SIMILAR PATTERNS OF AMINO ACIDS FOR 3H0A_A_9RAA500

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.
1dbi AK.1 SERINE PROTEASE

(Bacillus sp.
Ak1) 		PF00082
(Peptidase_S8) 		5 ALA A 236
ALA A 233
ALA A 237
VAL A 148
ILE A 120
 None
 0.97A 3h0aA-1dbiA:
undetectable		 3h0aA-1dbiA:
19.93
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.
1e19 CARBAMATE KINASE

(Pyrococcus
furiosus) 		PF00696
(AA_kinase) 		5 ALA A  34
LEU A  97
ALA A  96
VAL A   5
LEU A 234
 None
 0.94A 3h0aA-1e19A:
undetectable		 3h0aA-1e19A:
21.70
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.
1e32 P97

(Mus musculus) 		PF00004
(AAA)
PF02359
(CDC48_N)
PF02933
(CDC48_2) 		5 ALA A 259
ALA A 257
VAL A 367
ILE A 369
LEU A 213
 None
 0.99A 3h0aA-1e32A:
undetectable		 3h0aA-1e32A:
20.39
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT

(Methanopyrus
kandleri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 ALA A 307
GLN A 496
ALA A 500
VAL A 380
LEU A 346
 None
 0.88A 3h0aA-1e6vA:
undetectable		 3h0aA-1e6vA:
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.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		6 ALA B2205
ALA B2393
LEU B2397
ALA B2396
VAL B2265
ILE B2262
 OCS  C3065 ( 3.6A)
None
None
None
None
None
 1.44A 3h0aA-1e6yB:
undetectable		 3h0aA-1e6yB:
19.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hg4 ULTRASPIRACLE

(Drosophila
melanogaster) 		PF00104
(Hormone_recep) 		5 TRP A 318
LEU A 322
VAL A 382
ILE A 385
LEU A 476
 None
LPP  A   1 ( 4.8A)
LPP  A   1 (-4.8A)
None
LPP  A   1 (-4.2A)
 0.74A 3h0aA-1hg4A:
23.1		 3h0aA-1hg4A:
42.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hg4 ULTRASPIRACLE

(Drosophila
melanogaster) 		PF00104
(Hormone_recep) 		5 TRP A 318
LEU A 366
VAL A 382
ILE A 385
LEU A 476
 None
LPP  A   1 ( 4.4A)
LPP  A   1 (-4.8A)
None
LPP  A   1 (-4.2A)
 0.78A 3h0aA-1hg4A:
23.1		 3h0aA-1hg4A:
42.35
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.
1ofi ATP-DEPENDENT
PROTEASE HSLV

(Haemophilus
influenzae) 		PF00227
(Proteasome) 		5 ALA G  93
ALA G  47
LEU G  56
ALA G  53
VAL G 113
 None
LVS  G   0 (-4.9A)
None
LVS  G   0 ( 4.2A)
None
 0.98A 3h0aA-1ofiG:
undetectable		 3h0aA-1ofiG:
20.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
LEU A 387
ARG A 394
VAL A 418
LEU A 525
 EST  A   1 ( 3.7A)
EST  A   1 (-4.0A)
EST  A   1 (-3.7A)
None
EST  A   1 (-3.6A)
 0.92A 3h0aA-1pcgA:
23.4		 3h0aA-1pcgA:
31.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
TRP A 383
ARG A 394
ILE A 424
LEU A 525
 EST  A   1 ( 3.7A)
None
EST  A   1 (-3.7A)
EST  A   1 ( 4.5A)
EST  A   1 (-3.6A)
 0.95A 3h0aA-1pcgA:
23.4		 3h0aA-1pcgA:
31.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
TRP A 383
LEU A 387
ARG A 394
LEU A 525
 EST  A   1 ( 3.7A)
None
EST  A   1 (-4.0A)
EST  A   1 (-3.7A)
EST  A   1 (-3.6A)
 0.86A 3h0aA-1pcgA:
23.4		 3h0aA-1pcgA:
31.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r20 ULTRASPIRACLE
PROTEIN

(Heliothis
virescens) 		PF00104
(Hormone_recep) 		8 GLN A 256
TRP A 286
LEU A 290
ARG A 297
LEU A 325
VAL A 341
ILE A 344
LEU A 435
 None
None
EPH  A4000 ( 4.8A)
None
None
EPH  A4000 (-4.9A)
EPH  A4000 ( 4.1A)
EPH  A4000 ( 4.6A)
 1.04A 3h0aA-1r20A:
23.1		 3h0aA-1r20A:
45.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 ALA A 342
ALA A 343
GLN A 346
TRP A 376
LEU A 380
ARG A 387
LEU A 397
ALA A 398
VAL A 413
LEU A 507
 MEI  A1001 (-3.1A)
MEI  A1001 (-3.3A)
None
None
MEI  A1001 (-3.8A)
MEI  A1001 (-3.6A)
MEI  A1001 ( 4.4A)
MEI  A1001 (-3.4A)
MEI  A1001 (-4.1A)
MEI  A1001 (-4.6A)
 0.79A 3h0aA-1uhlA:
32.0		 3h0aA-1uhlA:
88.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 ALA A 342
ALA A 343
TRP A 376
LEU A 380
ARG A 387
LEU A 397
ALA A 398
VAL A 413
ILE A 416
LEU A 507
 MEI  A1001 (-3.1A)
MEI  A1001 (-3.3A)
None
MEI  A1001 (-3.8A)
MEI  A1001 (-3.6A)
MEI  A1001 ( 4.4A)
MEI  A1001 (-3.4A)
MEI  A1001 (-4.1A)
None
MEI  A1001 (-4.6A)
 0.83A 3h0aA-1uhlA:
32.0		 3h0aA-1uhlA:
88.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 ALA A 342
LEU A 380
ARG A 387
LEU A 397
VAL A 413
ILE A 416
CYH A 503
 MEI  A1001 (-3.1A)
MEI  A1001 (-3.8A)
MEI  A1001 (-3.6A)
MEI  A1001 ( 4.4A)
MEI  A1001 (-4.1A)
None
MEI  A1001 (-4.0A)
 0.96A 3h0aA-1uhlA:
32.0		 3h0aA-1uhlA:
88.70
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.
1xa0 PUTATIVE NADPH
DEPENDENT
OXIDOREDUCTASES

(Geobacillus
stearothermophilus) 		PF00107
(ADH_zinc_N) 		6 ALA A 134
ALA A 135
LEU A 291
LEU A 165
ALA A 166
ILE A  87
 None
 1.39A 3h0aA-1xa0A:
undetectable		 3h0aA-1xa0A:
24.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		6 ALA A 245
ALA A 246
GLN A 249
TRP A 279
ARG A 290
ILE A 402
 9CR  A 201 (-3.6A)
9CR  A 201 (-3.6A)
9CR  A 201 (-4.1A)
None
9CR  A 201 (-2.8A)
None
 1.28A 3h0aA-1xiuA:
29.4		 3h0aA-1xiuA:
82.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		10 ALA A 245
ALA A 246
GLN A 249
TRP A 279
LEU A 283
ARG A 290
LEU A 300
VAL A 316
ILE A 319
LEU A 410
 9CR  A 201 (-3.6A)
9CR  A 201 (-3.6A)
9CR  A 201 (-4.1A)
None
9CR  A 201 ( 4.1A)
9CR  A 201 (-2.8A)
9CR  A 201 (-4.4A)
9CR  A 201 (-4.2A)
None
9CR  A 201 ( 4.8A)
 0.69A 3h0aA-1xiuA:
29.4		 3h0aA-1xiuA:
82.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		8 ALA A 245
ALA A 246
LEU A 283
ARG A 290
LEU A 300
VAL A 316
ILE A 319
CYH A 406
 9CR  A 201 (-3.6A)
9CR  A 201 (-3.6A)
9CR  A 201 ( 4.1A)
9CR  A 201 (-2.8A)
9CR  A 201 (-4.4A)
9CR  A 201 (-4.2A)
None
9CR  A 201 (-3.6A)
 0.75A 3h0aA-1xiuA:
29.4		 3h0aA-1xiuA:
82.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		9 ALA A 245
GLN A 249
LEU A 283
ARG A 290
LEU A 300
ALA A 301
VAL A 316
ILE A 319
LEU A 410
 9CR  A 201 (-3.6A)
9CR  A 201 (-4.1A)
9CR  A 201 ( 4.1A)
9CR  A 201 (-2.8A)
9CR  A 201 (-4.4A)
9CR  A 201 (-3.4A)
9CR  A 201 (-4.2A)
None
9CR  A 201 ( 4.8A)
 0.71A 3h0aA-1xiuA:
29.4		 3h0aA-1xiuA:
82.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 ALA A 271
ALA A 272
GLN A 275
ARG A 316
LEU A 326
ALA A 327
ILE A 428
 9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.7A)
9CR  A 801 (-2.6A)
9CR  A 801 (-4.1A)
9CR  A 801 (-3.3A)
None
 1.30A 3h0aA-1xlsA:
31.5		 3h0aA-1xlsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 ALA A 271
ALA A 272
GLN A 275
TRP A 305
LEU A 309
ARG A 316
LEU A 326
ALA A 327
VAL A 342
ILE A 345
LEU A 436
 9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.7A)
None
9CR  A 801 (-4.2A)
9CR  A 801 (-2.6A)
9CR  A 801 (-4.1A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 4.5A)
9CR  A 801 (-4.7A)
 0.71A 3h0aA-1xlsA:
31.5		 3h0aA-1xlsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 ALA A 271
ALA A 272
LEU A 309
ARG A 316
LEU A 326
ALA A 327
VAL A 342
ILE A 345
CYH A 432
 9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.2A)
9CR  A 801 (-2.6A)
9CR  A 801 (-4.1A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 4.5A)
9CR  A 801 ( 3.7A)
 0.81A 3h0aA-1xlsA:
31.5		 3h0aA-1xlsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 ALA A 271
GLN A 275
ARG A 316
ALA A 327
VAL A 342
ILE A 345
 9CR  A 801 (-3.6A)
9CR  A 801 (-4.7A)
9CR  A 801 (-2.6A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 4.5A)
 1.44A 3h0aA-1xlsA:
31.5		 3h0aA-1xlsA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z6o FERRITIN HEAVY CHAIN
FERRITIN LIGHT CHAIN

(Trichoplusia ni) 		PF00210
(Ferritin) 		5 ALA A  59
ALA A  60
LEU M  79
VAL M  33
LEU M  91
 None
 0.92A 3h0aA-1z6oA:
undetectable		 3h0aA-1z6oA:
20.49
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.
1z6r MLC PROTEIN

(Escherichia
coli) 		PF00480
(ROK) 		5 ALA A 388
ALA A 387
LEU A 205
ALA A 202
VAL A  80
 None
 0.98A 3h0aA-1z6rA:
undetectable		 3h0aA-1z6rA:
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.
1z6t APOPTOTIC PROTEASE
ACTIVATING FACTOR 1

(Homo sapiens) 		PF00619
(CARD)
PF00931
(NB-ARC) 		5 ALA A 223
LEU A 230
LEU A 199
ILE A 260
CYH A 258
 None
 0.85A 3h0aA-1z6tA:
undetectable		 3h0aA-1z6tA:
18.63
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.
1zkj EXTENDED-SPECTRUM
BETA-LACTAMASE

(Klebsiella
aerogenes) 		PF00144
(Beta-lactamase) 		5 ALA A 163
ALA A 164
LEU A 174
ALA A  78
ILE A 225
 None
 1.00A 3h0aA-1zkjA:
undetectable		 3h0aA-1zkjA:
22.45
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.
2bgk RHIZOME
SECOISOLARICIRESINOL
DEHYDROGENASE

(Podophyllum
peltatum) 		PF13561
(adh_short_C2) 		5 ALA A 136
ALA A 133
LEU A 181
ALA A 137
VAL A 240
 None
 0.99A 3h0aA-2bgkA:
undetectable		 3h0aA-2bgkA:
22.49
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.
2coc FYVE, RHOGEF AND PH
DOMAIN CONTAINING
PROTEIN 3

(Homo sapiens) 		no annotation 5 ALA A  88
GLN A  94
LEU A  98
LEU A  93
LEU A  38
 None
 0.76A 3h0aA-2cocA:
undetectable		 3h0aA-2cocA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA A  57
ALA A  58
LEU A   5
ALA A  29
LEU A 171
 None
 0.71A 3h0aA-2dpnA:
undetectable		 3h0aA-2dpnA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA A  57
ALA A  58
LEU A   5
ALA A  29
VAL A 163
 None
 0.88A 3h0aA-2dpnA:
undetectable		 3h0aA-2dpnA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f46 HYPOTHETICAL PROTEIN

(Neisseria
meningitidis) 		PF04273
(DUF442) 		5 ALA A 136
ALA A 139
VAL A  90
ILE A  85
LEU A 150
 None
 0.88A 3h0aA-2f46A:
undetectable		 3h0aA-2f46A:
21.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gl8 RETINOIC ACID
RECEPTOR RXR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 LEU A  88
ARG A  95
LEU A 105
VAL A 121
ILE A 124
CYH A 211
 None
 1.01A 3h0aA-2gl8A:
25.7		 3h0aA-2gl8A:
88.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gl8 RETINOIC ACID
RECEPTOR RXR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 TRP A  84
LEU A  88
ARG A  95
LEU A 105
VAL A 121
ILE A 124
 None
 0.86A 3h0aA-2gl8A:
25.7		 3h0aA-2gl8A:
88.60
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.
2gp4 6-PHOSPHOGLUCONATE
DEHYDRATASE

(Shewanella
oneidensis) 		PF00920
(ILVD_EDD) 		5 LEU A 366
LEU A 295
ALA A 296
VAL A 318
ILE A  12
 None
 0.83A 3h0aA-2gp4A:
undetectable		 3h0aA-2gp4A:
17.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
LEU A 387
ARG A 394
VAL A 418
LEU A 525
 EST  A 596 ( 3.9A)
EST  A 596 ( 4.2A)
EST  A 596 (-4.0A)
CME  A 417 ( 3.2A)
EST  A 596 (-3.6A)
 0.99A 3h0aA-2ocfA:
23.5		 3h0aA-2ocfA:
30.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
TRP A 383
LEU A 387
ARG A 394
LEU A 525
 EST  A 596 ( 3.9A)
None
EST  A 596 ( 4.2A)
EST  A 596 (-4.0A)
EST  A 596 (-3.6A)
 0.97A 3h0aA-2ocfA:
23.5		 3h0aA-2ocfA:
30.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q60 RETINOID X RECEPTOR

(Polyandrocarpa
misakiensis) 		PF00104
(Hormone_recep) 		6 LEU A 184
ARG A 191
ALA A 202
VAL A 217
ILE A 220
CYH A 307
 None
 1.06A 3h0aA-2q60A:
25.0		 3h0aA-2q60A:
71.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q60 RETINOID X RECEPTOR

(Polyandrocarpa
misakiensis) 		PF00104
(Hormone_recep) 		6 TRP A 180
LEU A 184
ARG A 191
ALA A 202
VAL A 217
ILE A 220
 None
 0.99A 3h0aA-2q60A:
25.0		 3h0aA-2q60A:
71.65
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.
2qyg RIBULOSE
BISPHOSPHATE
CARBOXYLASE-LIKE
PROTEIN 2

(Rhodopseudomonas
palustris) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 ALA A 416
ALA A 417
ARG A 427
LEU A 426
ALA A 423
 None
 0.91A 3h0aA-2qygA:
undetectable		 3h0aA-2qygA:
17.66
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.
2v84 SPERMIDINE/PUTRESCIN
E ABC TRANSPORTER,
PERIPLASMIC BINDING
PROTEIN

(Treponema
pallidum) 		PF13416
(SBP_bac_8) 		5 ALA A 174
ALA A 175
LEU A 156
ALA A 155
ILE A 312
 None
 1.00A 3h0aA-2v84A:
undetectable		 3h0aA-2v84A:
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.
2vml PHYCOCYANIN ALPHA
CHAIN
PHYCOCYANIN BETA
CHAIN

(Gloeobacter
violaceus) 		PF00502
(Phycobilisome) 		5 ALA A  40
ALA A  41
ALA A 150
VAL B  31
LEU B  24
 None
 0.87A 3h0aA-2vmlA:
2.7		 3h0aA-2vmlA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xgt ASPARAGINYL-TRNA
SYNTHETASE,
CYTOPLASMIC

(Brugia malayi) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 ALA A 250
ALA A 251
LEU A 527
ALA A 370
LEU A 520
 None
 0.97A 3h0aA-2xgtA:
undetectable		 3h0aA-2xgtA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis) 		PF01593
(Amino_oxidase) 		6 ALA A 374
LEU A 363
LEU A 338
ALA A 299
VAL A  89
ILE A  91
 None
 1.28A 3h0aA-2yg6A:
undetectable		 3h0aA-2yg6A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yjn GLYCOSYLTRANSFERASE

(Saccharopolyspora
erythraea) 		PF06722
(DUF1205) 		5 ALA A 156
ALA A 157
LEU A 132
ILE A  63
LEU A  37
 None
 0.99A 3h0aA-2yjnA:
undetectable		 3h0aA-2yjnA:
19.27
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.
2zo4 METALLO-BETA-LACTAMA
SE FAMILY PROTEIN

(Thermus
thermophilus) 		PF00753
(Lactamase_B) 		5 ALA A  45
LEU A  40
VAL A  63
ILE A  66
LEU A  24
 None
 0.94A 3h0aA-2zo4A:
undetectable		 3h0aA-2zo4A:
23.96
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.
3au7 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Archaeoglobus
fulgidus) 		PF01336
(tRNA_anti-codon)
PF08489
(DUF1743) 		5 ALA A 148
ALA A  58
ALA A 147
VAL A  75
ILE A  79
 None
 0.99A 3h0aA-3au7A:
undetectable		 3h0aA-3au7A:
18.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		8 ALA A 271
ALA A 272
GLN A 275
TRP A 305
LEU A 309
ARG A 316
LEU A 326
LEU A 436
 9CR  A7223 (-3.5A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.6A)
None
9CR  A7223 ( 4.4A)
9CR  A7223 (-3.7A)
9CR  A7223 (-3.8A)
9CR  A7223 ( 4.7A)
 0.78A 3h0aA-3dzuA:
31.5		 3h0aA-3dzuA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		9 ALA A 271
ALA A 272
TRP A 305
LEU A 309
ARG A 316
LEU A 326
VAL A 342
ILE A 345
LEU A 436
 9CR  A7223 (-3.5A)
9CR  A7223 (-4.2A)
None
9CR  A7223 ( 4.4A)
9CR  A7223 (-3.7A)
9CR  A7223 (-3.8A)
9CR  A7223 ( 4.5A)
9CR  A7223 ( 4.9A)
9CR  A7223 ( 4.7A)
 0.74A 3h0aA-3dzuA:
31.5		 3h0aA-3dzuA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		6 ALA A 271
GLN A 275
TRP A 305
ARG A 316
LEU A 326
ILE A 428
 9CR  A7223 (-3.5A)
9CR  A7223 (-4.6A)
None
9CR  A7223 (-3.7A)
9CR  A7223 (-3.8A)
None
 1.35A 3h0aA-3dzuA:
31.5		 3h0aA-3dzuA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		7 ALA A 271
LEU A 309
ARG A 316
LEU A 326
VAL A 342
ILE A 345
CYH A 432
 9CR  A7223 (-3.5A)
9CR  A7223 ( 4.4A)
9CR  A7223 (-3.7A)
9CR  A7223 (-3.8A)
9CR  A7223 ( 4.5A)
9CR  A7223 ( 4.9A)
9CR  A7223 (-3.8A)
 0.93A 3h0aA-3dzuA:
31.5		 3h0aA-3dzuA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f0n MEVALONATE
PYROPHOSPHATE
DECARBOXYLASE

(Mus musculus) 		PF00288
(GHMP_kinases_N) 		5 ALA A 128
ALA A 129
ALA A 159
VAL A 311
ILE A 197
 None
 0.82A 3h0aA-3f0nA:
undetectable		 3h0aA-3f0nA:
18.78
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.
3f8r THIOREDOXIN
REDUCTASE (TRXB-3)

(Sulfolobus
solfataricus) 		PF07992
(Pyr_redox_2) 		6 ALA A  30
ALA A  27
ALA A  31
VAL A 271
ILE A 269
CYH A 288
 None
 1.42A 3h0aA-3f8rA:
undetectable		 3h0aA-3f8rA:
20.80
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.
3fcr PUTATIVE
AMINOTRANSFERASE

(Ruegeria sp.
TM1040) 		PF00202
(Aminotran_3) 		6 LEU A 367
LEU A 411
ALA A 451
ILE A 234
CYH A 383
LEU A 359
 None
 1.43A 3h0aA-3fcrA:
undetectable		 3h0aA-3fcrA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ipc ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN (AMINO ACID)

(Agrobacterium
fabrum) 		PF13458
(Peripla_BP_6) 		5 ALA A 289
ALA A 290
LEU A 305
ALA A 304
VAL A  74
 None
 0.69A 3h0aA-3ipcA:
undetectable		 3h0aA-3ipcA:
22.41
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.
3iwa FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Desulfovibrio
vulgaris) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A  17
ALA A  18
VAL A 277
ILE A 275
CYH A 294
 None
 0.99A 3h0aA-3iwaA:
undetectable		 3h0aA-3iwaA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l6a EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4
GAMMA 2

(Homo sapiens) 		PF02020
(W2)
PF02847
(MA3) 		5 ALA A 111
GLN A 143
LEU A 144
VAL A 162
LEU A 128
 None
None
None
MES  A 361 (-3.6A)
None
 0.94A 3h0aA-3l6aA:
undetectable		 3h0aA-3l6aA:
21.05
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.
3lb5 HIT-LIKE PROTEIN
INVOLVED IN
CELL-CYCLE
REGULATION

(Bartonella
henselae) 		PF01230
(HIT) 		5 ALA A  76
LEU A 140
ALA A 139
VAL A  30
ILE A  31
 None
 0.93A 3h0aA-3lb5A:
undetectable		 3h0aA-3lb5A:
19.49
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.
3mr7 ADENYLATE/GUANYLATE
CYCLASE/HYDROLASE,
ALPHA/BETA FOLD
FAMILY

(Ruegeria
pomeroyi) 		PF00211
(Guanylate_cyc) 		5 ALA A  66
ALA A  67
LEU A   8
ALA A  45
ILE A 102
 None
 0.95A 3h0aA-3mr7A:
undetectable		 3h0aA-3mr7A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nuf PRD-CONTAINING
TRANSCRIPTION
REGULATOR

(Lactobacillus
paracasei) 		no annotation 5 ALA A  39
ALA A  38
LEU A  88
ALA A  40
LEU A  53
 None
 1.01A 3h0aA-3nufA:
undetectable		 3h0aA-3nufA:
20.52
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.
3o10 SACSIN

(Homo sapiens) 		PF05168
(HEPN) 		5 ALA A4487
ALA A4488
LEU A4451
ALA A4447
LEU A4519
 None
 0.76A 3h0aA-3o10A:
undetectable		 3h0aA-3o10A:
17.98
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.
3sfz APOPTOTIC PEPTIDASE
ACTIVATING FACTOR 1

(Mus musculus) 		PF00400
(WD40)
PF00931
(NB-ARC)
PF12894
(ANAPC4_WD40) 		5 ALA A 223
LEU A 230
LEU A 199
ILE A 260
CYH A 258
 None
 0.84A 3h0aA-3sfzA:
undetectable		 3h0aA-3sfzA:
10.81
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.
3tt6 ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT

(Bacillus
subtilis) 		PF00574
(CLP_protease) 		5 ALA A  96
ALA A  95
LEU A 103
VAL A  39
ILE A  43
 None
 0.99A 3h0aA-3tt6A:
undetectable		 3h0aA-3tt6A:
22.84
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.
3upn PENICILLIN-BINDING
PROTEIN A

(Mycobacterium
tuberculosis) 		PF00905
(Transpeptidase) 		5 ALA A 231
ALA A 232
LEU A 298
ALA A 297
LEU A 274
 None
 0.98A 3h0aA-3upnA:
undetectable		 3h0aA-3upnA:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fdw LEUCINE RICH
HYPOTHETICAL PROTEIN

(Bacteroides
ovatus) 		PF07523
(Big_3)
PF13306
(LRR_5) 		5 ALA A 290
GLN A 269
VAL A 280
ILE A 277
CYH A 297
 None
 0.99A 3h0aA-4fdwA:
undetectable		 3h0aA-4fdwA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g68 ABC TRANSPORTER

(Caldanaerobius) 		PF01547
(SBP_bac_1) 		5 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.83A 3h0aA-4g68B:
undetectable		 3h0aA-4g68B:
20.54
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.
4iwh 3-ISOPROPYLMALATE
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00180
(Iso_dh) 		6 ALA A   4
ALA A  57
ALA A  60
VAL A  68
ILE A  86
LEU A  49
 None
 1.48A 3h0aA-4iwhA:
undetectable		 3h0aA-4iwhA:
22.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 9 ALA D 271
ALA D 272
GLN D 275
LEU D 309
ARG D 316
LEU D 326
VAL D 342
ILE D 345
CYH D 432
 None
 0.87A 3h0aA-4j5xD:
30.9		 3h0aA-4j5xD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 10 ALA D 271
ALA D 272
GLN D 275
TRP D 305
LEU D 309
ARG D 316
LEU D 326
VAL D 342
ILE D 345
LEU D 436
 None
 0.67A 3h0aA-4j5xD:
30.9		 3h0aA-4j5xD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 9 ALA D 271
GLN D 275
LEU D 309
ARG D 316
LEU D 326
ALA D 327
VAL D 342
ILE D 345
CYH D 432
 None
 0.99A 3h0aA-4j5xD:
30.9		 3h0aA-4j5xD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 7 ALA D 271
GLN D 275
TRP D 305
ARG D 316
LEU D 326
ALA D 327
ILE D 428
 None
 1.43A 3h0aA-4j5xD:
30.9		 3h0aA-4j5xD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 10 ALA D 271
GLN D 275
TRP D 305
LEU D 309
ARG D 316
LEU D 326
ALA D 327
VAL D 342
ILE D 345
LEU D 436
 None
 0.80A 3h0aA-4j5xD:
30.9		 3h0aA-4j5xD:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k70 UL37

(Suid
alphaherpesvirus
1) 		PF03970
(Herpes_UL37_1) 		5 ALA A 304
ALA A 305
ARG A 254
VAL A 238
LEU A 294
 None
 0.90A 3h0aA-4k70A:
undetectable		 3h0aA-4k70A:
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.
4kdz TRNA
(CYTIDINE(34)-2'-O)-
METHYLTRANSFERASE

(Escherichia
coli) 		PF00588
(SpoU_methylase) 		5 ALA A 113
LEU A 111
VAL A   5
ILE A  32
LEU A  67
 None
 0.98A 3h0aA-4kdzA:
undetectable		 3h0aA-4kdzA:
20.63
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.
4ovk PERIPLASMIC BINDING
PROTEIN

(Veillonella
parvula) 		PF01497
(Peripla_BP_2) 		6 ALA A 178
GLN A 177
LEU A 181
LEU A 172
VAL A 151
ILE A 153
 None
 1.40A 3h0aA-4ovkA:
undetectable		 3h0aA-4ovkA:
21.75
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.
4p7c TRNA
(MO5U34)-METHYLTRANS
FERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF08003
(Methyltransf_9) 		5 ALA A  79
ALA A  44
LEU A  48
ALA A  47
LEU A 152
 None
 0.99A 3h0aA-4p7cA:
undetectable		 3h0aA-4p7cA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qpn PROTEIN-LYSINE
METHYLTRANSFERASE
METTL21B

(Homo sapiens) 		PF10294
(Methyltransf_16) 		5 ALA A 179
LEU A  63
ALA A  59
ILE A  80
LEU A 166
 None
 0.73A 3h0aA-4qpnA:
undetectable		 3h0aA-4qpnA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x9n L-ALPHA-GLYCEROPHOSP
HATE OXIDASE

(Mycoplasma
pneumoniae) 		PF01266
(DAO) 		6 ALA A 209
ALA A 208
LEU A 343
LEU A 216
ALA A 213
LEU A  31
 FAD  A 401 (-3.6A)
None
None
None
None
None
 1.38A 3h0aA-4x9nA:
undetectable		 3h0aA-4x9nA:
18.73
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.
4x9n L-ALPHA-GLYCEROPHOSP
HATE OXIDASE

(Mycoplasma
pneumoniae) 		PF01266
(DAO) 		6 ALA A 209
ALA A 208
LEU A 343
LEU A 216
ALA A 213
VAL A 202
 FAD  A 401 (-3.6A)
None
None
None
None
None
 1.15A 3h0aA-4x9nA:
undetectable		 3h0aA-4x9nA:
18.73
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.
4xai GRUNGE, ISOFORM J
MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TAILLESS
ORTHOLOG

(Drosophila
melanogaster;
Escherichia
coli;
Tribolium
castaneum) 		PF00104
(Hormone_recep)
PF13416
(SBP_bac_8)
no annotation 		5 ALA A1204
LEU P1823
ALA P1819
CYH A1260
LEU A1256
 None
 0.97A 3h0aA-4xaiA:
14.1		 3h0aA-4xaiA:
18.97
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.
4xg0 UNCHARACTERIZED
PROTEIN

(Bordetella
bronchiseptica) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 ALA A 322
ALA A 321
LEU A 348
ALA A 347
ILE A 398
 None
 0.77A 3h0aA-4xg0A:
undetectable		 3h0aA-4xg0A:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xgj UNCHARACTERIZED
PROTEIN

(Pectobacterium
atrosepticum) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 ALA A 214
ALA A 215
LEU A 183
ALA A 184
LEU A 230
 None
 0.88A 3h0aA-4xgjA:
undetectable		 3h0aA-4xgjA:
20.13
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.
5aoh CARF

(Serratia sp.
ATCC 39006) 		PF03781
(FGE-sulfatase) 		5 LEU A 146
LEU A 242
ALA A 243
ILE A  39
LEU A  34
 None
 1.00A 3h0aA-5aohA:
undetectable		 3h0aA-5aohA:
23.28
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.
5bt1 HAT1-INTERACTING
FACTOR 1

(Saccharomyces
cerevisiae) 		no annotation 5 ALA A  41
ALA A  42
LEU A  33
ALA A  29
ILE A 245
 None
 0.93A 3h0aA-5bt1A:
undetectable		 3h0aA-5bt1A:
22.73
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.
5c90 ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT

(Staphylococcus
aureus) 		PF00574
(CLP_protease) 		5 ALA A  97
ALA A  96
LEU A 104
VAL A  40
ILE A  44
 None
 1.01A 3h0aA-5c90A:
undetectable		 3h0aA-5c90A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ehk LANTIBIOTIC
DEHYDRATASE

(Microbispora
corallina) 		PF04738
(Lant_dehydr_N)
PF14028
(Lant_dehydr_C) 		6 ALA A 934
LEU A 941
LEU A1044
ALA A1043
VAL A1097
LEU A 951
 None
 1.47A 3h0aA-5ehkA:
undetectable		 3h0aA-5ehkA:
12.62
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.
5ihv BETA-LACTAMASE

(Burkholderia
ambifaria) 		PF13354
(Beta-lactamase2) 		5 ALA A  54
ALA A  55
LEU A 176
VAL A 223
LEU A 166
 None
 0.85A 3h0aA-5ihvA:
undetectable		 3h0aA-5ihvA:
23.32
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.
5jr4 TYPE 1 FIMBIRAL
ADHESIN FIMH

(Escherichia
coli) 		PF00419
(Fimbrial)
PF09160
(FimH_man-bind) 		5 ALA A  62
ALA A  63
LEU A  68
VAL A  22
LEU A 109
 None
 1.00A 3h0aA-5jr4A:
undetectable		 3h0aA-5jr4A:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k0y RIBOSOMAL PROTEIN
ES19

(Oryctolagus
cuniculus) 		PF01090
(Ribosomal_S19e) 		5 ALA R  58
ALA R  57
LEU R  28
LEU R  18
ALA R  19
 None
 1.00A 3h0aA-5k0yR:
undetectable		 3h0aA-5k0yR:
21.92
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.
5njl CELL SURFACE PROTEIN
(PUTATIVE S-LAYER
PROTEIN)

(Clostridioides
difficile) 		no annotation 5 ALA A 156
LEU A 165
VAL A 213
ILE A 216
LEU A 192
 None
 0.98A 3h0aA-5njlA:
undetectable		 3h0aA-5njlA:
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.
5nth PUTATIVE
AMINOPEPTIDASE

(Leishmania
major) 		PF00883
(Peptidase_M17) 		6 ALA A 160
LEU A 182
ALA A 126
VAL A 529
ILE A 210
CYH A 211
 None
 1.31A 3h0aA-5nthA:
undetectable		 3h0aA-5nthA:
17.94
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.
5o2c SERINE/THREONINE-PRO
TEIN KINASE WNK3

(Homo sapiens) 		PF00069
(Pkinase)
PF12202
(OSR1_C) 		5 LEU A 339
VAL A 290
ILE A 281
CYH A 278
LEU A 239
 None
 1.00A 3h0aA-5o2cA:
undetectable		 3h0aA-5o2cA:
21.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5toa ESTROGEN RECEPTOR
BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 302
LEU A 339
VAL A 370
ILE A 373
LEU A 476
 EST  A 601 ( 3.9A)
EST  A 601 (-3.9A)
None
None
EST  A 601 (-3.5A)
 0.95A 3h0aA-5toaA:
22.0		 3h0aA-5toaA:
30.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		no annotation 12 ALA A 271
ALA A 272
GLN A 275
TRP A 305
LEU A 309
ARG A 316
LEU A 326
ALA A 327
VAL A 342
ILE A 345
CYH A 432
LEU A 436
 9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.8A)
None
9CR  A 503 (-3.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-4.3A)
9CR  A 503 (-3.4A)
None
None
9CR  A 503 (-3.3A)
9CR  A 503 ( 4.8A)
 0.70A 3h0aA-5uanA:
31.7		 3h0aA-5uanA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vyd PHOSPHODIESTERASE

(Salpingoeca
rosetta) 		no annotation 5 ALA A 119
LEU A  92
VAL A  55
ILE A  61
LEU A 182
 None
 0.96A 3h0aA-5vydA:
undetectable		 3h0aA-5vydA:
23.17
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.
5w0s 60 KDA CHAPERONIN

(Escherichia
coli) 		PF00118
(Cpn60_TCP1) 		5 ALA A 507
ALA A 508
LEU A  95
ALA A  96
VAL A 422
 None
 0.84A 3h0aA-5w0sA:
undetectable		 3h0aA-5w0sA:
19.89
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.
5xwb 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Colwellia
psychrerythraea) 		PF00275
(EPSP_synthase) 		6 ALA A 107
ALA A 108
LEU A 184
LEU A 133
ALA A 138
LEU A  34
 None
 1.21A 3h0aA-5xwbA:
undetectable		 3h0aA-5xwbA:
20.54
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.
5xym 50S RIBOSOMAL
PROTEIN L22

(Mycolicibacterium
smegmatis) 		PF00237
(Ribosomal_L22) 		5 ALA S  61
ALA S  62
LEU S  76
ALA S  10
LEU S  40
 None
 0.91A 3h0aA-5xymS:
undetectable		 3h0aA-5xymS:
18.94
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 5 ALA A  20
ALA A  21
ALA A 329
VAL A 126
ILE A 137
 None
 1.01A 3h0aA-6cmzA:
undetectable		 3h0aA-6cmzA:
21.34
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.
1bco BACTERIOPHAGE MU
TRANSPOSASE

(Escherichia
virus Mu) 		PF02914
(DDE_2)
PF09299
(Mu-transpos_C) 		3 ILE A 266
PHE A 318
HIS A 375
 None
 0.71A 3h0aA-1bcoA:
undetectable		 3h0aA-1bcoA:
21.96
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.
1c4k PROTEIN (ORNITHINE
DECARBOXYLASE)

(Lactobacillus
sp. 30A) 		PF01276
(OKR_DC_1)
PF03709
(OKR_DC_1_N)
PF03711
(OKR_DC_1_C) 		3 ILE A 251
PHE A 616
HIS A 223
 None
None
PLP  A 955 (-3.4A)
 0.68A 3h0aA-1c4kA:
0.0		 3h0aA-1c4kA:
15.69
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.
1eyw PHOSPHOTRIESTERASE

(Brevundimonas
diminuta) 		PF02126
(PTE) 		3 ILE A 228
PHE A 216
HIS A  55
 None
None
ZN  A 401 (-3.2A)
 0.72A 3h0aA-1eywA:
undetectable		 3h0aA-1eywA:
22.39
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.
1eyw PHOSPHOTRIESTERASE

(Brevundimonas
diminuta) 		PF02126
(PTE) 		3 ILE A 228
PHE A 216
HIS A 201
 None
None
ZN  A 402 (-3.1A)
 0.76A 3h0aA-1eywA:
undetectable		 3h0aA-1eywA:
22.39
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.
1k9a CARBOXYL-TERMINAL
SRC KINASE

(Rattus
norvegicus) 		PF00017
(SH2)
PF00018
(SH3_1)
PF07714
(Pkinase_Tyr) 		3 ILE A 379
PHE A 382
HIS A 449
 None
 0.70A 3h0aA-1k9aA:
0.0		 3h0aA-1k9aA:
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.
1kfi PHOSPHOGLUCOMUTASE 1

(Paramecium
tetraurelia) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ILE A 118
PHE A  47
HIS A  91
 None
 0.75A 3h0aA-1kfiA:
0.0		 3h0aA-1kfiA:
17.07
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.
1nsv GALACTOSE MUTAROTASE

(Lactococcus
lactis) 		PF01263
(Aldose_epim) 		3 ILE A 278
PHE A 219
HIS A 298
 None
 0.73A 3h0aA-1nsvA:
undetectable		 3h0aA-1nsvA:
20.17
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.
1psz PROTEIN (SURFACE
ANTIGEN PSAA)

(Streptococcus
pneumoniae) 		PF01297
(ZnuA) 		3 ILE A  41
PHE A 150
HIS A  67
 None
None
ZN  A1000 ( 3.2A)
 0.66A 3h0aA-1pszA:
undetectable		 3h0aA-1pszA:
21.50
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.
1q56 AGRIN

(Gallus gallus) 		PF00054
(Laminin_G_1) 		3 ILE A  97
PHE A 163
HIS A 101
 None
 0.70A 3h0aA-1q56A:
undetectable		 3h0aA-1q56A:
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.
1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III

(Paracoccus
denitrificans) 		PF00115
(COX1)
PF00510
(COX3) 		3 ILE A 194
PHE C  93
HIS A 187
 None
 0.73A 3h0aA-1qleA:
0.2		 3h0aA-1qleA:
19.36
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.
1r5m SIR4-INTERACTING
PROTEIN SIF2

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		3 ILE A 286
PHE A 299
HIS A 275
 None
 0.64A 3h0aA-1r5mA:
undetectable		 3h0aA-1r5mA:
21.18
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.
1rif DNA HELICASE UVSW

(Escherichia
virus T4) 		PF04851
(ResIII) 		3 ILE A  15
PHE A  22
HIS A  12
 None
 0.70A 3h0aA-1rifA:
undetectable		 3h0aA-1rifA:
22.58
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.
1s5j DNA POLYMERASE I

(Sulfolobus
solfataricus) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 ILE A 120
PHE A 128
HIS A 463
 None
SO4  A 891 ( 4.3A)
None
 0.70A 3h0aA-1s5jA:
0.0		 3h0aA-1s5jA:
14.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 ILE A 339
PHE A 384
HIS A 506
 MEI  A1001 (-3.8A)
MEI  A1001 (-4.5A)
None
 0.52A 3h0aA-1uhlA:
32.0		 3h0aA-1uhlA:
88.70
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.
1ui1 URACIL-DNA
GLYCOSYLASE

(Thermus
thermophilus) 		PF03167
(UDG) 		3 ILE A 178
PHE A 151
HIS A 172
 None
 0.74A 3h0aA-1ui1A:
undetectable		 3h0aA-1ui1A:
20.08
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.
1w8j MYOSIN VA

(Gallus gallus) 		PF00063
(Myosin_head) 		3 ILE A 332
PHE A 360
HIS A 406
 None
 0.74A 3h0aA-1w8jA:
0.8		 3h0aA-1w8jA:
16.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		3 ILE A 242
PHE A 287
HIS A 409
 9CR  A 201 ( 4.4A)
9CR  A 201 (-4.7A)
9CR  A 201 (-4.8A)
 0.55A 3h0aA-1xiuA:
29.4		 3h0aA-1xiuA:
82.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 ILE A 268
PHE A 313
HIS A 435
 9CR  A 801 (-3.9A)
9CR  A 801 (-4.3A)
None
 0.54A 3h0aA-1xlsA:
31.5		 3h0aA-1xlsA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xmx HYPOTHETICAL PROTEIN
VC1899

(Vibrio cholerae) 		PF09002
(DUF1887) 		3 ILE A  73
PHE A  89
HIS A  97
 None
 0.59A 3h0aA-1xmxA:
undetectable		 3h0aA-1xmxA:
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.
1y63 LMAJ004144AAA
PROTEIN

(Leishmania
major) 		PF13238
(AAA_18) 		3 ILE A  13
PHE A 101
HIS A  39
 None
None
MN  A 311 (-3.3A)
 0.68A 3h0aA-1y63A:
undetectable		 3h0aA-1y63A:
21.63
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.
1z6y ADP-RIBOSYLATION
FACTOR-LIKE PROTEIN
5

(Homo sapiens) 		PF00025
(Arf) 		3 ILE A  88
PHE A  36
HIS A 153
 None
 0.67A 3h0aA-1z6yA:
undetectable		 3h0aA-1z6yA:
21.27
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.
2as9 SERINE PROTEASE

(Staphylococcus
aureus) 		PF00089
(Trypsin) 		3 ILE A  36
PHE A 107
HIS A 201
 None
 0.72A 3h0aA-2as9A:
undetectable		 3h0aA-2as9A:
19.40
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.
2b61 HOMOSERINE
O-ACETYLTRANSFERASE

(Haemophilus
influenzae) 		PF00561
(Abhydrolase_1) 		3 ILE A 133
PHE A  81
HIS A 130
 None
 0.68A 3h0aA-2b61A:
undetectable		 3h0aA-2b61A:
19.23
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.
2dfs MYOSIN-5A

(Gallus gallus) 		PF00063
(Myosin_head)
PF00612
(IQ) 		3 ILE A 332
PHE A 360
HIS A 406
 None
 0.66A 3h0aA-2dfsA:
undetectable		 3h0aA-2dfsA:
11.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e6m WERNER SYNDROME
ATP-DEPENDENT
HELICASE HOMOLOG

(Mus musculus) 		PF01612
(DNA_pol_A_exo1) 		3 ILE A  94
PHE A 145
HIS A 107
 None
 0.71A 3h0aA-2e6mA:
undetectable		 3h0aA-2e6mA:
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.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		3 ILE A 156
PHE A 203
HIS A 151
 None
 0.72A 3h0aA-2fpgA:
undetectable		 3h0aA-2fpgA:
19.54
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.
2g6y GREEN FLUORESCENT
PROTEIN 2

(Pontellina
plumata) 		PF01353
(GFP) 		3 ILE A 180
PHE A  74
HIS A 143
 None
 0.55A 3h0aA-2g6yA:
undetectable		 3h0aA-2g6yA:
23.14
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.
2h6o MAJOR OUTER ENVELOPE
GLYCOPROTEIN GP350

(Human
gammaherpesvirus
4) 		PF05109
(Herpes_BLLF1) 		3 ILE A  50
PHE A  26
HIS A 143
 None
 0.74A 3h0aA-2h6oA:
undetectable		 3h0aA-2h6oA:
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.
2h8x XENOBIOTIC REDUCTASE
A

(Pseudomonas
putida) 		PF00724
(Oxidored_FMN) 		3 ILE A  89
PHE A 172
HIS A  41
 None
 0.75A 3h0aA-2h8xA:
undetectable		 3h0aA-2h8xA:
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		3 ILE A 513
PHE A 300
HIS A 202
 None
None
FAD  A 700 (-3.9A)
 0.72A 3h0aA-2i0kA:
undetectable		 3h0aA-2i0kA:
17.68
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.
2ify 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Bacillus
anthracis) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		3 ILE A 440
PHE A  13
HIS A  41
 None
 0.71A 3h0aA-2ifyA:
undetectable		 3h0aA-2ifyA:
18.11
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.
2im9 HYPOTHETICAL PROTEIN

(Legionella
pneumophila) 		PF07313
(DUF1460) 		3 ILE A 335
PHE A 247
HIS A 291
 None
 0.65A 3h0aA-2im9A:
undetectable		 3h0aA-2im9A:
22.59
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.
2jhq URACIL
DNA-GLYCOSYLASE

(Vibrio cholerae) 		PF03167
(UDG) 		3 ILE A  60
PHE A 203
HIS A 187
 None
 0.70A 3h0aA-2jhqA:
undetectable		 3h0aA-2jhqA:
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.
2jnk HYALURONONGLUCOSAMIN
IDASE

(Clostridium
perfringens) 		PF00404
(Dockerin_1)
PF07554
(FIVAR) 		3 ILE A 118
PHE A  84
HIS A  30
 None
 0.67A 3h0aA-2jnkA:
undetectable		 3h0aA-2jnkA:
20.35
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.
2o5h HYPOTHETICAL PROTEIN

(Neisseria
meningitidis) 		PF04591
(DUF596) 		3 ILE A  54
PHE A  41
HIS A   7
 None
 0.67A 3h0aA-2o5hA:
undetectable		 3h0aA-2o5hA:
18.42
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.
2oca ATP-DEPENDENT DNA
HELICASE UVSW

(Escherichia
virus T4) 		PF00271
(Helicase_C)
PF04851
(ResIII) 		3 ILE A  15
PHE A  22
HIS A  12
 None
 0.74A 3h0aA-2ocaA:
undetectable		 3h0aA-2ocaA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p5z TYPE VI SECRETION
SYSTEM COMPONENT

(Escherichia
coli) 		PF05954
(Phage_GPD) 		3 ILE X 197
PHE X 150
HIS X 141
 None
 0.73A 3h0aA-2p5zX:
undetectable		 3h0aA-2p5zX:
18.48
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.
2pnc COPPER AMINE
OXIDASE, LIVER
ISOZYME

(Bos taurus) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		3 ILE A 290
PHE A 498
HIS A 196
 None
 0.56A 3h0aA-2pncA:
undetectable		 3h0aA-2pncA:
14.54
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.
2qfb PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF11648
(RIG-I_C-RD) 		3 ILE A 862
PHE A 838
HIS A 871
 None
 0.63A 3h0aA-2qfbA:
undetectable		 3h0aA-2qfbA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r2i GUANYLYL
CYCLASE-ACTIVATING
PROTEIN 1

(Gallus gallus) 		PF00036
(EF-hand_1)
PF13499
(EF-hand_7) 		3 ILE A 118
PHE A  62
HIS A 176
 None
MYR  A   1 ( 4.7A)
None
 0.51A 3h0aA-2r2iA:
undetectable		 3h0aA-2r2iA:
22.41
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.
2uvf EXOPOLYGALACTURONASE

(Yersinia
enterocolitica) 		PF00295
(Glyco_hydro_28)
PF12708
(Pectate_lyase_3) 		3 ILE A 448
PHE A 519
HIS A 443
 None
None
AD0  A1617 (-3.8A)
 0.70A 3h0aA-2uvfA:
undetectable		 3h0aA-2uvfA:
16.45
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.
2van DNA POLYMERSE BETA

(Rattus
norvegicus) 		PF10391
(DNA_pol_lambd_f)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		3 ILE A 255
PHE A 235
HIS A 252
 None
 0.76A 3h0aA-2vanA:
undetectable		 3h0aA-2vanA:
23.60
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.
2vr5 GLYCOGEN OPERON
PROTEIN GLGX

(Sulfolobus
solfataricus) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		3 ILE A 307
PHE A  99
HIS A 337
 None
 0.73A 3h0aA-2vr5A:
undetectable		 3h0aA-2vr5A:
14.40
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.
2w4g MYOSIN HEAVY CHAIN,
SKELETAL MUSCLE,
ADULT

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		3 ILE M 175
PHE M 196
HIS M 668
 None
 0.59A 3h0aA-2w4gM:
1.2		 3h0aA-2w4gM:
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.
2wqq ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		3 ILE A 130
PHE A 109
HIS A 122
 None
 0.76A 3h0aA-2wqqA:
undetectable		 3h0aA-2wqqA:
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.
2x3l ORN/LYS/ARG
DECARBOXYLASE FAMILY
PROTEIN

(Staphylococcus
aureus) 		PF01276
(OKR_DC_1)
PF03711
(OKR_DC_1_C) 		3 ILE A 408
PHE A 410
HIS A 133
 None
 0.67A 3h0aA-2x3lA:
undetectable		 3h0aA-2x3lA:
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.
2y9y IMITATION SWITCH
PROTEIN 1
(DEL_ATPASE)
ISWI ONE COMPLEX
PROTEIN 3

(Saccharomyces
cerevisiae) 		PF09110
(HAND)
PF09111
(SLIDE)
PF15612
(WHIM1) 		3 ILE A 947
PHE A 895
HIS B 346
 None
 0.76A 3h0aA-2y9yA:
undetectable		 3h0aA-2y9yA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zbl PUTATIVE ISOMERASE

(Salmonella
enterica) 		PF07221
(GlcNAc_2-epim) 		3 ILE A 381
PHE A  21
HIS A 386
 None
 0.73A 3h0aA-2zblA:
undetectable		 3h0aA-2zblA:
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.
3bks STEROL CARRIER
PROTEIN-2 LIKE-3

(Aedes aegypti) 		PF02036
(SCP2) 		3 ILE A 103
PHE A  92
HIS A  33
 None
 0.70A 3h0aA-3bksA:
undetectable		 3h0aA-3bksA:
23.00
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.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		3 ILE A  76
PHE A 113
HIS A 328
 None
None
ACI  A 694 (-3.9A)
 0.75A 3h0aA-3bmwA:
undetectable		 3h0aA-3bmwA:
15.37
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.
3d7u TYROSINE-PROTEIN
KINASE CSK

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 ILE A 379
PHE A 382
HIS A 449
 None
 0.70A 3h0aA-3d7uA:
undetectable		 3h0aA-3d7uA:
22.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		3 ILE A 268
PHE A 313
HIS A 435
 9CR  A7223 (-3.9A)
9CR  A7223 (-4.5A)
9CR  A7223 (-4.3A)
 0.66A 3h0aA-3dzuA:
31.5		 3h0aA-3dzuA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gmf PROTEIN-DISULFIDE
ISOMERASE

(Novosphingobium
aromaticivorans) 		PF13462
(Thioredoxin_4) 		3 ILE A 111
PHE A 170
HIS A 124
 None
 0.75A 3h0aA-3gmfA:
undetectable		 3h0aA-3gmfA:
19.75
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT B

(Sulfolobus
solfataricus) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 ILE B 655
PHE B 456
HIS B 660
 None
 0.70A 3h0aA-3hkzB:
undetectable		 3h0aA-3hkzB:
12.76
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.
3hwc CHLOROPHENOL-4-MONOO
XYGENASE COMPONENT 2

(Burkholderia
cepacia) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		3 ILE A3220
PHE A3258
HIS A3201
 None
 0.68A 3h0aA-3hwcA:
undetectable		 3h0aA-3hwcA:
19.60
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.
3i99 UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Vibrio cholerae) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		3 ILE A 304
PHE A 244
HIS A 289
 None
 0.64A 3h0aA-3i99A:
undetectable		 3h0aA-3i99A:
21.90
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.
3j0c E1 ENVELOPE
GLYCOPROTEIN

(Venezuelan
equine
encephalitis
virus) 		PF01589
(Alpha_E1_glycop) 		3 ILE A 177
PHE A 189
HIS A 125
 None
 0.63A 3h0aA-3j0cA:
undetectable		 3h0aA-3j0cA:
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.
3j4j TRANSLATION
INITIATION FACTOR
IF-2

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF04760
(IF2_N)
PF11987
(IF-2) 		3 ILE A 149
PHE A 201
HIS A 167
 None
 0.75A 3h0aA-3j4jA:
undetectable		 3h0aA-3j4jA:
18.43
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.
3k4y ISOPENTENYL
PHOSPHATE KINASE

(Methanocaldococcus
jannaschii) 		PF00696
(AA_kinase) 		3 ILE A 157
PHE A 125
HIS A  53
 None
 0.68A 3h0aA-3k4yA:
undetectable		 3h0aA-3k4yA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kzh PROBABLE SUGAR
KINASE

(Clostridium
perfringens) 		PF00294
(PfkB) 		3 ILE A 224
PHE A 214
HIS A 191
 None
 0.71A 3h0aA-3kzhA:
undetectable		 3h0aA-3kzhA:
21.60
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.
3lat BIFUNCTIONAL
AUTOLYSIN

(Staphylococcus
epidermidis) 		PF01510
(Amidase_2) 		3 ILE A 120
PHE A 129
HIS A 181
 None
 0.69A 3h0aA-3latA:
undetectable		 3h0aA-3latA:
21.22
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.
3lnl UPF0135 PROTEIN
SA1388

(Staphylococcus
aureus) 		PF01784
(NIF3) 		3 ILE A 310
PHE A 305
HIS A 330
 None
None
ZN  A 402 (-3.4A)
 0.71A 3h0aA-3lnlA:
undetectable		 3h0aA-3lnlA:
21.62
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.
3lqc DNA POLYMERASE BETA

(Rattus
norvegicus) 		PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		3 ILE B 255
PHE B 235
HIS B 252
 None
 0.68A 3h0aA-3lqcB:
undetectable		 3h0aA-3lqcB:
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.
3lrn PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF11648
(RIG-I_C-RD) 		3 ILE A 862
PHE A 838
HIS A 871
 None
 0.58A 3h0aA-3lrnA:
undetectable		 3h0aA-3lrnA:
21.15
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.
3mdq EXOPOLYPHOSPHATASE

(Cytophaga
hutchinsonii) 		PF02541
(Ppx-GppA) 		3 ILE A 207
PHE A 118
HIS A 130
 None
 0.74A 3h0aA-3mdqA:
undetectable		 3h0aA-3mdqA:
23.73
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.
3ov3 CURCUMIN SYNTHASE

(Curcuma longa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		3 ILE A 132
PHE A 215
HIS A 165
 MLI  A 396 (-2.9A)
None
None
 0.75A 3h0aA-3ov3A:
undetectable		 3h0aA-3ov3A:
22.59
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.
3tex PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		3 ILE A 591
PHE A 531
HIS A 299
 None
 0.59A 3h0aA-3texA:
undetectable		 3h0aA-3texA:
16.08
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.
3tr7 URACIL-DNA
GLYCOSYLASE

(Coxiella
burnetii) 		PF03167
(UDG) 		3 ILE A  63
PHE A 205
HIS A 189
 None
 0.65A 3h0aA-3tr7A:
undetectable		 3h0aA-3tr7A:
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.
3tx1 UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Listeria
monocytogenes) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		3 ILE A 257
PHE A 222
HIS A 242
 None
 0.68A 3h0aA-3tx1A:
undetectable		 3h0aA-3tx1A:
23.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ua4 PROTEIN ARGININE
N-METHYLTRANSFERASE
5

(Caenorhabditis
elegans) 		PF05185
(PRMT5)
PF17285
(PRMT5_TIM)
PF17286
(PRMT5_C) 		3 ILE A 629
PHE A 611
HIS A 707
 None
 0.58A 3h0aA-3ua4A:
undetectable		 3h0aA-3ua4A:
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.
3wwz D-LACTATE
DEHYDROGENASE
(FERMENTATIVE)

(Pseudomonas
aeruginosa) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 ILE A   3
PHE A  29
HIS A  23
 None
 0.76A 3h0aA-3wwzA:
undetectable		 3h0aA-3wwzA:
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.
3zoq URACIL-DNA
GLYCOSYLASE

(Bacillus
subtilis) 		PF03167
(UDG) 		3 ILE A  61
PHE A 203
HIS A 187
 None
None
GOL  A1226 (-4.6A)
 0.73A 3h0aA-3zoqA:
undetectable		 3h0aA-3zoqA:
23.55
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.
3zoq URACIL-DNA
GLYCOSYLASE

(Bacillus
subtilis) 		PF03167
(UDG) 		3 ILE A 162
PHE A 203
HIS A 187
 None
None
GOL  A1226 (-4.6A)
 0.60A 3h0aA-3zoqA:
undetectable		 3h0aA-3zoqA:
23.55
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.
4ay2 PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		3 ILE A 862
PHE A 838
HIS A 871
 None
 0.67A 3h0aA-4ay2A:
undetectable		 3h0aA-4ay2A:
16.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bvt CYANURIC ACID
AMIDOHYDROLASE

(Pseudomonas sp.
ADP) 		PF09663
(Amido_AtzD_TrzD) 		3 ILE A  34
PHE A  80
HIS A  66
 None
 0.71A 3h0aA-4bvtA:
undetectable		 3h0aA-4bvtA:
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.
4fcy TRANSPOSASE

(Escherichia
virus Mu) 		PF02316
(HTH_Tnp_Mu_1)
PF02914
(DDE_2)
PF09039
(HTH_Tnp_Mu_2)
PF09299
(Mu-transpos_C) 		3 ILE A 266
PHE A 318
HIS A 375
 None
 0.69A 3h0aA-4fcyA:
undetectable		 3h0aA-4fcyA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fgu LEGUMAIN

(Homo sapiens) 		PF01650
(Peptidase_C13) 		3 ILE A  56
PHE A 142
HIS A  51
 None
 0.59A 3h0aA-4fguA:
undetectable		 3h0aA-4fguA:
20.47
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.
4g56 HSL7 PROTEIN

(Xenopus laevis) 		PF05185
(PRMT5)
PF17285
(PRMT5_TIM)
PF17286
(PRMT5_C) 		3 ILE A 134
PHE A 188
HIS A 136
 None
 0.75A 3h0aA-4g56A:
undetectable		 3h0aA-4g56A:
15.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 3 ILE D 268
PHE D 313
HIS D 435
 None
 0.61A 3h0aA-4j5xD:
30.9		 3h0aA-4j5xD:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jb3 HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13419
(HAD_2) 		3 ILE A 179
PHE A 169
HIS A  41
 None
 0.71A 3h0aA-4jb3A:
undetectable		 3h0aA-4jb3A:
21.18
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.
4jcm CYCLODEXTRIN
GLUCANOTRANSFERASE

([Bacillus]
clarkii) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		3 ILE A  76
PHE A 109
HIS A 317
 None
 0.75A 3h0aA-4jcmA:
undetectable		 3h0aA-4jcmA:
15.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4knk BIFUNCTIONAL
AUTOLYSIN

(Staphylococcus
aureus) 		PF01510
(Amidase_2) 		3 ILE A 325
PHE A 334
HIS A 386
 None
 0.65A 3h0aA-4knkA:
undetectable		 3h0aA-4knkA:
22.00
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.
4l5n URACIL-DNA
GLYCOSYLASE

(Human
alphaherpesvirus
1) 		PF03167
(UDG) 		3 ILE A  84
PHE A 225
HIS A 210
 None
 0.76A 3h0aA-4l5nA:
undetectable		 3h0aA-4l5nA:
20.15
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.
4lyk CYCLIC DI-GMP
PHOSPHODIESTERASE
YAHA

(Escherichia
coli) 		PF00563
(EAL) 		3 ILE A 248
PHE A 211
HIS A 253
 None
 0.68A 3h0aA-4lykA:
undetectable		 3h0aA-4lykA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lyl URACIL-DNA
GLYCOSYLASE

(Gadus morhua) 		PF03167
(UDG) 		3 ILE A 141
PHE A 284
HIS A 268
 None
 0.73A 3h0aA-4lylA:
undetectable		 3h0aA-4lylA:
24.02
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.
4m47 DNA POLYMERASE BETA

(Homo sapiens) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		3 ILE A 255
PHE A 235
HIS A 252
 None
 0.76A 3h0aA-4m47A:
1.4		 3h0aA-4m47A:
23.03
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.
4mkv RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Pisum sativum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ILE A 301
PHE A 117
HIS A 310
 None
 0.75A 3h0aA-4mkvA:
undetectable		 3h0aA-4mkvA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n2z GH62
ARABINOFURANOSIDASE

(Podospora
anserina) 		PF03664
(Glyco_hydro_62) 		3 ILE A 289
PHE A 329
HIS A  60
 None
 0.74A 3h0aA-4n2zA:
undetectable		 3h0aA-4n2zA:
21.10
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.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 ILE A 879
PHE A 944
HIS A 557
 None
 0.74A 3h0aA-4ptfA:
undetectable		 3h0aA-4ptfA:
11.81
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.
4pyt UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(unidentified) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		3 ILE A 262
PHE A 227
HIS A 247
 None
 0.66A 3h0aA-4pytA:
undetectable		 3h0aA-4pytA:
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.
4rdy PARATHION HYDROLASE

(Vulcanisaeta
moutnovskia) 		PF02126
(PTE) 		3 ILE A 198
PHE A 186
HIS A 171
 None
None
CO  A 402 ( 3.1A)
 0.73A 3h0aA-4rdyA:
undetectable		 3h0aA-4rdyA:
20.31
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.
4u63 DNA PHOTOLYASE

(Agrobacterium
fabrum) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		3 ILE A 354
PHE A 306
HIS A 356
 None
 0.76A 3h0aA-4u63A:
undetectable		 3h0aA-4u63A:
16.60
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.
4uqm URACIL-DNA
GLYCOSYLASE

(Deinococcus
radiodurans) 		PF03167
(UDG) 		3 ILE A  79
PHE A 221
HIS A 206
 None
 0.68A 3h0aA-4uqmA:
undetectable		 3h0aA-4uqmA:
24.19
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.
4uqm URACIL-DNA
GLYCOSYLASE

(Deinococcus
radiodurans) 		PF03167
(UDG) 		3 ILE A 181
PHE A 221
HIS A 206
 None
 0.59A 3h0aA-4uqmA:
undetectable		 3h0aA-4uqmA:
24.19
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.
4wzh DIHYDROOROTATE
DEHYDROGENASE

(Leishmania
braziliensis) 		PF01180
(DHO_dh) 		3 ILE A  97
PHE A  77
HIS A 160
 None
 0.75A 3h0aA-4wzhA:
undetectable		 3h0aA-4wzhA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xj5 CYCLIC AMP-GMP
SYNTHASE

(Vibrio cholerae) 		no annotation 3 ILE A 149
PHE A  47
HIS A 151
 None
 0.70A 3h0aA-4xj5A:
undetectable		 3h0aA-4xj5A:
19.57
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.
4xuk PUTATIVE HYDROLASE

(Acinetobacter
sp. NBRC 100985) 		PF00753
(Lactamase_B) 		3 ILE A 263
PHE A 298
HIS A 244
 None
None
ZN  A 402 (-3.3A)
 0.74A 3h0aA-4xukA:
undetectable		 3h0aA-4xukA:
23.15
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.
4z8z UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 3 ILE A 255
PHE A 283
HIS A 197
 None
 0.75A 3h0aA-4z8zA:
undetectable		 3h0aA-4z8zA:
23.69
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.
4zvc DIGUANYLATE CYCLASE
DOSC

(Escherichia
coli) 		no annotation 3 ILE A 242
PHE A 217
HIS A 237
 None
 0.73A 3h0aA-4zvcA:
undetectable		 3h0aA-4zvcA:
19.30
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.
5c70 GLUCURONIDASE

(Aspergillus
oryzae) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		3 ILE A  52
PHE A  21
HIS A  59
 None
 0.62A 3h0aA-5c70A:
undetectable		 3h0aA-5c70A:
19.48