SIMILAR PATTERNS OF AMINO ACIDS FOR 4DC3_A_ADNA401

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dgm ADENOSINE KINASE

(Toxoplasma
gondii) 		PF00294
(PfkB) 		9 ASN A  20
ASP A  24
LEU A  46
GLY A  68
ASN A  73
THR A 140
LEU A 142
GLY A 315
ASP A 318
 ADN  A 375 ( 3.8A)
ADN  A 375 (-2.9A)
None
ADN  A 375 ( 4.5A)
ADN  A 375 ( 4.9A)
ADN  A 375 ( 4.9A)
None
ACY  A 370 (-3.1A)
ADN  A 375 ( 3.1A)
 0.82A 4dc3A-1dgmA:
40.2		 4dc3A-1dgmA:
31.31
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.
1ek2 EPOXIDE HYDROLASE

(Mus musculus) 		PF00561
(Abhydrolase_1)
PF13419
(HAD_2) 		5 LEU A 462
GLY A 425
ALA A 421
VAL A 390
LEU A 395
 None
 1.02A 4dc3A-1ek2A:
3.4		 4dc3A-1ek2A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f2h TUMOR NECROSIS
FACTOR RECEPTOR TYPE
1 ASSOCIATED DEATH
DOMAIN PROTEIN

(Homo sapiens) 		PF09034
(TRADD_N) 		5 LEU A 125
GLY A  84
ALA A  89
LEU A 129
GLY A  54
 None
 0.91A 4dc3A-1f2hA:
undetectable		 4dc3A-1f2hA:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i74 PROBABLE
MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE

(Streptococcus
mutans) 		PF01368
(DHH)
PF02833
(DHHA2) 		5 ASP A 162
GLY A 117
ALA A 119
GLY A 145
ASP A  14
 None
None
MN  A 402 ( 4.9A)
None
MN  A 402 (-3.3A)
 0.88A 4dc3A-1i74A:
undetectable		 4dc3A-1i74A:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iyn CHLOROPLASTIC
ASCORBATE PEROXIDASE

(Nicotiana
tabacum) 		PF00141
(peroxidase) 		5 LEU A 159
GLY A  50
ALA A  52
ASN A  53
LEU A 151
 HEM  A 296 (-4.0A)
None
None
NA  A 298 (-2.9A)
None
 0.94A 4dc3A-1iynA:
undetectable		 4dc3A-1iynA:
23.86
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.
1j3b ATP-DEPENDENT
PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Thermus
thermophilus) 		PF01293
(PEPCK_ATP) 		5 LEU A 441
ALA A 347
THR A 444
LEU A 241
GLY A 351
 None
 1.03A 4dc3A-1j3bA:
undetectable		 4dc3A-1j3bA:
21.28
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.
1jp4 3'(2'),5'-BISPHOSPHA
TE NUCLEOTIDASE

(Rattus
norvegicus) 		PF00459
(Inositol_P) 		5 ASP A 120
LEU A 270
GLY A 220
THR A 248
LEU A 262
 MG  A 701 (-3.1A)
None
AMP  A 601 (-3.5A)
None
None
 0.92A 4dc3A-1jp4A:
undetectable		 4dc3A-1jp4A:
23.56
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.
1k20 MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE

(Streptococcus
gordonii) 		PF01368
(DHH)
PF02833
(DHHA2) 		5 ASP A 164
GLY A 119
ALA A 121
GLY A 147
ASP A  15
 None
None
MN  A 702 ( 4.6A)
None
MN  A 702 (-3.1A)
 0.91A 4dc3A-1k20A:
undetectable		 4dc3A-1k20A:
23.63
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.
1kol FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 198
ALA A 192
LEU A 223
GLY A 263
ASP A 260
 None
NAD  A1403 ( 4.1A)
None
NAD  A1403 ( 4.0A)
None
 1.00A 4dc3A-1kolA:
4.9		 4dc3A-1kolA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ly7 FRATAXIN

(Homo sapiens) 		PF01491
(Frataxin_Cyay) 		5 LEU A 103
GLY A 207
THR A 102
LEU A 106
GLY A 170
 None
 0.99A 4dc3A-1ly7A:
undetectable		 4dc3A-1ly7A:
13.48
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.
1p8r ARGINASE 1

(Rattus
norvegicus) 		PF00491
(Arginase) 		5 LEU A 219
GLY A 178
MET A 212
THR A 215
GLY A 257
 None
 0.98A 4dc3A-1p8rA:
2.4		 4dc3A-1p8rA:
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.
1tz6 PUTATIVE SUGAR
KINASE

(Salmonella
enterica) 		PF00294
(PfkB) 		6 ASP A  16
GLY A  30
ALA A  32
ASN A  35
GLY A 249
ASP A 252
 AIS  A 402 (-2.5A)
AIS  A 402 ( 4.2A)
AIS  A 402 ( 4.2A)
AIS  A 402 (-3.9A)
AIS  A 402 ( 4.5A)
AIS  A 402 (-3.0A)
 0.48A 4dc3A-1tz6A:
29.7		 4dc3A-1tz6A:
27.82
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.
1uz5 402AA LONG
HYPOTHETICAL
MOLYBDOPTERIN
BIOSYNTHESIS MOEA
PROTEIN

(Pyrococcus
horikoshii) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		5 LEU A 300
GLY A 223
ALA A 215
ASN A 217
VAL A 185
 None
 0.96A 4dc3A-1uz5A:
undetectable		 4dc3A-1uz5A:
22.83
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.
1v19 2-KETO-3-DEOXYGLUCON
ATE KINASE

(Thermus
thermophilus) 		PF00294
(PfkB) 		6 LEU A 170
ALA A  35
ASN A  38
LEU A 138
GLY A 248
ASP A 251
 None
 1.07A 4dc3A-1v19A:
31.4		 4dc3A-1v19A:
24.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v19 2-KETO-3-DEOXYGLUCON
ATE KINASE

(Thermus
thermophilus) 		PF00294
(PfkB) 		6 LEU A 170
GLY A  33
ALA A  35
ASN A  38
GLY A 248
ASP A 251
 None
 0.93A 4dc3A-1v19A:
31.4		 4dc3A-1v19A:
24.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2abq FRUCTOSE 1-PHOSPHATE
KINASE

(Bacillus
halodurans) 		PF00294
(PfkB) 		6 ASN A   8
ASP A  12
GLY A  36
ASN A  41
GLY A 246
ASP A 249
 None
 1.12A 4dc3A-2abqA:
25.2		 4dc3A-2abqA:
24.06
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.
2afb 2-KETO-3-DEOXYGLUCON
ATE KINASE

(Thermotoga
maritima) 		PF00294
(PfkB) 		7 LEU A 171
GLY A  32
ALA A  34
ASN A  37
LEU A 139
GLY A 277
ASP A 280
 None
 1.07A 4dc3A-2afbA:
28.9		 4dc3A-2afbA:
25.19
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.
2ajr SUGAR KINASE, PFKB
FAMILY

(Thermotoga
maritima) 		PF00294
(PfkB) 		6 ASN A   8
ASP A  12
GLY A  39
ASN A  44
GLY A 258
ASP A 261
 None
ACT  A 321 (-3.1A)
ACT  A 321 ( 4.3A)
ACT  A 321 (-3.9A)
None
None
 1.00A 4dc3A-2ajrA:
24.0		 4dc3A-2ajrA:
23.59
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.
2bq8 TARTRATE-RESISTANT
ACID PHOSPHATASE
TYPE 5

(Homo sapiens) 		PF00149
(Metallophos) 		5 LEU X 139
GLY X 218
THR X 136
LEU X 134
GLY X 194
 None
 1.03A 4dc3A-2bq8X:
undetectable		 4dc3A-2bq8X:
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.
2c49 SUGAR KINASE MJ0406

(Methanocaldococcus
jannaschii) 		PF00294
(PfkB) 		6 ASP A  17
ALA A  44
ASN A  47
THR A 111
GLY A 244
ASP A 247
 ADN  A1301 (-2.8A)
ADN  A1301 ( 4.1A)
ADN  A1301 (-3.4A)
ADN  A1301 (-3.1A)
None
ADN  A1301 (-2.9A)
 1.18A 4dc3A-2c49A:
27.3		 4dc3A-2c49A:
25.52
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.
2c49 SUGAR KINASE MJ0406

(Methanocaldococcus
jannaschii) 		PF00294
(PfkB) 		6 ASP A  17
GLY A  42
ALA A  44
ASN A  47
GLY A 244
ASP A 247
 ADN  A1301 (-2.8A)
ADN  A1301 (-3.4A)
ADN  A1301 ( 4.1A)
ADN  A1301 (-3.4A)
None
ADN  A1301 (-2.9A)
 0.73A 4dc3A-2c49A:
27.3		 4dc3A-2c49A:
25.52
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.
2ddu REELIN

(Mus musculus) 		no annotation 5 LEU A1459
GLY A1488
LEU A1484
GLY A1364
ASP A1365
 None
 1.00A 4dc3A-2dduA:
undetectable		 4dc3A-2dduA:
22.20
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.
2dw6 BLL6730 PROTEIN

(Bradyrhizobium
japonicum) 		PF13378
(MR_MLE_C) 		5 LEU A  73
ALA A 119
VAL A  93
MET A  97
GLY A 114
 None
 0.95A 4dc3A-2dw6A:
undetectable		 4dc3A-2dw6A:
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.
2enx MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE

(Streptococcus
agalactiae) 		PF01368
(DHH)
PF02833
(DHHA2) 		5 ASP A 164
GLY A 119
ALA A 121
GLY A 147
ASP A  15
 None
None
MN  A 402 ( 4.9A)
None
MN  A 402 (-3.2A)
 0.98A 4dc3A-2enxA:
undetectable		 4dc3A-2enxA:
22.62
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.
2f02 TAGATOSE-6-PHOSPHATE
KINASE

(Enterococcus
faecalis) 		PF00294
(PfkB) 		5 ASP A  12
GLY A  36
ASN A  41
GLY A 252
ASP A 255
 None
None
None
ATP  A 411 (-3.6A)
ATP  A 411 (-4.1A)
 0.88A 4dc3A-2f02A:
24.2		 4dc3A-2f02A:
22.31
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.
2f43 ATP SYNTHASE ALPHA
CHAIN, MITOCHONDRIAL

(Rattus
norvegicus) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 ASP A 154
LEU A 352
GLY A 149
ASN A 185
VAL A 153
 None
 1.00A 4dc3A-2f43A:
2.3		 4dc3A-2f43A:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fkn UROCANATE HYDRATASE

(Bacillus
subtilis) 		PF01175
(Urocanase)
PF17391
(Urocanase_N)
PF17392
(Urocanase_C) 		5 ASN A 185
VAL A 189
THR A 166
LEU A 161
GLY A 175
 None
None
None
None
NAD  A5555 (-3.7A)
 0.86A 4dc3A-2fknA:
3.5		 4dc3A-2fknA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fkn UROCANATE HYDRATASE

(Bacillus
subtilis) 		PF01175
(Urocanase)
PF17391
(Urocanase_N)
PF17392
(Urocanase_C) 		5 ASN A 185
VAL A 189
THR A 166
LEU A 161
GLY A 176
 None
 0.87A 4dc3A-2fknA:
3.5		 4dc3A-2fknA:
21.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i6b ADENOSINE KINASE

(Homo sapiens) 		PF00294
(PfkB) 		8 ASN A  14
ASP A  18
LEU A  40
GLY A  63
ASN A  68
LEU A 138
GLY A 297
ASP A 300
 89I  A 500 (-4.0A)
None
89I  A 500 ( 4.8A)
None
None
89I  A 500 (-4.4A)
None
None
 0.92A 4dc3A-2i6bA:
41.5		 4dc3A-2i6bA:
36.10
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.
2jg5 FRUCTOSE 1-PHOSPHATE
KINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		5 ASP A  12
GLY A  36
ASN A  41
GLY A 246
ASP A 249
 None
 0.76A 4dc3A-2jg5A:
24.8		 4dc3A-2jg5A:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qcv PUTATIVE
5-DEHYDRO-2-DEOXYGLU
CONOKINASE

(Bacillus
halodurans) 		PF00294
(PfkB) 		5 ASP A  22
GLY A  43
ASN A  48
GLY A 269
ASP A 272
 None
None
None
None
PGE  A 332 (-3.6A)
 0.46A 4dc3A-2qcvA:
30.7		 4dc3A-2qcvA:
23.41
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.
2v26 MYOSIN VI

(Sus scrofa) 		PF00063
(Myosin_head) 		5 ASN A  62
LEU A 689
ASN A  92
VAL A 697
LEU A  73
 None
 0.94A 4dc3A-2v26A:
undetectable		 4dc3A-2v26A:
18.57
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.
2xpz LEUKOTRIENE A-4
HYDROLASE

(Saccharomyces
cerevisiae) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		5 ASN A 639
LEU A 671
GLY A 634
VAL A 665
GLY A 623
 None
 0.87A 4dc3A-2xpzA:
undetectable		 4dc3A-2xpzA:
20.57
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.
3all 2-METHYL-3-HYDROXYPY
RIDINE-5-CARBOXYLIC
ACID OXYGENASE

(Mesorhizobium
japonicum) 		PF01494
(FAD_binding_3) 		6 LEU A 151
GLY A  19
ALA A  22
VAL A  16
LEU A  30
GLY A 157
 None
FAD  A 380 ( 4.4A)
FAD  A 380 (-3.2A)
None
None
FAD  A 380 ( 3.8A)
 1.42A 4dc3A-3allA:
3.0		 4dc3A-3allA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b1r RIBOKINASE, PUTATIVE

(Burkholderia
thailandensis) 		PF00294
(PfkB) 		5 ASP A  12
GLY A  47
ASN A  52
GLY A 250
ASP A 253
 AMP  A 501 (-2.9A)
AMP  A 501 ( 3.7A)
AMP  A 501 (-3.3A)
AMP  A 501 (-3.4A)
AMP  A 501 (-2.8A)
 0.75A 4dc3A-3b1rA:
26.1		 4dc3A-3b1rA:
24.08
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.
3bdk D-MANNONATE
DEHYDRATASE

(Streptococcus
suis) 		PF03786
(UxuA) 		5 ASP A 308
LEU A 150
GLY A 307
ASN A 289
GLY A 259
 None
 0.99A 4dc3A-3bdkA:
undetectable		 4dc3A-3bdkA:
25.82
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.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459

(Pyrococcus
horikoshii) 		PF00294
(PfkB) 		6 ASP A  13
ALA A  35
ASN A  38
LEU A 167
GLY A 244
ASP A 247
 None
 1.12A 4dc3A-3ewmA:
30.0		 4dc3A-3ewmA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459

(Pyrococcus
horikoshii) 		PF00294
(PfkB) 		7 ASP A  13
LEU A 167
GLY A  33
ALA A  35
ASN A  38
GLY A 244
ASP A 247
 None
 1.07A 4dc3A-3ewmA:
30.0		 4dc3A-3ewmA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459

(Pyrococcus
horikoshii) 		PF00294
(PfkB) 		7 ASP A  13
LEU A 167
GLY A  33
ALA A  35
ASN A  38
VAL A  90
ASP A 247
 None
 0.89A 4dc3A-3ewmA:
30.0		 4dc3A-3ewmA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459

(Pyrococcus
horikoshii) 		PF00294
(PfkB) 		6 LEU A 167
ALA A  35
ASN A  38
LEU A 103
GLY A 246
ASP A 247
 None
 1.43A 4dc3A-3ewmA:
30.0		 4dc3A-3ewmA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3go7 RIBOKINASE RBSK

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		5 ASP A  25
GLY A  50
ASN A  55
GLY A 239
ASP A 242
 RIB  A 305 (-2.8A)
RIB  A 305 ( 3.7A)
RIB  A 305 (-3.2A)
RIB  A 305 ( 4.5A)
RIB  A 305 (-2.9A)
 0.50A 4dc3A-3go7A:
26.1		 4dc3A-3go7A:
24.55
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.
3hj6 FRUCTOKINASE

(Halothermothrix
orenii) 		PF00294
(PfkB) 		6 ASP A  33
LEU A 188
GLY A  54
ASN A  59
VAL A 111
ASP A 275
 None
 1.01A 4dc3A-3hj6A:
28.8		 4dc3A-3hj6A:
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.
3hrp UNCHARACTERIZED
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF01833
(TIG) 		5 LEU A 247
GLY A 243
LEU A 254
GLY A 348
ASP A 405
 None
 0.99A 4dc3A-3hrpA:
undetectable		 4dc3A-3hrpA:
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.
3hwr 2-DEHYDROPANTOATE
2-REDUCTASE

(Cupriavidus
pinatubonensis) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 LEU A  72
GLY A  23
ALA A 161
VAL A  26
LEU A  70
 None
 0.96A 4dc3A-3hwrA:
5.7		 4dc3A-3hwrA:
25.06
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.
3i3w PHOSPHOGLUCOSAMINE
MUTASE

(Francisella
tularensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 ASN A 205
GLY A 182
ALA A 203
GLY A 216
ASP A 178
 None
 0.93A 4dc3A-3i3wA:
undetectable		 4dc3A-3i3wA:
21.55
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.
3i3y CARBOHYDRATE KINASE

(Klebsiella
pneumoniae) 		PF00294
(PfkB) 		5 ASP A  12
GLY A  37
ASN A  42
GLY A 229
ASP A 232
 None
 0.89A 4dc3A-3i3yA:
25.1		 4dc3A-3i3yA:
26.00
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.
3in1 UNCHARACTERIZED
SUGAR KINASE YDJH

(Escherichia
coli) 		PF00294
(PfkB) 		5 ASP A  15
GLY A  41
ASN A  46
GLY A 257
ASP A 260
 None
None
None
NA  A 411 ( 4.9A)
None
 0.76A 4dc3A-3in1A:
29.8		 4dc3A-3in1A:
26.56
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.
3lki FRUCTOKINASE

(Xylella
fastidiosa) 		PF00294
(PfkB) 		5 ASP A  24
GLY A  44
ALA A  46
ASN A  49
ASP A 270
 None
 0.77A 4dc3A-3lkiA:
26.9		 4dc3A-3lkiA:
24.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3loo ANOPHELES GAMBIAE
ADENOSINE KINASE

(Anopheles
gambiae) 		PF00294
(PfkB) 		8 ASN A  14
ASP A  18
LEU A  40
GLY A  63
ASN A  68
LEU A 137
GLY A 297
ASP A 300
 B4P  A 349 ( 4.0A)
B4P  A 349 (-2.8A)
None
B4P  A 349 ( 3.8A)
B4P  A 349 (-3.6A)
None
B4P  A 349 (-2.9A)
B4P  A 349 (-3.4A)
 0.55A 4dc3A-3looA:
46.4		 4dc3A-3looA:
38.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3loo ANOPHELES GAMBIAE
ADENOSINE KINASE

(Anopheles
gambiae) 		PF00294
(PfkB) 		6 ASN A  14
LEU A  40
ASN A  68
LEU A 137
GLY A 299
ASP A 300
 B4P  A 349 ( 4.0A)
None
B4P  A 349 (-3.6A)
None
B4P  A 349 (-3.3A)
B4P  A 349 (-3.4A)
 1.37A 4dc3A-3looA:
46.4		 4dc3A-3looA:
38.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3otx ADENOSINE KINASE,
PUTATIVE

(Trypanosoma
brucei) 		PF00294
(PfkB) 		7 ASN A  13
ASP A  17
LEU A  39
GLY A  62
ASN A  67
LEU A 138
ASP A 299
 AP5  A 346 (-4.1A)
AP5  A 346 (-2.8A)
None
AP5  A 346 (-3.6A)
AP5  A 346 (-3.4A)
None
AP5  A 346 ( 3.2A)
 0.43A 4dc3A-3otxA:
43.6		 4dc3A-3otxA:
30.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3otx ADENOSINE KINASE,
PUTATIVE

(Trypanosoma
brucei) 		PF00294
(PfkB) 		6 ASN A  13
LEU A  39
ASN A  67
LEU A 138
GLY A 298
ASP A 299
 AP5  A 346 (-4.1A)
None
AP5  A 346 (-3.4A)
None
AP5  A 346 (-3.2A)
AP5  A 346 ( 3.2A)
 1.38A 4dc3A-3otxA:
43.6		 4dc3A-3otxA:
30.65
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.
3pl2 SUGAR KINASE,
RIBOKINASE FAMILY

(Corynebacterium
glutamicum) 		PF00294
(PfkB) 		5 ASP A  19
GLY A  40
ASN A  45
GLY A 261
ASP A 264
 None
 0.48A 4dc3A-3pl2A:
30.2		 4dc3A-3pl2A:
23.92
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.
3q1y LIN2199 PROTEIN

(Listeria
innocua) 		PF00294
(PfkB) 		5 ASN A   8
ASP A  12
GLY A  37
GLY A 248
ASP A 251
 None
 0.98A 4dc3A-3q1yA:
24.7		 4dc3A-3q1yA:
23.50
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.
3rht (GATASE1)-LIKE
PROTEIN

(Planctopirus
limnophila) 		PF07090
(GATase1_like) 		5 GLY A  83
ASN A 152
LEU A  79
GLY A  90
ASP A 113
 None
 1.00A 4dc3A-3rhtA:
3.0		 4dc3A-3rhtA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ty4 PROBABLE
HOMOISOCITRATE
DEHYDROGENASE

(Schizosaccharomyces
pombe) 		PF00180
(Iso_dh) 		5 ALA A  14
THR A  63
LEU A  67
GLY A  50
ASP A  15
 None
GOL  A 363 (-3.9A)
None
None
None
 1.02A 4dc3A-3ty4A:
undetectable		 4dc3A-3ty4A:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u4g NAMN:DMB
PHOSPHORIBOSYLTRANSF
ERASE

(Pyrococcus
horikoshii) 		no annotation 5 LEU A 289
GLY A 300
ALA A  66
VAL A 297
ASP A  40
 None
None
None
None
ACY  A 338 ( 4.2A)
 0.97A 4dc3A-3u4gA:
undetectable		 4dc3A-3u4gA:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti) 		PF00294
(PfkB) 		10 ASN A  11
ASP A  15
LEU A  37
GLY A  58
ASN A  63
MET A 127
THR A 129
LEU A 131
GLY A 275
ASP A 278
 ADN  A 353 (-3.7A)
ADN  A 353 (-2.8A)
None
ADN  A 353 (-3.3A)
ADN  A 353 (-3.4A)
ADN  A 353 (-3.3A)
ADN  A 353 (-3.3A)
None
ADN  A 353 (-3.7A)
ADN  A 353 (-3.3A)
 0.74A 4dc3A-3uboA:
38.0		 4dc3A-3uboA:
25.30
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.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti) 		PF00294
(PfkB) 		6 ASP A  15
LEU A 131
ASN A  63
THR A 129
GLY A 275
ASP A 278
 ADN  A 353 (-2.8A)
None
ADN  A 353 (-3.4A)
ADN  A 353 (-3.3A)
ADN  A 353 (-3.7A)
ADN  A 353 (-3.3A)
 1.49A 4dc3A-3uboA:
38.0		 4dc3A-3uboA:
25.30
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.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti) 		PF00294
(PfkB) 		6 LEU A  37
GLY A  59
ASN A  63
MET A 127
THR A 129
LEU A 131
 None
ADN  A 353 (-3.2A)
ADN  A 353 (-3.4A)
ADN  A 353 (-3.3A)
ADN  A 353 (-3.3A)
None
 1.30A 4dc3A-3uboA:
38.0		 4dc3A-3uboA:
25.30
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.
3ucq AMYLOSUCRASE

(Deinococcus
geothermalis) 		PF00128
(Alpha-amylase) 		5 LEU A 112
ALA A  96
VAL A 120
LEU A 165
GLY A 498
 None
 0.77A 4dc3A-3ucqA:
undetectable		 4dc3A-3ucqA:
19.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vas PUTATIVE ADENOSINE
KINASE

(Schistosoma
mansoni) 		PF00294
(PfkB) 		12 ASN A  14
ASP A  18
LEU A  40
GLY A  63
ALA A  65
ASN A  68
VAL A 123
MET A 134
THR A 136
LEU A 138
GLY A 299
ASP A 302
 ADN  A 401 ( 4.0A)
ADN  A 401 (-2.7A)
None
ADN  A 401 ( 3.8A)
ADN  A 401 (-3.8A)
ADN  A 401 (-3.7A)
ADN  A 401 (-4.5A)
ADN  A 401 ( 4.0A)
ADN  A 401 (-3.1A)
ADN  A 401 (-4.9A)
ADN  A 401 ( 3.8A)
ADN  A 401 (-2.9A)
 0.27A 4dc3A-3vasA:
57.8		 4dc3A-3vasA:
99.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vas PUTATIVE ADENOSINE
KINASE

(Schistosoma
mansoni) 		PF00294
(PfkB) 		6 ASN A  14
LEU A  40
ALA A  65
ASN A  68
GLY A 301
ASP A 302
 ADN  A 401 ( 4.0A)
None
ADN  A 401 (-3.8A)
ADN  A 401 (-3.7A)
None
ADN  A 401 (-2.9A)
 1.38A 4dc3A-3vasA:
57.8		 4dc3A-3vasA:
99.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vas PUTATIVE ADENOSINE
KINASE

(Schistosoma
mansoni) 		PF00294
(PfkB) 		6 GLY A  64
ASN A  68
VAL A 123
MET A 134
THR A 136
GLY A 299
 ADN  A 401 (-3.7A)
ADN  A 401 (-3.7A)
ADN  A 401 (-4.5A)
ADN  A 401 ( 4.0A)
ADN  A 401 (-3.1A)
ADN  A 401 ( 3.8A)
 1.15A 4dc3A-3vasA:
57.8		 4dc3A-3vasA:
99.46
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.
4anj UNCONVENTIONAL
MYOSIN-VI, GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria;
Sus scrofa) 		PF00063
(Myosin_head)
PF01353
(GFP) 		5 ASN A  62
LEU A 689
ASN A  92
VAL A 697
LEU A  73
 None
 1.00A 4dc3A-4anjA:
undetectable		 4dc3A-4anjA:
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.
4ays AMYLOSUCRASE

(Deinococcus
radiodurans) 		PF00128
(Alpha-amylase) 		5 LEU A 108
ALA A  92
VAL A 116
LEU A 161
GLY A 490
 None
 0.92A 4dc3A-4aysA:
undetectable		 4dc3A-4aysA:
19.52
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.
4cbp NEURAL/ECTODERMAL
DEVELOPMENT FACTOR
IMP-L2

(Drosophila
melanogaster) 		PF07679
(I-set) 		5 LEU A 161
GLY A  59
ALA A  30
GLY A 119
ASP A  31
 None
 0.88A 4dc3A-4cbpA:
undetectable		 4dc3A-4cbpA:
24.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4du5 PFKB

(Polaromonas sp.
JS666) 		PF00294
(PfkB) 		5 LEU A 197
ALA A  60
ASN A  63
GLY A 282
ASP A 285
 None
CL  A 401 ( 4.3A)
None
None
None
 0.96A 4dc3A-4du5A:
30.5		 4dc3A-4du5A:
26.75
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.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli) 		PF00294
(PfkB) 		10 ASN A   9
ASP A  13
LEU A  35
GLY A  56
ASN A  61
MET A 125
THR A 127
LEU A 129
GLY A 273
ASP A 276
 ADN  A 500 (-3.8A)
ADN  A 500 (-2.7A)
None
ADN  A 500 (-3.5A)
ADN  A 500 (-3.5A)
ADN  A 500 (-3.4A)
ADN  A 500 (-3.0A)
None
ADN  A 500 (-3.9A)
ADN  A 500 (-2.8A)
 0.64A 4dc3A-4e3aA:
38.4		 4dc3A-4e3aA:
28.54
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.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli) 		PF00294
(PfkB) 		6 ASP A  13
LEU A 129
ASN A  61
THR A 127
GLY A 273
ASP A 276
 ADN  A 500 (-2.7A)
None
ADN  A 500 (-3.5A)
ADN  A 500 (-3.0A)
ADN  A 500 (-3.9A)
ADN  A 500 (-2.8A)
 1.42A 4dc3A-4e3aA:
38.4		 4dc3A-4e3aA:
28.54
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.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli) 		PF00294
(PfkB) 		6 LEU A  35
GLY A  57
ASN A  61
MET A 125
THR A 127
LEU A 129
 None
ADN  A 500 (-3.7A)
ADN  A 500 (-3.5A)
ADN  A 500 (-3.4A)
ADN  A 500 (-3.0A)
None
 1.28A 4dc3A-4e3aA:
38.4		 4dc3A-4e3aA:
28.54
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.
4f6t MOLYBDENUM STORAGE
PROTEIN SUBUNIT
ALPHA
MOLYBDENUM STORAGE
PROTEIN SUBUNIT BETA

(Azotobacter
vinelandii) 		PF00696
(AA_kinase) 		5 ASP A  52
LEU B  12
ALA A  80
ASN A 112
GLY A  47
 None
None
ATP  A 301 (-3.7A)
None
ATP  A 301 (-3.1A)
 0.96A 4dc3A-4f6tA:
undetectable		 4dc3A-4f6tA:
20.94
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.
4g8k 2-5A-DEPENDENT
RIBONUCLEASE

(Homo sapiens) 		PF12796
(Ank_2)
PF13857
(Ank_5) 		5 LEU A 226
ALA A 246
VAL A 218
THR A 222
LEU A 206
 None
 1.03A 4dc3A-4g8kA:
undetectable		 4dc3A-4g8kA:
23.19
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.
4gm6 PFKB FAMILY
CARBOHYDRATE KINASE

(Listeria grayi) 		PF00294
(PfkB) 		6 LEU A 172
ALA A  35
ASN A  38
LEU A 140
GLY A 267
ASP A 270
 None
GOL  A 401 (-3.9A)
GOL  A 401 (-4.4A)
None
GOL  A 401 ( 4.5A)
GOL  A 401 (-3.0A)
 1.08A 4dc3A-4gm6A:
27.6		 4dc3A-4gm6A:
23.84
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.
4gm6 PFKB FAMILY
CARBOHYDRATE KINASE

(Listeria grayi) 		PF00294
(PfkB) 		6 LEU A 172
GLY A  33
ALA A  35
ASN A  38
GLY A 267
ASP A 270
 None
GOL  A 401 ( 4.1A)
GOL  A 401 (-3.9A)
GOL  A 401 (-4.4A)
GOL  A 401 ( 4.5A)
GOL  A 401 (-3.0A)
 0.91A 4dc3A-4gm6A:
27.6		 4dc3A-4gm6A:
23.84
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.
4ixu ARGINASE-2,
MITOCHONDRIAL

(Homo sapiens) 		PF00491
(Arginase) 		5 LEU A 238
GLY A 197
MET A 231
THR A 234
GLY A 276
 None
 0.90A 4dc3A-4ixuA:
3.9		 4dc3A-4ixuA:
20.94
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.
4jlw GLUTATHIONE-INDEPEND
ENT FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 199
ALA A 193
LEU A 224
GLY A 264
ASP A 261
 None
NAD  A 403 ( 4.1A)
None
NAD  A 403 ( 4.1A)
None
 1.00A 4dc3A-4jlwA:
4.8		 4dc3A-4jlwA:
23.09
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.
4kt1 LEUCINE-RICH
REPEAT-CONTAINING
G-PROTEIN COUPLED
RECEPTOR 4

(Homo sapiens) 		PF01462
(LRRNT)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 321
ALA A 291
THR A 318
LEU A 298
ASP A 265
 None
 0.98A 4dc3A-4kt1A:
undetectable		 4dc3A-4kt1A:
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.
4o2h PROTEIN BCAM1869

(Burkholderia
cenocepacia) 		PF16245
(DUF4902) 		5 LEU A 116
MET A 109
THR A 112
LEU A  25
ASP A  15
 None
 0.96A 4dc3A-4o2hA:
undetectable		 4dc3A-4o2hA:
18.46
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.
4okd ISOAMYLASE

(Chlamydomonas
reinhardtii) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 LEU A 681
GLY A 696
THR A 677
GLY A 726
ASP A 723
 None
 0.83A 4dc3A-4okdA:
undetectable		 4dc3A-4okdA:
19.14
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.
4oso REDUCTASE HOMOLOG

(Streptomyces
cyanogenus) 		PF13561
(adh_short_C2) 		5 LEU A  78
GLY A   6
ALA A  31
LEU A  91
GLY A  56
 None
 1.00A 4dc3A-4osoA:
7.4		 4dc3A-4osoA:
25.14
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.
4pvv ADENOSINE KINASE

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		5 ASP A  12
GLY A  47
ASN A  52
GLY A 254
ASP A 257
 HO4  A 401 (-2.4A)
HO4  A 401 (-3.5A)
HO4  A 401 (-3.8A)
HO4  A 401 ( 4.3A)
HO4  A 401 (-3.3A)
 0.74A 4dc3A-4pvvA:
26.9		 4dc3A-4pvvA:
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.
4wjm RIBOKINASE:CARBOHYDR
ATE KINASE, PFKB

(Brucella
abortus) 		PF00294
(PfkB) 		5 ASP A  11
GLY A  29
ASN A  34
GLY A 246
ASP A 249
 None
None
None
ANP  A 401 (-3.3A)
ANP  A 401 ( 4.3A)
 0.54A 4dc3A-4wjmA:
29.1		 4dc3A-4wjmA:
24.14
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.
4wjm RIBOKINASE:CARBOHYDR
ATE KINASE, PFKB

(Brucella
abortus) 		PF00294
(PfkB) 		5 LEU A 162
GLY A  29
ASN A  34
GLY A 246
ASP A 249
 None
None
None
ANP  A 401 (-3.3A)
ANP  A 401 ( 4.3A)
 0.95A 4dc3A-4wjmA:
29.1		 4dc3A-4wjmA:
24.14
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.
4wnx NETRIN-4

(Mus musculus) 		PF00053
(Laminin_EGF)
PF00055
(Laminin_N) 		5 LEU A 201
GLY A 266
LEU A 219
GLY A 324
ASP A 320
 None
 1.01A 4dc3A-4wnxA:
undetectable		 4dc3A-4wnxA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wy8 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		5 LEU A 107
GLY A 292
THR A 103
LEU A 307
GLY A  90
 None
 0.89A 4dc3A-4wy8A:
4.0		 4dc3A-4wy8A:
22.17
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		5 LEU A1488
GLY A1531
ALA A1528
VAL A1535
GLY A1563
 None
 0.93A 4dc3A-5a31A:
undetectable		 4dc3A-5a31A:
14.37
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.
5c41 RIBOKINASE

(Homo sapiens) 		PF00294
(PfkB) 		5 ASP A  27
GLY A  52
ASN A  57
GLY A 266
ASP A 269
 None
None
None
ACP  A 401 ( 4.1A)
NA  A 403 ( 4.7A)
 0.57A 4dc3A-5c41A:
31.8		 4dc3A-5c41A:
25.06
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.
5dn6 ATP SYNTHASE SUBUNIT
ALPHA

(Paracoccus
denitrificans) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 ASP A 154
LEU A 353
GLY A 149
ASN A 185
VAL A 153
 None
 0.99A 4dc3A-5dn6A:
2.4		 4dc3A-5dn6A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ey7 FRUCTOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		7 ASP A  30
GLY A  44
ALA A  46
ASN A  49
VAL A 101
GLY A 263
ASP A 266
 None
 0.70A 4dc3A-5ey7A:
29.6		 4dc3A-5ey7A:
23.85
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.
5hft GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Klebsiella
pneumoniae) 		PF01019
(G_glu_transpept) 		5 LEU A 208
GLY A 110
LEU A 195
GLY A  76
ASP A  57
 None
 0.88A 4dc3A-5hftA:
undetectable		 4dc3A-5hftA:
23.57
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.
5ks8 PYRUVATE CARBOXYLASE
SUBUNIT BETA

(Methylobacillus
flagellatus) 		PF00364
(Biotin_lipoyl)
PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		5 ASP C   8
GLY C 228
ALA C 241
VAL C  10
LEU C  18
 None
 0.87A 4dc3A-5ks8C:
undetectable		 4dc3A-5ks8C:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l3q SIGNAL RECOGNITION
PARTICLE RECEPTOR
SUBUNIT ALPHA

(Homo sapiens) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 LEU B 397
GLY B 551
ALA B 553
LEU B 626
GLY B 556
 None
 0.95A 4dc3A-5l3qB:
2.1		 4dc3A-5l3qB:
21.38
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.
5lcw ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		5 LEU A1488
GLY A1531
ALA A1528
VAL A1535
GLY A1563
 None
 0.89A 4dc3A-5lcwA:
undetectable		 4dc3A-5lcwA:
10.72
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.
5nkm PROTEIN SMG-9

(Caenorhabditis
elegans) 		no annotation 5 LEU D 282
GLY D  93
ALA D  91
THR D 240
ASP D 150
 None
 0.97A 4dc3A-5nkmD:
3.1		 4dc3A-5nkmD:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oc1 ARYL-ALCOHOL OXIDASE

(Pleurotus
eryngii) 		no annotation 5 LEU A 234
GLY A 307
ALA A 507
LEU A 280
GLY A 517
 None
None
None
FAD  A 602 ( 4.3A)
None
 1.02A 4dc3A-5oc1A:
2.9		 4dc3A-5oc1A:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z96 SHORT TRANSIENT
RECEPTOR POTENTIAL
CHANNEL 4

(Mus musculus) 		no annotation 5 GLY A  43
ALA A  77
ASN A  82
VAL A  48
LEU A  37
 None
 1.03A 4dc3A-5z96A:
undetectable		 4dc3A-5z96A:
11.83
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.
5zrx PHOSPHATIDYLINOSITOL
3,4,5-TRISPHOSPHATE
5-PHOSPHATASE
2,EPHRIN TYPE-A
RECEPTOR 2

(Mus musculus) 		no annotation 5 LEU A1255
GLY A1208
ALA A1206
THR A1252
GLY A1201
 None
 0.96A 4dc3A-5zrxA:
undetectable		 4dc3A-5zrxA:
13.61
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.
6cw5 RIBOKINASE

(Cryptococcus
neoformans) 		no annotation 5 ASP A  16
GLY A  41
ASN A  46
GLY A 270
ASP A 273
 GOL  A 400 (-2.8A)
GOL  A 400 (-3.5A)
GOL  A 400 (-3.3A)
None
None
 0.70A 4dc3A-6cw5A:
28.6		 4dc3A-6cw5A:
12.70
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.
6f5d ATP SYNTHASE ALPHA
CHAIN, MITOCHONDRIAL

(Trypanosoma
brucei) 		no annotation 5 ASP A 167
LEU A 365
GLY A 162
ASN A 198
VAL A 166
 None
 0.98A 4dc3A-6f5dA:
2.2		 4dc3A-6f5dA:
13.07
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.
1air PECTATE LYASE C

(Dickeya
chrysanthemi) 		PF00544
(Pec_lyase_C) 		4 LEU A 219
ILE A 252
GLY A 241
PHE A 257
 None
 1.05A 4dc3A-1airA:
undetectable		 4dc3A-1airA:
19.90
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.
1eqn DNA PRIMASE

(Escherichia
coli) 		PF08275
(Toprim_N)
PF10410
(DnaB_bind)
PF13155
(Toprim_2) 		4 LEU A 419
ILE A 399
GLY A 416
PHE A 373
 None
 1.13A 4dc3A-1eqnA:
undetectable		 4dc3A-1eqnA:
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.
1exb KV BETA2 PROTEIN

(Rattus
norvegicus) 		PF00248
(Aldo_ket_red) 		4 LEU A 321
ILE A  81
GLY A  55
PHE A  84
 NDP  A1000 (-4.0A)
None
NDP  A1000 (-2.7A)
None
 0.75A 4dc3A-1exbA:
3.2		 4dc3A-1exbA:
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.
1k2p TYROSINE-PROTEIN
KINASE BTK

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 LEU A 542
ILE A 432
GLY A 541
PHE A 442
 None
 1.08A 4dc3A-1k2pA:
undetectable		 4dc3A-1k2pA:
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.
1kwc 2,3-DIHYDROXYBIPHENY
L DIOXYGENASE

(Pseudomonas sp.
KKS102) 		PF00903
(Glyoxalase) 		4 LEU B   5
ILE B  49
GLY B 144
PHE B 210
 None
 0.81A 4dc3A-1kwcB:
undetectable		 4dc3A-1kwcB:
21.79
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.
1l1f GLUTAMATE
DEHYDROGENASE 1

(Homo sapiens) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 LEU A 377
ILE A 468
GLY A 226
PHE A 230
 None
 1.12A 4dc3A-1l1fA:
undetectable		 4dc3A-1l1fA:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE

(Paraburkholderia
xenovorans) 		PF00903
(Glyoxalase) 		4 LEU A   6
ILE A  50
GLY A 145
PHE A 211
 None
 0.92A 4dc3A-1lkdA:
undetectable		 4dc3A-1lkdA:
21.72
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.
1ll2 GLYCOGENIN-1

(Oryctolagus
cuniculus) 		PF01501
(Glyco_transf_8) 		4 LEU A  22
ILE A 111
GLY A  23
PHE A   6
 None
 0.84A 4dc3A-1ll2A:
2.7		 4dc3A-1ll2A:
21.91
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.
1lva SELENOCYSTEINE-SPECI
FIC ELONGATION
FACTOR

(Moorella
thermoacetica) 		PF09105
(SelB-wing_1)
PF09106
(SelB-wing_2)
PF09107
(SelB-wing_3) 		4 LEU A 577
ILE A 584
GLY A 578
PHE A 621
 None
 1.03A 4dc3A-1lvaA:
undetectable		 4dc3A-1lvaA:
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.
1m2v PROTEIN TRANSPORT
PROTEIN SEC24

(Saccharomyces
cerevisiae) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		4 LEU B 424
ILE B 442
GLY B 425
PHE B 486
 None
 0.91A 4dc3A-1m2vB:
undetectable		 4dc3A-1m2vB:
17.54
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.
1nl3 PREPROTEIN
TRANSLOCASE SECA 1
SUBUNIT

(Mycobacterium
tuberculosis) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		4 LEU A 222
ILE A 213
GLY A 182
PHE A 362
 None
 1.10A 4dc3A-1nl3A:
undetectable		 4dc3A-1nl3A:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nmn HYPOTHETICAL PROTEIN
YQGF

(Escherichia
coli) 		PF03652
(RuvX) 		4 LEU A  93
ILE A  83
GLY A  60
PHE A  79
 None
 0.98A 4dc3A-1nmnA:
undetectable		 4dc3A-1nmnA:
19.07
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.
1oqv TOXIN-COREGULATED
PILUS SUBUNIT

(Vibrio cholerae) 		PF05946
(TcpA) 		4 LEU A 115
ILE A 124
GLY A 193
PHE A 196
 None
 1.11A 4dc3A-1oqvA:
undetectable		 4dc3A-1oqvA:
23.26
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.
1pd1 PROTEIN TRANSPORT
PROTEIN SEC24

(Saccharomyces
cerevisiae) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		4 LEU A 424
ILE A 442
GLY A 425
PHE A 486
 None
 0.94A 4dc3A-1pd1A:
undetectable		 4dc3A-1pd1A:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r55 ADAM 33

(Homo sapiens) 		PF01421
(Reprolysin) 		4 LEU A 353
ILE A 253
GLY A 352
PHE A 397
 None
 1.11A 4dc3A-1r55A:
undetectable		 4dc3A-1r55A:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t2w SORTASE

(Staphylococcus
aureus) 		PF04203
(Sortase) 		4 LEU A  97
ILE A 117
GLY A 100
PHE A 130
 None
 1.10A 4dc3A-1t2wA:
undetectable		 4dc3A-1t2wA:
18.83
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.
1tlt PUTATIVE
OXIDOREDUCTASE
(VIRULENCE FACTOR
MVIM HOMOLOG)

(Escherichia
coli) 		PF01408
(GFO_IDH_MocA) 		4 LEU A  33
ILE A 276
GLY A   9
PHE A  70
 None
 1.09A 4dc3A-1tltA:
5.8		 4dc3A-1tltA:
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.
1tz7 4-ALPHA-GLUCANOTRANS
FERASE

(Aquifex
aeolicus) 		PF02446
(Glyco_hydro_77) 		4 LEU A 317
ILE A 351
GLY A 314
PHE A 288
 None
 0.96A 4dc3A-1tz7A:
undetectable		 4dc3A-1tz7A:
23.48
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.
1vft ALANINE RACEMASE

(Streptomyces
lavendulae) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 LEU A 134
ILE A 206
GLY A 133
PHE A 169
 KCX  A 129 ( 4.4A)
None
None
None
 1.12A 4dc3A-1vftA:
undetectable		 4dc3A-1vftA:
22.17
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.
1wsu SELENOCYSTEINE-SPECI
FIC ELONGATION
FACTOR

(Moorella
thermoacetica) 		PF09107
(SelB-wing_3) 		4 LEU A 577
ILE A 584
GLY A 578
PHE A 621
 None
 1.07A 4dc3A-1wsuA:
undetectable		 4dc3A-1wsuA:
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.
1z47 PUTATIVE
ABC-TRANSPORTER
ATP-BINDING PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		4 LEU A  46
ILE A  38
GLY A  45
PHE A 227
 None
 1.11A 4dc3A-1z47A:
undetectable		 4dc3A-1z47A:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cy8 D-PHENYLGLYCINE
AMINOTRANSFERASE

(Pseudomonas
stutzeri) 		PF00202
(Aminotran_3) 		4 LEU A 230
ILE A 183
GLY A 227
PHE A 223
 None
 0.99A 4dc3A-2cy8A:
undetectable		 4dc3A-2cy8A:
21.29
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.
2fu0 CYCLOPHILIN,
PUTATIVE

(Plasmodium
falciparum) 		PF00160
(Pro_isomerase) 		4 LEU A  21
ILE A  10
GLY A 124
PHE A 106
 None
 1.06A 4dc3A-2fu0A:
undetectable		 4dc3A-2fu0A:
17.25
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.
2fur HYPOTHETICAL PROTEIN

(Thermoplasma
acidophilum) 		PF12900
(Pyridox_ox_2) 		4 LEU A  72
ILE A  47
GLY A  70
PHE A  38
 None
 1.11A 4dc3A-2furA:
undetectable		 4dc3A-2furA:
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.
2he9 NK-TUMOR RECOGNITION
PROTEIN

(Homo sapiens) 		PF00160
(Pro_isomerase) 		4 LEU A 142
ILE A 125
GLY A 141
PHE A  25
 None
 1.14A 4dc3A-2he9A:
undetectable		 4dc3A-2he9A:
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.
2i6d RNA
METHYLTRANSFERASE,
TRMH FAMILY

(Porphyromonas
gingivalis) 		PF00588
(SpoU_methylase) 		4 LEU A 202
ILE A 217
GLY A 203
PHE A 180
 None
 0.91A 4dc3A-2i6dA:
2.4		 4dc3A-2i6dA:
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.
2iuj LIPOXYGENASE L-5

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		4 LEU A 842
ILE A 853
GLY A 841
PHE A 709
 None
 0.92A 4dc3A-2iujA:
undetectable		 4dc3A-2iujA:
19.65
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.
2ivd PROTOPORPHYRINOGEN
OXIDASE

(Myxococcus
xanthus) 		PF01593
(Amino_oxidase) 		4 LEU A 219
ILE A  85
GLY A 221
PHE A  65
 None
 0.88A 4dc3A-2ivdA:
3.7		 4dc3A-2ivdA:
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.
2k3o TUSP1

(Nephila
antipodiana) 		PF12042
(RP1-2) 		4 LEU A  61
ILE A  51
GLY A  59
PHE A  88
 None
 1.03A 4dc3A-2k3oA:
undetectable		 4dc3A-2k3oA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lao LYSINE, ARGININE,
ORNITHINE-BINDING
PROTEIN

(Salmonella
enterica) 		PF00497
(SBP_bac_3) 		4 LEU A  87
ILE A   8
GLY A 196
PHE A 210
 None
 1.13A 4dc3A-2laoA:
undetectable		 4dc3A-2laoA:
20.10
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.
2oo4 NEUROGENIC LOCUS
NOTCH HOMOLOG
PROTEIN 2

(Homo sapiens) 		PF00066
(Notch)
PF06816
(NOD)
PF07684
(NODP) 		4 LEU A1572
ILE A1549
GLY A1570
PHE A1565
 None
None
GOL  A7007 ( 3.7A)
None
 1.07A 4dc3A-2oo4A:
undetectable		 4dc3A-2oo4A:
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.
2p0q ALR1010 PROTEIN

(Nostoc sp. PCC
7120) 		PF11535
(Calci_bind_CcbP) 		4 LEU A  66
ILE A 100
GLY A  67
PHE A  44
 None
 1.06A 4dc3A-2p0qA:
undetectable		 4dc3A-2p0qA:
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.
2p88 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Bacillus cereus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A 268
ILE A 123
GLY A 273
PHE A 108
 None
 1.00A 4dc3A-2p88A:
undetectable		 4dc3A-2p88A:
23.22
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.
2qwv UPF0217 PROTEIN
VC_A1059

(Vibrio cholerae) 		PF04013
(Methyltrn_RNA_2) 		4 LEU A 127
ILE A 155
GLY A 125
PHE A 120
 None
 1.07A 4dc3A-2qwvA:
undetectable		 4dc3A-2qwvA:
19.35
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.
3b4r PUTATIVE ZINC
METALLOPROTEASE
MJ0392

(Methanocaldococcus
jannaschii) 		PF02163
(Peptidase_M50) 		4 LEU A 193
ILE A 180
GLY A 185
PHE A 184
 None
 1.06A 4dc3A-3b4rA:
undetectable		 4dc3A-3b4rA:
20.05
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.
3buz IOTA TOXIN COMPONENT
IA

(Clostridium
perfringens) 		PF03496
(ADPrib_exo_Tox) 		4 LEU A 304
ILE A 354
GLY A 303
PHE A 322
 None
 1.05A 4dc3A-3buzA:
undetectable		 4dc3A-3buzA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cjp PREDICTED
AMIDOHYDROLASE,
DIHYDROOROTASE
FAMILY

(Clostridium
acetobutylicum) 		PF04909
(Amidohydro_2) 		4 LEU A  77
ILE A  31
GLY A  92
PHE A  33
 None
 1.13A 4dc3A-3cjpA:
undetectable		 4dc3A-3cjpA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		4 LEU A 318
ILE A 435
GLY A 321
PHE A 295
 None
 1.02A 4dc3A-3d1jA:
6.4		 4dc3A-3d1jA:
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.
3ek5 URIDYLATE KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase) 		4 LEU A 148
ILE A 153
GLY A 145
PHE A 131
 None
 1.09A 4dc3A-3ek5A:
2.2		 4dc3A-3ek5A:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fdu PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Acinetobacter
baumannii) 		PF00378
(ECH_1) 		4 LEU A  35
ILE A 123
GLY A  71
PHE A  68
 None
 1.13A 4dc3A-3fduA:
undetectable		 4dc3A-3fduA:
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.
3g3s GCN5-RELATED
N-ACETYLTRANSFERASE

(Streptococcus
suis) 		PF12746
(GNAT_acetyltran) 		4 LEU A 137
ILE A 128
GLY A 147
PHE A 155
 None
 0.97A 4dc3A-3g3sA:
undetectable		 4dc3A-3g3sA:
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.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 LEU A 439
ILE A 573
GLY A 438
PHE A 276
 None
 1.12A 4dc3A-3k30A:
2.3		 4dc3A-3k30A:
19.97
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.
3kal HOMOGLUTATHIONE
SYNTHETASE

(Glycine max) 		PF03199
(GSH_synthase)
PF03917
(GSH_synth_ATP) 		4 LEU A 201
ILE A  34
GLY A 200
PHE A  29
 None
 1.11A 4dc3A-3kalA:
undetectable		 4dc3A-3kalA:
19.96
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.
3l6c SERINE RACEMASE

(Rattus
norvegicus) 		PF00291
(PALP) 		4 LEU A 290
ILE A 308
GLY A 289
PHE A 298
 None
 1.02A 4dc3A-3l6cA:
undetectable		 4dc3A-3l6cA:
22.96
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.
3luq SENSOR PROTEIN

(Geobacter
sulfurreducens) 		PF08448
(PAS_4) 		4 LEU A 153
ILE A 194
GLY A 191
PHE A 105
 None
 1.05A 4dc3A-3luqA:
undetectable		 4dc3A-3luqA:
15.73
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.
3m8f PUTATIVE DNA-BINDING
PROTEIN

(Bacillus
thuringiensis) 		no annotation 4 LEU A  86
ILE A  18
GLY A  87
PHE A  64
 None
 0.94A 4dc3A-3m8fA:
undetectable		 4dc3A-3m8fA:
20.32
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.
3n2t PUTATIVE
OXIDOREDUCTASE

(Gluconobacter
oxydans) 		PF00248
(Aldo_ket_red) 		4 LEU A 176
ILE A 138
GLY A 158
PHE A 162
 None
 0.85A 4dc3A-3n2tA:
2.4		 4dc3A-3n2tA:
24.94
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.
3og9 PROTEIN YAHD A
COPPER INDUCIBLE
HYDROLASE

(Lactococcus
lactis) 		PF01738
(DLH) 		4 LEU A 172
ILE A 181
GLY A 170
PHE A 165
 None
 1.07A 4dc3A-3og9A:
4.5		 4dc3A-3og9A:
20.32
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.
3poc ALPHA-GLUCOSIDASE

(Blautia obeum) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 LEU A  53
ILE A  92
GLY A  54
PHE A  90
 None
 0.91A 4dc3A-3pocA:
undetectable		 4dc3A-3pocA:
18.81
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.
3rmv GLYCOGENIN-1

(Homo sapiens) 		PF01501
(Glyco_transf_8) 		4 LEU A  22
ILE A 111
GLY A  23
PHE A   6
 None
 0.83A 4dc3A-3rmvA:
2.8		 4dc3A-3rmvA:
19.90
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.
3s51 FANCONI ANEMIA GROUP
I PROTEIN HOMOLOG

(Mus musculus) 		PF14674
(FANCI_S1-cap)
PF14675
(FANCI_S1)
PF14676
(FANCI_S2)
PF14677
(FANCI_S3)
PF14678
(FANCI_S4)
PF14679
(FANCI_HD1)
PF14680
(FANCI_HD2) 		4 LEU A 121
ILE A  73
GLY A 124
PHE A 112
 None
 0.84A 4dc3A-3s51A:
undetectable		 4dc3A-3s51A:
15.09
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.
3sto SERINE PROTEASE
INHIBITOR

(Schistosoma
haematobium) 		PF00079
(Serpin) 		4 LEU A  27
ILE A 382
GLY A 275
PHE A 384
 None
 1.05A 4dc3A-3stoA:
undetectable		 4dc3A-3stoA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tqi GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Coxiella
burnetii) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 LEU A 178
ILE A  55
GLY A 177
PHE A 197
 None
 1.04A 4dc3A-3tqiA:
undetectable		 4dc3A-3tqiA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3urg ALR1010 PROTEIN

(Nostoc sp. PCC
7120) 		PF11535
(Calci_bind_CcbP) 		4 LEU A  66
ILE A 100
GLY A  67
PHE A  44
 None
 1.05A 4dc3A-3urgA:
undetectable		 4dc3A-3urgA:
22.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vas PUTATIVE ADENOSINE
KINASE

(Schistosoma
mansoni) 		PF00294
(PfkB) 		4 LEU A  16
ILE A  38
GLY A  64
PHE A 169
 ADN  A 401 (-4.7A)
ADN  A 401 (-4.3A)
ADN  A 401 (-3.7A)
ADN  A 401 (-3.7A)
 0.60A 4dc3A-3vasA:
57.8		 4dc3A-3vasA:
99.46
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.
3wrv TM-1 PROTEIN

(Solanum
lycopersicum) 		PF06792
(UPF0261) 		4 LEU A 116
ILE A  14
GLY A 118
PHE A 135
 None
 0.87A 4dc3A-3wrvA:
6.4		 4dc3A-3wrvA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wry TM-1 PROTEIN

(Solanum
lycopersicum) 		PF06792
(UPF0261) 		4 LEU A 116
ILE A  14
GLY A 118
PHE A 135
 None
 0.85A 4dc3A-3wryA:
3.8		 4dc3A-3wryA:
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.
4aso TUBR FROM BACILLUS
THURINGIENSIS
PBTOXIS

(Bacillus
thuringiensis) 		no annotation 4 LEU A  86
ILE A  18
GLY A  87
PHE A  64
 None
 1.09A 4dc3A-4asoA:
undetectable		 4dc3A-4asoA:
15.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bgn VOLTAGE-GATED SODIUM
CHANNEL

(Caldalkalibacillus
thermarum) 		PF00520
(Ion_trans) 		4 LEU A 168
ILE A 204
GLY A 165
PHE A 215
 None
 1.02A 4dc3A-4bgnA:
undetectable		 4dc3A-4bgnA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		4 LEU A  79
ILE A  39
GLY A  80
PHE A  35
 None
None
LLP  A  77 ( 3.7A)
None
 1.07A 4dc3A-4d9iA:
3.1		 4dc3A-4d9iA:
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.
4dup QUINONE
OXIDOREDUCTASE

(Rhizobium etli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 LEU A 245
ILE A 241
GLY A 246
PHE A 244
 None
 1.01A 4dc3A-4dupA:
2.7		 4dc3A-4dupA:
25.06
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.
4e9k HYPOTHETICAL PROTEIN

(Bacteroides
ovatus) 		PF14717
(DUF4465) 		4 LEU A 160
ILE A 259
GLY A 256
PHE A  74
 None
 1.09A 4dc3A-4e9kA:
undetectable		 4dc3A-4e9kA:
19.00
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.
4h41 PUTATIVE
ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF14488
(DUF4434)
PF17134
(DUF5109) 		4 LEU A 355
ILE A  92
GLY A 353
PHE A 339
 None
 1.03A 4dc3A-4h41A:
undetectable		 4dc3A-4h41A:
21.09
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		4 LEU L 252
ILE L 270
GLY L 249
PHE L 210
 None
 1.06A 4dc3A-4heaL:
undetectable		 4dc3A-4heaL:
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.
4k25 PROBABLE TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN QRI7,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00814
(Peptidase_M22) 		4 LEU A 202
ILE A 299
GLY A 199
PHE A 257
 None
 0.88A 4dc3A-4k25A:
2.1		 4dc3A-4k25A:
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.
4kvf RHAMNOSE ABC
TRANSPORTER,
PERIPLASMIC
RHAMNOSE-BINDING
PROTEIN

(Kribbella
flavida) 		PF13407
(Peripla_BP_4) 		4 LEU A 316
ILE A 345
GLY A 313
PHE A 329
 None
 0.97A 4dc3A-4kvfA:
undetectable		 4dc3A-4kvfA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pcg VP1

(Human
polyomavirus 6) 		PF00718
(Polyoma_coat) 		4 LEU A 228
ILE A 243
GLY A 235
PHE A 284
 None
 1.14A 4dc3A-4pcgA:
undetectable		 4dc3A-4pcgA:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4psw HISTONE
ACETYLTRANSFERASE
TYPE B CATALYTIC
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00583
(Acetyltransf_1)
PF10394
(Hat1_N) 		4 LEU A 221
ILE A  23
GLY A 189
PHE A  63
 COA  A 401 ( 4.6A)
None
None
None
 1.06A 4dc3A-4pswA:
undetectable		 4dc3A-4pswA:
22.56
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.
4r9v SIALYLTRANSFERASE
0160

(Photobacterium
damselae) 		PF11477
(PM0188) 		4 LEU A 412
ILE A 378
GLY A 413
PHE A 415
 None
 1.11A 4dc3A-4r9vA:
5.6		 4dc3A-4r9vA:
25.29
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.
4rqu ALCOHOL
DEHYDROGENASE

(Arabidopsis
thaliana) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 LEU A 179
ILE A 371
GLY A 209
PHE A 238
 None
 1.08A 4dc3A-4rquA:
3.8		 4dc3A-4rquA:
23.45
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.
4tn0 UPF0141 PROTEIN YJDB

(Campylobacter
jejuni) 		PF00884
(Sulfatase) 		4 LEU A 487
ILE A 349
GLY A 488
PHE A 490
 None
 1.12A 4dc3A-4tn0A:
undetectable		 4dc3A-4tn0A:
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.
4v36 LYSYL-TRNA-DEPENDENT
L-YSYL-PHOSPHATIDYLG
YCEROL SYNTHASE

(Bacillus
licheniformis) 		PF09924
(DUF2156) 		4 LEU A 778
ILE A 797
GLY A 631
PHE A 628
 None
 1.12A 4dc3A-4v36A:
undetectable		 4dc3A-4v36A:
20.56
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.
4wm0 XYLOSIDE
XYLOSYLTRANSFERASE 1

(Mus musculus) 		PF01501
(Glyco_transf_8) 		4 LEU A 347
ILE A 222
GLY A 251
PHE A 241
 None
 1.09A 4dc3A-4wm0A:
undetectable		 4dc3A-4wm0A:
19.35
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.
5anb ELONGATION FACTOR TU
GTP-BINDING
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF14492
(EFG_II) 		4 LEU K 766
ILE K 792
GLY K 832
PHE K 826
 None
 1.10A 4dc3A-5anbK:
undetectable		 4dc3A-5anbK:
16.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1

(Pseudomonas
stutzeri) 		PF00115
(COX1) 		4 LEU A 219
ILE A 248
GLY A 217
PHE A 212
 None
 1.14A 4dc3A-5djqA:
undetectable		 4dc3A-5djqA:
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.
5e3x THERMOSTABLE
CARBOXYPEPTIDASE 1

(Fervidobacterium
islandicum) 		PF02074
(Peptidase_M32) 		4 LEU A 409
ILE A 460
GLY A 410
PHE A 281
 None
 0.85A 4dc3A-5e3xA:
undetectable		 4dc3A-5e3xA:
21.86
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.
5erg TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61

(Saccharomyces
cerevisiae) 		PF08704
(GCD14) 		4 LEU B 226
ILE B 102
GLY B 225
PHE B 360
 None
 1.04A 4dc3A-5ergB:
3.9		 4dc3A-5ergB:
22.32
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.
5ex8 CYTOCHROME P450

(Streptomyces
toyocaensis) 		PF00067
(p450) 		4 LEU A  61
ILE A 293
GLY A  62
PHE A  66
 None
None
EDO  A 410 (-3.6A)
None
 0.90A 4dc3A-5ex8A:
undetectable		 4dc3A-5ex8A:
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.
5fjn L-AMINO ACID
DEAMINASE

(Cosenzaea
myxofaciens) 		PF01266
(DAO) 		4 LEU A 120
ILE A 462
GLY A 117
PHE A 165
 None
 1.04A 4dc3A-5fjnA:
3.3		 4dc3A-5fjnA:
23.16
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.
5fp1 TONB-DEPENDENT
SIDEROPHORE RECEPTOR

(Acinetobacter
baumannii) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 LEU A 208
ILE A 204
GLY A 172
PHE A 206
 None
 1.08A 4dc3A-5fp1A:
undetectable		 4dc3A-5fp1A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gv1 ENDO-1,4-BETA-XYLANA
SE

(termite gut
metagenome) 		PF00457
(Glyco_hydro_11) 		4 LEU A  59
ILE A 257
GLY A  84
PHE A 252
 None
 1.09A 4dc3A-5gv1A:
undetectable		 4dc3A-5gv1A:
26.34
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.
5gyg ENDO-1,4-BETA-XYLANA
SE

(termite gut
metagenome) 		PF00457
(Glyco_hydro_11) 		4 LEU A  59
ILE A 257
GLY A  84
PHE A 252
 None
 1.10A 4dc3A-5gygA:
undetectable		 4dc3A-5gygA:
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.
5ikg DYE-DECOLORIZING
PEROXIDASE

(Auricularia
auricula-judae) 		PF04261
(Dyp_perox) 		4 LEU A  76
ILE A  66
GLY A  72
PHE A  27
 None
 1.07A 4dc3A-5ikgA:
undetectable		 4dc3A-5ikgA:
20.72
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.
5j1k TOXR-ACTIVATED GENE
(TAGE)

(Helicobacter
pylori) 		PF01551
(Peptidase_M23) 		4 LEU A 254
ILE A 281
GLY A 255
PHE A 209
 None
 1.05A 4dc3A-5j1kA:
undetectable		 4dc3A-5j1kA:
26.68
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.
5j1l TOXR-ACTIVATED GENE
(TAGE)

(Helicobacter
pylori) 		PF01551
(Peptidase_M23) 		4 LEU A 258
ILE A 285
GLY A 212
PHE B 226
 None
 0.95A 4dc3A-5j1lA:
undetectable		 4dc3A-5j1lA:
24.13
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.
5j1l TOXR-ACTIVATED GENE
(TAGE)

(Helicobacter
pylori) 		PF01551
(Peptidase_M23) 		4 LEU B 254
ILE B 281
GLY B 208
PHE A 230
 None
 0.96A 4dc3A-5j1lB:
undetectable		 4dc3A-5j1lB:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j1l TOXR-ACTIVATED GENE
(TAGE)

(Helicobacter
pylori) 		PF01551
(Peptidase_M23) 		4 LEU B 254
ILE B 281
GLY B 255
PHE B 209
 None
 1.05A 4dc3A-5j1lB:
undetectable		 4dc3A-5j1lB:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jfc NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT ALPHA

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		4 LEU L 226
ILE L 160
GLY L 228
PHE L 411
 FAD  L 503 ( 4.8A)
None
None
FAD  L 503 (-3.4A)
 1.10A 4dc3A-5jfcL:
4.5		 4dc3A-5jfcL:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jri PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 4 LEU A 227
ILE A 223
GLY A 235
PHE A 226
 None
 1.14A 4dc3A-5jriA:
4.8		 4dc3A-5jriA:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k22 PROTEIN TYROSINE
PHOSPHATASE TYPE IVA
2

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 LEU A 105
ILE A 130
GLY A 106
PHE A 138
 None
 1.03A 4dc3A-5k22A:
undetectable		 4dc3A-5k22A:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ksd ATPASE 2, PLASMA
MEMBRANE-TYPE

(Arabidopsis
thaliana) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		4 LEU A 280
ILE A 654
GLY A 254
PHE A 658
 None
 1.07A 4dc3A-5ksdA:
undetectable		 4dc3A-5ksdA:
18.26
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.
5loa MESO-DIAMINOPIMELATE
D-DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF16654
(DAPDH_C) 		4 LEU A  14
ILE A 279
GLY A  15
PHE A  63
 NAP  A 401 (-4.2A)
None
None
None
 0.85A 4dc3A-5loaA:
5.0		 4dc3A-5loaA:
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.
5m11 IMMUNOREACTIVE 84KD
ANTIGEN PG93

(Porphyromonas
gingivalis) 		no annotation 4 LEU A 255
ILE A 224
GLY A 216
PHE A 226
 None
 1.14A 4dc3A-5m11A:
undetectable		 4dc3A-5m11A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ore OCTOPINE-BINDING
PERIPLASMIC PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 4 LEU A 200
ILE A 147
GLY A 112
PHE A 225
 None
 0.98A 4dc3A-5oreA:
undetectable		 4dc3A-5oreA:
12.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x5v GD

(Suid
alphaherpesvirus
1) 		PF01537
(Herpes_glycop_D) 		4 LEU A 176
ILE A 101
GLY A  52
PHE A  50
 None
 1.05A 4dc3A-5x5vA:
undetectable		 4dc3A-5x5vA:
19.18
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.
5xu5 ENDO-1,4-BETA-MANNAN
ASE

(Rhizopus
microsporus) 		no annotation 4 LEU B  86
ILE B  94
GLY B  56
PHE B  58
 None
 1.04A 4dc3A-5xu5B:
undetectable		 4dc3A-5xu5B:
13.12
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.
5z9s GLYCOSYL HYDROLASE
FAMILY 3 PROTEIN

(Bifidobacterium
longum) 		no annotation 4 LEU A 661
ILE A 592
GLY A 660
PHE A 655
 None
 1.14A 4dc3A-5z9sA:
4.5		 4dc3A-5z9sA:
11.89
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.
6bsz METABOTROPIC
GLUTAMATE RECEPTOR 8

(Homo sapiens) 		no annotation 4 LEU A 443
ILE A 174
GLY A 444
PHE A 461
 None
 1.07A 4dc3A-6bszA:
3.4		 4dc3A-6bszA:
12.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fnu METHYLENETETRAHYDROF
OLATE REDUCTASE 1

(Saccharomyces
cerevisiae) 		no annotation 4 LEU A 218
ILE A 280
GLY A 217
PHE A 197
 None
 0.67A 4dc3A-6fnuA:
undetectable		 4dc3A-6fnuA:
13.12
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
4
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 4 LEU M 367
ILE M 411
GLY M 404
PHE L 152
 None
 1.00A 4dc3A-6g2jM:
undetectable		 4dc3A-6g2jM:
11.52