SIMILAR PATTERNS OF AMINO ACIDS FOR 4DC3_A_ADNA401_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism
Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
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