1.06A 5ljcA-5kojA:
undetectable		 5ljcA-5kojA:
13.86
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.
5l1b GLUTAMATE RECEPTOR
2,GLUTAMATE RECEPTOR
2

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 LEU A 639
THR A 655
TRP A 671
MET A 674
 None
 1.36A 5ljcA-5l1bA:
0.0		 5ljcA-5l1bA:
11.54
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.
5lad PUTATIVE GTP-BINDING
PROTEIN

(Thermotoga
maritima) 		PF01926
(MMR_HSR1) 		4 LEU A 290
ILE A 384
THR A 383
TRP A 319
 None
 1.22A 5ljcA-5ladA:
undetectable		 5ljcA-5ladA:
15.93
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.
5lad PUTATIVE GTP-BINDING
PROTEIN

(Thermotoga
maritima) 		PF01926
(MMR_HSR1) 		4 LEU A 328
ILE A 384
THR A 383
TRP A 319
 None
 1.20A 5ljcA-5ladA:
undetectable		 5ljcA-5ladA:
15.93
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.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo) 		no annotation 4 LEU A 691
ILE A 649
MET A 722
MET A 698
 None
 1.38A 5ljcA-5m41A:
undetectable		 5ljcA-5m41A:
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.
5tc3 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Eremothecium
gossypii) 		PF00478
(IMPDH)
PF00571
(CBS) 		4 LEU A 203
ILE A 164
THR A 165
MET A 223
 None
None
ATP  A 601 (-2.7A)
GDP  A 602 (-4.7A)
 1.43A 5ljcA-5tc3A:
undetectable		 5ljcA-5tc3A:
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.
5trv DENOVO NTF2

(synthetic
construct) 		PF12680
(SnoaL_2) 		4 LEU A  28
ILE A 106
MET A  88
MET A  50
 None
None
None
PEG  A 201 (-3.5A)
 0.89A 5ljcA-5trvA:
undetectable		 5ljcA-5trvA:
23.74
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.
5wug BETA-GLUCOSIDASE

(Paenibacillus
barengoltzii) 		no annotation 4 LEU A 632
ILE A 162
MET A 203
TRP A 213
 None
 1.45A 5ljcA-5wugA:
undetectable		 5ljcA-5wugA:
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.
5x9w DNA MISMATCH REPAIR
PROTEIN MUTS

(Neisseria
gonorrhoeae) 		no annotation 4 LEU A 279
ILE A 646
THR A 648
MET A 265
 None
 0.85A 5ljcA-5x9wA:
undetectable		 5ljcA-5x9wA:
9.42
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.
5xap PROTEIN TRANSLOCASE
SUBUNIT SECD

(Deinococcus
radiodurans) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG) 		4 LEU A  76
ILE A 430
THR A 427
MET A  70
 None
 0.99A 5ljcA-5xapA:
undetectable		 5ljcA-5xapA:
10.62
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.
5xtd NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Homo sapiens) 		PF15879
(MWFE) 		4 LEU s 162
ILE s  81
THR s 108
MET s 233
 None
 1.17A 5ljcA-5xtds:
undetectable		 5ljcA-5xtds:
16.25
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.
6emz INT PROTEIN

(Enterococcus
faecalis) 		no annotation 4 LEU A 200
ILE A 244
THR A 222
MET A 274
 None
 1.12A 5ljcA-6emzA:
undetectable		 5ljcA-6emzA:
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
4

(Mus musculus;
Mus musculus) 		no annotation
no annotation 		4 LEU L 216
MET M 383
TRP L 196
MET L 137
 None
 1.46A 5ljcA-6g2jL:
undetectable		 5ljcA-6g2jL:
undetectable