SIMILAR PATTERNS OF AMINO ACIDS FOR 4XJ7_A_ADNA303_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.
1cp9 PENICILLIN G AMIDASE

(Providencia
rettgeri) 		PF01804
(Penicil_amidase) 		5 TYR A  94
ALA A  32
ILE B  35
LEU B  37
TYR B  33
 None
 1.10A 4xj7A-1cp9A:
undetectable
4xj7B-1cp9A:
undetectable		 4xj7A-1cp9A:
17.65
4xj7B-1cp9A:
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.
1dj0 PSEUDOURIDINE
SYNTHASE I

(Escherichia
coli) 		PF01416
(PseudoU_synth_1) 		5 GLY A 215
ALA A 240
ILE A 122
LEU A 143
TYR A 120
 None
 1.03A 4xj7A-1dj0A:
undetectable
4xj7B-1dj0A:
undetectable		 4xj7A-1dj0A:
23.02
4xj7B-1dj0A:
23.02
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.
1e4y ADENYLATE KINASE

(Escherichia
coli) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 GLY A   7
ALA A  93
ILE A   4
LEU A   6
TYR A 182
 None
 1.16A 4xj7A-1e4yA:
2.9
4xj7B-1e4yA:
2.8		 4xj7A-1e4yA:
24.73
4xj7B-1e4yA:
24.73
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.
1gp1 GLUTATHIONE
PEROXIDASE

(Bos taurus) 		PF00255
(GSHPx) 		5 GLY A  63
ASN A 104
ILE A 188
LEU A  62
LEU A  67
 None
 1.21A 4xj7A-1gp1A:
undetectable
4xj7B-1gp1A:
undetectable		 4xj7A-1gp1A:
23.67
4xj7B-1gp1A:
23.67
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.
1lfw PEPV

(Lactobacillus
delbrueckii) 		PF01546
(Peptidase_M20) 		5 GLY A 150
ASP A 120
ALA A 127
PRO A 176
LEU A 149
 None
ZN  A1002 ( 4.8A)
None
None
None
 1.11A 4xj7A-1lfwA:
undetectable
4xj7B-1lfwA:
undetectable		 4xj7A-1lfwA:
21.14
4xj7B-1lfwA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mzr 2,5-DIKETO-D-GLUCONA
TE REDUCTASE A

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 GLY A  59
ASN A  28
ILE A  74
LEU A  62
LEU A  97
 None
 1.12A 4xj7A-1mzrA:
undetectable
4xj7B-1mzrA:
undetectable		 4xj7A-1mzrA:
22.94
4xj7B-1mzrA:
22.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nkq HYPOTHETICAL 28.8
KDA PROTEIN IN
PSD1-SKO1 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF01557
(FAA_hydrolase) 		5 TYR A   3
ILE A  44
PRO A  73
LEU A   6
LEU A  66
 None
 1.19A 4xj7A-1nkqA:
undetectable
4xj7B-1nkqA:
undetectable		 4xj7A-1nkqA:
23.21
4xj7B-1nkqA:
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.
1nvm 4-HYDROXY-2-OXOVALER
ATE ALDOLASE

(Pseudomonas sp.
CF600) 		PF00682
(HMGL-like)
PF07836
(DmpG_comm) 		5 GLY A  54
ASP A  18
ALA A 169
LEU A  88
LEU A  90
 None
MN  A3504 ( 2.7A)
OXL  A3508 ( 4.0A)
None
None
 1.15A 4xj7A-1nvmA:
undetectable
4xj7B-1nvmA:
undetectable		 4xj7A-1nvmA:
22.61
4xj7B-1nvmA:
22.61
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.
1o5o URACIL
PHOSPHORIBOSYLTRANSF
ERASE

(Thermotoga
maritima) 		PF14681
(UPRTase) 		5 GLY A 199
ALA A 159
ILE A 161
PRO A 132
LEU A 198
 None
 1.16A 4xj7A-1o5oA:
2.7
4xj7B-1o5oA:
undetectable		 4xj7A-1o5oA:
25.35
4xj7B-1o5oA:
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.
1qqe VESICULAR TRANSPORT
PROTEIN SEC17

(Saccharomyces
cerevisiae) 		PF14938
(SNAP) 		5 GLY A 206
ALA A 247
ILE A 280
LEU A 210
LEU A 207
 None
 1.13A 4xj7A-1qqeA:
undetectable
4xj7B-1qqeA:
undetectable		 4xj7A-1qqeA:
21.57
4xj7B-1qqeA:
21.57
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.
1r6v SUBTILISIN-LIKE
SERINE PROTEASE

(Fervidobacterium
pennivorans) 		PF00082
(Peptidase_S8) 		5 ALA A 376
ILE A 225
LEU A 356
LEU A 143
TYR A 382
 None
 1.13A 4xj7A-1r6vA:
3.1
4xj7B-1r6vA:
3.0		 4xj7A-1r6vA:
20.90
4xj7B-1r6vA:
20.90
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.
1ua2 CELL DIVISION
PROTEIN KINASE 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 265
ALA A 204
ILE A 272
LEU A 268
LEU A 269
 None
 1.21A 4xj7A-1ua2A:
undetectable
4xj7B-1ua2A:
undetectable		 4xj7A-1ua2A:
20.87
4xj7B-1ua2A:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vls ASPARTATE RECEPTOR

(Salmonella
enterica) 		PF02203
(TarH) 		5 GLY A 162
ALA A 100
LEU A 161
LEU A 165
TYR A 127
 None
 1.20A 4xj7A-1vlsA:
undetectable
4xj7B-1vlsA:
undetectable		 4xj7A-1vlsA:
20.42
4xj7B-1vlsA:
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.
1whb KIAA0055

(Homo sapiens) 		PF00581
(Rhodanese) 		5 GLY A 134
TYR A 135
ILE A  35
LEU A  93
LEU A 131
 None
 1.15A 4xj7A-1whbA:
undetectable
4xj7B-1whbA:
undetectable		 4xj7A-1whbA:
20.45
4xj7B-1whbA:
20.45
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.
1yk3 HYPOTHETICAL PROTEIN
RV1347C/MT1389

(Mycobacterium
tuberculosis) 		PF13523
(Acetyltransf_8) 		5 GLY A  44
ALA A 131
ILE A 151
LEU A  45
LEU A  39
 None
 1.16A 4xj7A-1yk3A:
undetectable
4xj7B-1yk3A:
undetectable		 4xj7A-1yk3A:
22.66
4xj7B-1yk3A:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yve ACETOHYDROXY ACID
ISOMEROREDUCTASE

(Spinacia
oleracea) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 GLY I 223
ALA I 297
ILE I 128
LEU I 197
LEU I 195
 None
 0.99A 4xj7A-1yveI:
2.6
4xj7B-1yveI:
2.0		 4xj7A-1yveI:
19.77
4xj7B-1yveI:
19.77
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.
2akz GAMMA ENOLASE

(Homo sapiens) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLY A 154
ASN A 150
ILE A 216
LEU A 162
TYR A 199
 None
 1.19A 4xj7A-2akzA:
undetectable
4xj7B-2akzA:
undetectable		 4xj7A-2akzA:
20.58
4xj7B-2akzA:
20.58
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.
2bvt BETA-1,4-MANNANASE

(Cellulomonas
fimi) 		PF02156
(Glyco_hydro_26) 		5 ALA A 112
ILE A 151
PRO A 172
LEU A 148
LEU A 204
 None
 1.04A 4xj7A-2bvtA:
undetectable
4xj7B-2bvtA:
undetectable		 4xj7A-2bvtA:
22.35
4xj7B-2bvtA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f8a GLUTATHIONE
PEROXIDASE 1

(Homo sapiens) 		PF00255
(GSHPx) 		5 GLY A  65
ASN A 106
ILE A 190
LEU A  64
LEU A  69
 None
 1.22A 4xj7A-2f8aA:
undetectable
4xj7B-2f8aA:
undetectable		 4xj7A-2f8aA:
22.85
4xj7B-2f8aA:
22.85
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.
2i44 SERINE-THREONINE
PHOSPHATASE 2C

(Toxoplasma
gondii) 		PF00481
(PP2C) 		5 GLY A 242
TYR A 142
ILE A 216
LEU A 245
LEU A 250
 None
 1.23A 4xj7A-2i44A:
undetectable
4xj7B-2i44A:
undetectable		 4xj7A-2i44A:
21.26
4xj7B-2i44A:
21.26
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.
2isq CYSTEINE SYNTHASE

(Arabidopsis
thaliana) 		PF00291
(PALP) 		5 TYR A  91
ALA A  57
LEU A  70
LEU A  82
TYR A 143
 None
 1.13A 4xj7A-2isqA:
2.6
4xj7B-2isqA:
2.6		 4xj7A-2isqA:
20.88
4xj7B-2isqA:
20.88
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.
2lig ASPARTATE RECEPTOR

(Salmonella
enterica) 		PF02203
(TarH) 		5 GLY A 162
ALA A 100
LEU A 161
LEU A 165
TYR A 127
 None
 1.20A 4xj7A-2ligA:
undetectable
4xj7B-2ligA:
undetectable		 4xj7A-2ligA:
21.53
4xj7B-2ligA:
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.
2obn HYPOTHETICAL PROTEIN

(Trichormus
variabilis) 		PF07755
(DUF1611)
PF17396
(DUF1611_N) 		5 GLY A  25
ASP A  41
ILE A  55
LEU A  29
LEU A  26
 None
 1.22A 4xj7A-2obnA:
3.7
4xj7B-2obnA:
4.2		 4xj7A-2obnA:
23.90
4xj7B-2obnA:
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.
2otd GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Shigella
flexneri) 		PF03009
(GDPD) 		5 GLY A 166
ASN A 112
ILE A 150
LEU A 167
LEU A 153
 None
 1.20A 4xj7A-2otdA:
undetectable
4xj7B-2otdA:
undetectable		 4xj7A-2otdA:
22.26
4xj7B-2otdA:
22.26
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.
2ox4 PUTATIVE MANDELATE
RACEMASE

(Zymomonas
mobilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A 227
ILE A 241
LEU A 261
LEU A 250
TYR A 238
 None
 1.19A 4xj7A-2ox4A:
undetectable
4xj7B-2ox4A:
undetectable		 4xj7A-2ox4A:
19.42
4xj7B-2ox4A:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p5z TYPE VI SECRETION
SYSTEM COMPONENT

(Escherichia
coli) 		PF05954
(Phage_GPD) 		5 ASN X 458
ALA X 122
ILE X 132
LEU X 176
TYR X 124
 None
 1.22A 4xj7A-2p5zX:
undetectable
4xj7B-2p5zX:
undetectable		 4xj7A-2p5zX:
22.18
4xj7B-2p5zX:
22.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2v4n MULTIFUNCTIONAL
PROTEIN SUR E

(Salmonella
enterica) 		PF01975
(SurE) 		7 GLY A  40
ASN A  96
ASP A 100
TYR A 103
ALA A 182
ILE A 199
PRO A 202
 PO4  A1257 ( 4.2A)
PO4  A1257 (-3.2A)
GOL  A1256 ( 3.7A)
GOL  A1256 ( 4.8A)
GOL  A1256 ( 3.9A)
None
GOL  A1256 ( 4.3A)
 0.72A 4xj7A-2v4nA:
40.6
4xj7B-2v4nA:
40.4		 4xj7A-2v4nA:
99.61
4xj7B-2v4nA:
99.61
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.
2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE

(Bacillus
subtilis) 		PF02156
(Glyco_hydro_26) 		5 GLY A 268
ASN A 307
ALA A 284
ILE A 249
TYR A 289
 None
 0.90A 4xj7A-2whkA:
undetectable
4xj7B-2whkA:
undetectable		 4xj7A-2whkA:
21.73
4xj7B-2whkA:
21.73
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.
2wjs LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1) 		5 GLY A2468
TYR A2465
ALA A2377
LEU A2469
LEU A2372
 None
 1.01A 4xj7A-2wjsA:
undetectable
4xj7B-2wjsA:
undetectable		 4xj7A-2wjsA:
18.40
4xj7B-2wjsA:
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.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLY A 595
TYR A 596
ALA A 591
PRO A 590
LEU A 543
 None
 1.03A 4xj7A-2x40A:
2.8
4xj7B-2x40A:
2.8		 4xj7A-2x40A:
16.76
4xj7B-2x40A:
16.76
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.
2xsx BETA-ENOLASE

(Homo sapiens) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLY A 155
ASN A 151
ILE A 217
LEU A 163
TYR A 200
 None
 1.06A 4xj7A-2xsxA:
undetectable
4xj7B-2xsxA:
undetectable		 4xj7A-2xsxA:
23.12
4xj7B-2xsxA:
23.12
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.
2yc2 INTRAFLAGELLAR
TRANSPORT PROTEIN 25

(Chlamydomonas
reinhardtii) 		no annotation 5 GLY A  11
ASP A   3
TYR A   4
LEU A  51
LEU A  49
 None
 1.16A 4xj7A-2yc2A:
undetectable
4xj7B-2yc2A:
undetectable		 4xj7A-2yc2A:
22.18
4xj7B-2yc2A:
22.18
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.
2ykf PROBABLE SENSOR
HISTIDINE KINASE
PDTAS

(Mycobacterium
tuberculosis) 		PF12282
(H_kinase_N) 		5 GLY A 188
ALA A 197
ILE A 276
LEU A 215
LEU A 184
 BR  A1300 ( 4.2A)
None
None
None
None
 1.16A 4xj7A-2ykfA:
undetectable
4xj7B-2ykfA:
undetectable		 4xj7A-2ykfA:
24.46
4xj7B-2ykfA:
24.46
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.
2ynp COATOMER SUBUNIT
BETA'

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF04053
(Coatomer_WDAD) 		5 GLY A 301
ILE A 254
PRO A 241
LEU A 300
LEU A   3
 None
 1.07A 4xj7A-2ynpA:
undetectable
4xj7B-2ynpA:
undetectable		 4xj7A-2ynpA:
20.20
4xj7B-2ynpA:
20.20
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.
2z7r RIBOSOMAL PROTEIN S6
KINASE ALPHA-1

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 174
ASP A 244
ILE A 193
LEU A 171
LEU A 203
 None
 0.97A 4xj7A-2z7rA:
undetectable
4xj7B-2z7rA:
undetectable		 4xj7A-2z7rA:
22.19
4xj7B-2z7rA:
22.19
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.
3a98 DEDICATOR OF
CYTOKINESIS PROTEIN
2
ENGULFMENT AND CELL
MOTILITY PROTEIN 1

(Homo sapiens) 		PF07653
(SH3_2)
PF16172
(DOCK_N)
PF16457
(PH_12) 		5 GLY A  32
ASN A  18
ILE B 704
PRO B 707
LEU B 701
 None
 0.82A 4xj7A-3a98A:
undetectable
4xj7B-3a98A:
undetectable		 4xj7A-3a98A:
21.43
4xj7B-3a98A:
21.43
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.
3cwc PUTATIVE GLYCERATE
KINASE 2

(Salmonella
enterica) 		PF02595
(Gly_kinase) 		5 ASP A 140
ALA A 256
ILE A 174
LEU A 153
LEU A 171
 None
 1.20A 4xj7A-3cwcA:
5.4
4xj7B-3cwcA:
2.4		 4xj7A-3cwcA:
23.91
4xj7B-3cwcA:
23.91
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.
3ec3 PROTEIN
DISULFIDE-ISOMERASE
A4

(Rattus
norvegicus) 		PF13848
(Thioredoxin_6) 		5 ASP A 403
TYR A 407
ALA A 451
LEU A 412
LEU A 477
 None
 1.11A 4xj7A-3ec3A:
undetectable
4xj7B-3ec3A:
undetectable		 4xj7A-3ec3A:
22.60
4xj7B-3ec3A:
22.60
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.
3efm FERRIC ALCALIGIN
SIDEROPHORE RECEPTOR

(Bordetella
pertussis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 GLY A  71
ASN A 116
ALA A 148
ILE A  80
LEU A  74
 None
 1.14A 4xj7A-3efmA:
undetectable
4xj7B-3efmA:
undetectable		 4xj7A-3efmA:
17.51
4xj7B-3efmA:
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.
3fr8 PUTATIVE KETOL-ACID
REDUCTOISOMERASE
(OS05G0573700
PROTEIN)

(Oryza sativa) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 GLY A 223
ALA A 297
ILE A 128
LEU A 197
LEU A 195
 None
 0.98A 4xj7A-3fr8A:
2.3
4xj7B-3fr8A:
2.2		 4xj7A-3fr8A:
19.58
4xj7B-3fr8A:
19.58
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.
3ge4 DNA PROTECTION
DURING STARVATION
PROTEIN

(Brucella
melitensis) 		PF00210
(Ferritin) 		5 ASN A 123
ALA A 113
ILE A  39
LEU A  36
TYR A 100
 None
 1.20A 4xj7A-3ge4A:
undetectable
4xj7B-3ge4A:
undetectable		 4xj7A-3ge4A:
24.18
4xj7B-3ge4A:
24.18
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.
3gq9 PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		5 GLY A 546
ASP A 542
TYR A 543
ILE A 524
LEU A 547
 None
 1.14A 4xj7A-3gq9A:
undetectable
4xj7B-3gq9A:
undetectable		 4xj7A-3gq9A:
19.24
4xj7B-3gq9A:
19.24
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.
3iby FERROUS IRON
TRANSPORT PROTEIN B

(Legionella
pneumophila) 		PF02421
(FeoB_N) 		5 ASN A   9
ASP A  92
ALA A 123
ILE A 130
LEU A 117
 None
 1.21A 4xj7A-3ibyA:
4.0
4xj7B-3ibyA:
4.5		 4xj7A-3ibyA:
23.08
4xj7B-3ibyA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jcm U4/U6 SMALL NUCLEAR
RIBONUCLEOPROTEIN
PRP4

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 GLY B 281
ASP B 293
ALA B 120
ILE B 336
LEU B 291
 None
 1.09A 4xj7A-3jcmB:
undetectable
4xj7B-3jcmB:
undetectable		 4xj7A-3jcmB:
18.72
4xj7B-3jcmB:
18.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ml0 PENICILLIN G
ACYLASE, ALPHA
SUBUNIT
PENICILLIN G
ACYLASE, BETA
SUBUNIT

(Alcaligenes
faecalis) 		PF01804
(Penicil_amidase) 		5 TYR A  98
ALA A  32
ILE B  35
LEU B  37
TYR B  33
 None
 1.14A 4xj7A-3ml0A:
undetectable
4xj7B-3ml0A:
undetectable		 4xj7A-3ml0A:
19.85
4xj7B-3ml0A:
19.85
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.
3nwr A RUBISCO-LIKE
PROTEIN

(Paraburkholderia
fungorum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 GLY A 126
ASP A 120
TYR A 119
LEU A 297
LEU A  75
 None
 1.11A 4xj7A-3nwrA:
undetectable
4xj7B-3nwrA:
undetectable		 4xj7A-3nwrA:
23.54
4xj7B-3nwrA:
23.54
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.
3o82 PEPTIDE ARYLATION
ENZYME

(Acinetobacter
baumannii) 		PF00501
(AMP-binding) 		5 GLY A 168
ALA A  97
ILE A 130
LEU A 169
LEU A 158
 None
 0.98A 4xj7A-3o82A:
undetectable
4xj7B-3o82A:
undetectable		 4xj7A-3o82A:
20.26
4xj7B-3o82A:
20.26
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.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1) 		PF01663
(Phosphodiest) 		5 GLY A 284
ASP A 334
ALA A 275
ILE A 292
LEU A  42
 None
 1.21A 4xj7A-3q3qA:
undetectable
4xj7B-3q3qA:
undetectable		 4xj7A-3q3qA:
20.36
4xj7B-3q3qA:
20.36
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.
3s6h N-ACETYLGLUTAMATE
KINASE /
N-ACETYLGLUTAMATE
SYNTHASE

(Maricaulis
maris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		5 GLY A  46
ASP A  53
ALA A  60
ILE A  43
PRO A 271
 None
 1.20A 4xj7A-3s6hA:
undetectable
4xj7B-3s6hA:
undetectable		 4xj7A-3s6hA:
22.34
4xj7B-3s6hA:
22.34
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.
3tb4 VIBRIOBACTIN-SPECIFI
C ISOCHORISMATASE

(Vibrio cholerae) 		PF00857
(Isochorismatase) 		5 GLY A 145
ASP A 175
TYR A 147
ILE A  51
LEU A  54
 None
None
BOG  A 501 (-4.1A)
None
None
 1.22A 4xj7A-3tb4A:
3.3
4xj7B-3tb4A:
3.3		 4xj7A-3tb4A:
23.37
4xj7B-3tb4A:
23.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ty2 5'-NUCLEOTIDASE SURE

(Coxiella
burnetii) 		PF01975
(SurE) 		5 GLY A  51
ASN A 106
ASP A 110
TYR A 113
ALA A 194
 None
 0.75A 4xj7A-3ty2A:
35.7
4xj7B-3ty2A:
35.6		 4xj7A-3ty2A:
53.16
4xj7B-3ty2A:
53.16
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.
3v6a APOPTOSIS INHIBITOR
5

(Homo sapiens) 		PF05918
(API5) 		5 ASN A 118
ALA A 129
ILE A 175
LEU A 159
LEU A 155
 None
 1.18A 4xj7A-3v6aA:
undetectable
4xj7B-3v6aA:
undetectable		 4xj7A-3v6aA:
20.25
4xj7B-3v6aA:
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.
3vz0 PUTATIVE
NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF00171
(Aldedh) 		5 GLY A 213
ALA A 158
ILE A 129
PRO A 131
LEU A 206
 None
 1.02A 4xj7A-3vz0A:
2.2
4xj7B-3vz0A:
3.0		 4xj7A-3vz0A:
21.76
4xj7B-3vz0A:
21.76
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.
4aec CYSTEINE SYNTHASE,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF00291
(PALP) 		5 TYR A 199
ALA A 165
LEU A 178
LEU A 190
TYR A 251
 None
 1.23A 4xj7A-4aecA:
undetectable
4xj7B-4aecA:
undetectable		 4xj7A-4aecA:
20.00
4xj7B-4aecA:
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.
4be3 ALGINATE LYASE,
FAMILY PL7

(Zobellia
galactanivorans) 		PF08787
(Alginate_lyase2) 		5 GLY A 297
ALA A  69
ILE A  54
PRO A  42
LEU A 106
 None
 1.23A 4xj7A-4be3A:
undetectable
4xj7B-4be3A:
undetectable		 4xj7A-4be3A:
21.56
4xj7B-4be3A:
21.56
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.
4cs6 AMINOGLYCOSIDE
ADENYLTRANSFERASE

(Salmonella
enterica) 		PF01909
(NTP_transf_2)
PF13427
(DUF4111) 		5 GLY A 233
TYR A 231
ALA A 209
LEU A 232
LEU A 234
 None
 1.20A 4xj7A-4cs6A:
undetectable
4xj7B-4cs6A:
undetectable		 4xj7A-4cs6A:
21.07
4xj7B-4cs6A:
21.07
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.
4dyu DNA PROTECTION
DURING STARVATION
PROTEIN

(Yersinia pestis) 		PF00210
(Ferritin) 		5 ASN A 130
ALA A 120
ILE A  46
LEU A  43
TYR A 107
 None
 1.16A 4xj7A-4dyuA:
undetectable
4xj7B-4dyuA:
undetectable		 4xj7A-4dyuA:
20.70
4xj7B-4dyuA:
20.70
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.
4eco UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		no annotation 5 GLY A 581
TYR A 607
ALA A 653
LEU A 606
TYR A 420
 None
 1.20A 4xj7A-4ecoA:
undetectable
4xj7B-4ecoA:
undetectable		 4xj7A-4ecoA:
17.17
4xj7B-4ecoA:
17.17
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.
4fin ETTA (YJJK) ABCF
FAMILY PROTEIN

(Escherichia
coli) 		PF00005
(ABC_tran)
PF12848
(ABC_tran_Xtn) 		6 GLY A  44
ASP A  56
ALA A  63
ILE A  25
LEU A  48
LEU A  22
 SO4  A 601 (-3.1A)
None
None
None
None
None
 1.40A 4xj7A-4finA:
undetectable
4xj7B-4finA:
undetectable		 4xj7A-4finA:
18.85
4xj7B-4finA:
18.85
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.
4ilg A1 CISTRON-SPLICING
FACTOR AAR2

(Saccharomyces
cerevisiae) 		PF05282
(AAR2) 		5 GLY A 222
ASN A 216
TYR A 220
ILE A 267
LEU A 224
 None
 1.22A 4xj7A-4ilgA:
undetectable
4xj7B-4ilgA:
undetectable		 4xj7A-4ilgA:
16.67
4xj7B-4ilgA:
16.67
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.
4k46 ADENYLATE KINASE

(Photobacterium
profundum) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 GLY A   7
ALA A  93
ILE A   4
LEU A   6
TYR A 182
 None
 1.04A 4xj7A-4k46A:
2.8
4xj7B-4k46A:
3.0		 4xj7A-4k46A:
25.53
4xj7B-4k46A:
25.53
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.
4lma CYSTEINE SYNTHASE

(Microcystis
aeruginosa) 		PF00291
(PALP) 		5 TYR A  91
ALA A  57
LEU A  70
LEU A  82
TYR A 143
 None
 1.12A 4xj7A-4lmaA:
undetectable
4xj7B-4lmaA:
undetectable		 4xj7A-4lmaA:
22.57
4xj7B-4lmaA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mb5 CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18)
PF16403
(DUF5011) 		5 GLY A 226
ASN A 238
ILE A 229
LEU A 227
TYR A 249
 GLY  A 613 (-4.7A)
None
None
None
None
 1.13A 4xj7A-4mb5A:
undetectable
4xj7B-4mb5A:
undetectable		 4xj7A-4mb5A:
19.69
4xj7B-4mb5A:
19.69
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.
4n0q LEU/ILE/VAL-BINDING
PROTEIN HOMOLOG 3

(Brucella
melitensis) 		PF13458
(Peripla_BP_6) 		5 GLY A 228
ASP A 168
ALA A 177
LEU A 250
TYR A 220
 None
 1.12A 4xj7A-4n0qA:
3.2
4xj7B-4n0qA:
3.2		 4xj7A-4n0qA:
24.12
4xj7B-4n0qA:
24.12
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.
4q1j POLYKETIDE
BIOSYNTHESIS
ENOYL-COA ISOMERASE
PKSI

(Bacillus
subtilis) 		PF00378
(ECH_1) 		5 GLY A 167
TYR A 165
ALA A 129
LEU A 170
LEU A 121
 None
EDO  A 303 (-4.8A)
None
None
None
 1.16A 4xj7A-4q1jA:
undetectable
4xj7B-4q1jA:
undetectable		 4xj7A-4q1jA:
24.84
4xj7B-4q1jA:
24.84
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.
4q2b ENDO-1,4-BETA-D-GLUC
ANASE

(Pseudomonas
putida) 		PF01270
(Glyco_hydro_8) 		5 GLY A 141
ALA A  85
ILE A 121
LEU A 144
LEU A 125
 None
 1.12A 4xj7A-4q2bA:
undetectable
4xj7B-4q2bA:
undetectable		 4xj7A-4q2bA:
23.98
4xj7B-4q2bA:
23.98
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.
4qla JUVENILE HORMONE
EPOXIDE HYDROLASE

(Bombyx mori) 		PF06441
(EHN) 		5 GLY A 319
ILE A 366
LEU A 320
LEU A 313
TYR A 360
 None
 1.03A 4xj7A-4qlaA:
3.2
4xj7B-4qlaA:
3.5		 4xj7A-4qlaA:
22.29
4xj7B-4qlaA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rl3 CHITINASE A

(Pteris
ryukyuensis) 		PF00704
(Glyco_hydro_18) 		5 ASN A 169
ASP A 160
ILE A 242
LEU A 230
LEU A 264
 None
 1.07A 4xj7A-4rl3A:
undetectable
4xj7B-4rl3A:
undetectable		 4xj7A-4rl3A:
22.36
4xj7B-4rl3A:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w91 AMINOTRANSFERASE

(Brucella suis) 		PF00266
(Aminotran_5) 		5 GLY A 325
ASN A 335
ALA A 388
LEU A 324
LEU A 330
 None
 1.10A 4xj7A-4w91A:
undetectable
4xj7B-4w91A:
2.6		 4xj7A-4w91A:
23.43
4xj7B-4w91A:
23.43
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.
4y7v NUCLEOTIDYL
TRANSFERASE

(Pseudomonas
putida) 		PF00483
(NTP_transferase) 		5 GLY A  67
ALA A   7
ILE A  34
LEU A  64
LEU A  38
 None
 1.14A 4xj7A-4y7vA:
2.7
4xj7B-4y7vA:
2.7		 4xj7A-4y7vA:
22.79
4xj7B-4y7vA:
22.79
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.
4zps MCG133388, ISOFORM
CRA_M

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		5 ALA A 121
ILE A 113
PRO A 119
LEU A 171
TYR A 123
 None
 1.01A 4xj7A-4zpsA:
undetectable
4xj7B-4zpsA:
undetectable		 4xj7A-4zpsA:
21.87
4xj7B-4zpsA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cd2 ENDO-1,4-D-GLUCANASE

(Aliivibrio
fischeri) 		PF01270
(Glyco_hydro_8) 		5 GLY A 161
ALA A 105
ILE A 141
LEU A 164
LEU A 145
 None
 1.15A 4xj7A-5cd2A:
undetectable
4xj7B-5cd2A:
undetectable		 4xj7A-5cd2A:
21.11
4xj7B-5cd2A:
21.11
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.
5eog PROTEIN MAB-21-LIKE
1

(Homo sapiens) 		PF03281
(Mab-21) 		5 GLY A 297
ILE A 253
LEU A  12
LEU A 300
TYR A  15
 None
 1.17A 4xj7A-5eogA:
undetectable
4xj7B-5eogA:
undetectable		 4xj7A-5eogA:
20.98
4xj7B-5eogA:
20.98
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.
5fsg MALTOSE-BINDING
PERIPLASMIC PROTEIN,
HANTAVIRUS
NUCLEOPROTEIN

(Hantaan
orthohantavirus) 		PF00846
(Hanta_nucleocap)
PF13416
(SBP_bac_8) 		5 GLY A 204
TYR A 206
ALA A 291
ILE A 123
LEU A 205
 None
 1.23A 4xj7A-5fsgA:
undetectable
4xj7B-5fsgA:
undetectable		 4xj7A-5fsgA:
17.82
4xj7B-5fsgA:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g3y ADENYLATE KINSE

(synthetic
construct) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 GLY A   7
ALA A  93
ILE A   4
LEU A   6
TYR A 186
 None
 1.08A 4xj7A-5g3yA:
2.5
4xj7B-5g3yA:
2.3		 4xj7A-5g3yA:
23.37
4xj7B-5g3yA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gs0 TOLL-LIKE RECEPTOR 3

(Homo sapiens) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		5 GLY A 594
ASN A 645
ALA A 633
ILE A 591
LEU A 593
 None
 1.12A 4xj7A-5gs0A:
undetectable
4xj7B-5gs0A:
undetectable		 4xj7A-5gs0A:
15.48
4xj7B-5gs0A:
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.
5gwe CYTOCHROME P450

(Corynebacterium
glutamicum) 		PF00067
(p450) 		5 GLY A 341
ASN A 440
PRO A  58
LEU A 366
LEU A 364
 None
 1.15A 4xj7A-5gweA:
undetectable
4xj7B-5gweA:
undetectable		 4xj7A-5gweA:
21.88
4xj7B-5gweA:
21.88
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18) 		5 ASP B 687
ALA B 739
ILE B 754
LEU B 758
LEU B 715
 None
 1.18A 4xj7A-5gztB:
undetectable
4xj7B-5gztB:
undetectable		 4xj7A-5gztB:
13.09
4xj7B-5gztB:
13.09
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.
5gzu CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18) 		5 ASP A 687
ALA A 739
ILE A 754
LEU A 758
LEU A 715
 None
 1.18A 4xj7A-5gzuA:
undetectable
4xj7B-5gzuA:
undetectable		 4xj7A-5gzuA:
15.39
4xj7B-5gzuA:
15.39
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.
5hab RIBONUCLEASE J

(Methanolobus
psychrophilus) 		PF07521
(RMMBL)
PF12706
(Lactamase_B_2) 		5 GLY A  89
ASN A  18
ASP A  32
ALA A 104
ILE A 112
 None
 1.22A 4xj7A-5habA:
undetectable
4xj7B-5habA:
undetectable		 4xj7A-5habA:
22.88
4xj7B-5habA:
22.88
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.
5ik8 LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2) 		5 GLY A2885
TYR A2882
ALA A2802
LEU A2886
LEU A2797
 None
 0.97A 4xj7A-5ik8A:
undetectable
4xj7B-5ik8A:
undetectable		 4xj7A-5ik8A:
22.51
4xj7B-5ik8A:
22.51
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.
5lnk MITOCHONDRIAL
COMPLEX I, 39 KDA
SUBUNIT

(Ovis aries) 		no annotation 5 GLY d  31
ALA d 217
ILE d  92
LEU d  34
LEU d  94
 None
None
None
None
NDP  d 401 ( 4.7A)
 1.17A 4xj7A-5lnkd:
4.4
4xj7B-5lnkd:
4.2		 4xj7A-5lnkd:
21.45
4xj7B-5lnkd:
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.
5mc9 LAMININ SUBUNIT
ALPHA-1

(Mus musculus) 		PF00054
(Laminin_G_1)
PF06009
(Laminin_II) 		5 GLY A2446
TYR A2443
ALA A2354
LEU A2447
LEU A2349
 None
 0.94A 4xj7A-5mc9A:
undetectable
4xj7B-5mc9A:
undetectable		 4xj7A-5mc9A:
16.51
4xj7B-5mc9A:
16.51
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.
5oh5 RIDL

(Legionella
pneumophila) 		no annotation 5 GLY A 119
ASP A 124
ALA A 130
LEU A 120
LEU A 150
 None
 1.02A 4xj7A-5oh5A:
undetectable
4xj7B-5oh5A:
undetectable		 4xj7A-5oh5A:
19.42
4xj7B-5oh5A:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oy0 PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1

(Synechocystis
sp. PCC 6803) 		no annotation 5 ASP 1 292
ALA 1 503
ILE 1 514
LEU 1 281
TYR 1 507
 None
 1.22A 4xj7A-5oy01:
undetectable
4xj7B-5oy01:
undetectable		 4xj7A-5oy01:
15.89
4xj7B-5oy01:
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.
5szm PCDHGA8 OR
PROTOCADHERIN GAMMA
A8

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		5 ALA A 121
ILE A 113
PRO A 119
LEU A 171
TYR A 123
 None
 1.02A 4xj7A-5szmA:
undetectable
4xj7B-5szmA:
undetectable		 4xj7A-5szmA:
19.67
4xj7B-5szmA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5szn PROTOCADHERIN GAMMA
A9

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		5 ALA A 122
ILE A 114
PRO A 120
LEU A 172
TYR A 124
 None
 1.02A 4xj7A-5sznA:
undetectable
4xj7B-5sznA:
undetectable		 4xj7A-5sznA:
20.79
4xj7B-5sznA:
20.79
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.
5umf RIBULOSE-PHOSPHATE
3-EPIMERASE

(Neisseria
gonorrhoeae) 		PF00834
(Ribul_P_3_epim) 		5 GLY A 113
ALA A  94
ILE A  98
LEU A 114
LEU A 102
 None
 1.20A 4xj7A-5umfA:
undetectable
4xj7B-5umfA:
undetectable		 4xj7A-5umfA:
25.96
4xj7B-5umfA:
25.96
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.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		5 GLY A 106
ILE A 174
LEU A 107
LEU A 165
TYR A 176
 None
 1.15A 4xj7A-5v1wA:
undetectable
4xj7B-5v1wA:
undetectable		 4xj7A-5v1wA:
17.12
4xj7B-5v1wA:
17.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5van BETA-KLOTHO

(Homo sapiens) 		no annotation 5 GLY A 171
TYR A 174
ALA A  93
ILE A 153
LEU A 158
 None
 1.19A 4xj7A-5vanA:
undetectable
4xj7B-5vanA:
undetectable		 4xj7A-5vanA:
13.86
4xj7B-5vanA:
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.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36

(Bos taurus) 		no annotation 5 GLY A 571
ASN A 502
ALA A 479
ILE A 403
LEU A 616
 None
 1.08A 4xj7A-5vhaA:
undetectable
4xj7B-5vhaA:
undetectable		 4xj7A-5vhaA:
13.03
4xj7B-5vhaA:
13.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wi9 -

(-) 		no annotation 5 GLY A 171
TYR A 174
ALA A  93
ILE A 153
LEU A 158
 None
 1.21A 4xj7A-5wi9A:
undetectable
4xj7B-5wi9A:
undetectable		 4xj7A-5wi9A:
undetectable
4xj7B-5wi9A:
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.
5wyh INTERAPTIN

(Legionella
pneumophila) 		no annotation 5 GLY B 119
ASP B 124
ALA B 130
LEU B 120
LEU B 150
 None
 1.01A 4xj7A-5wyhB:
undetectable
4xj7B-5wyhB:
undetectable		 4xj7A-5wyhB:
13.16
4xj7B-5wyhB:
13.16
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.
5xep CHITINASE-3-LIKE
PROTEIN 1

(Mus musculus) 		no annotation 5 ASN A 237
TYR A 244
ALA A 185
LEU A 204
TYR A 190
 None
 1.22A 4xj7A-5xepA:
undetectable
4xj7B-5xepA:
undetectable		 4xj7A-5xepA:
14.62
4xj7B-5xepA:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xjn CYTOCHROME P450

(Corynebacterium
glutamicum) 		PF00067
(p450) 		5 GLY A 314
ASN A 413
PRO A  31
LEU A 339
LEU A 337
 None
 1.16A 4xj7A-5xjnA:
undetectable
4xj7B-5xjnA:
undetectable		 4xj7A-5xjnA:
22.13
4xj7B-5xjnA:
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.
5xmr SERINE
HYDROXYMETHYLTRANSFE
RASE

(Plasmodium
vivax) 		no annotation 5 GLY A 369
ASN A 354
ALA A 397
ILE A 337
LEU A 332
 None
8AO  A 502 ( 4.4A)
None
None
None
 1.23A 4xj7A-5xmrA:
undetectable
4xj7B-5xmrA:
undetectable		 4xj7A-5xmrA:
21.49
4xj7B-5xmrA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c3p ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8

(Homo sapiens) 		no annotation 5 GLY E 448
ILE E 455
PRO E 317
LEU E 451
LEU E 452
 None
 1.22A 4xj7A-6c3pE:
undetectable
4xj7B-6c3pE:
undetectable		 4xj7A-6c3pE:
14.23
4xj7B-6c3pE:
14.23
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.
6dft -

(-) 		no annotation 5 GLY B  46
ASN B  33
TYR B  35
ILE B 320
LEU B  45
 None
 1.11A 4xj7A-6dftB:
undetectable
4xj7B-6dftB:
undetectable		 4xj7A-6dftB:
undetectable
4xj7B-6dftB:
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.
6dw1 -

(-) 		no annotation 5 GLY C 124
ILE C  93
PRO C  31
LEU C  74
LEU C 126
 None
 1.20A 4xj7A-6dw1C:
undetectable
4xj7B-6dw1C:
undetectable		 4xj7A-6dw1C:
undetectable
4xj7B-6dw1C:
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.
6eoj PROTEIN CFT1

(Saccharomyces
cerevisiae) 		no annotation 5 GLY A  64
ASP A 126
ILE A  85
LEU A  77
LEU A 123
 None
 1.20A 4xj7A-6eojA:
undetectable
4xj7B-6eojA:
undetectable		 4xj7A-6eojA:
10.99
4xj7B-6eojA:
10.99