SIMILAR PATTERNS OF AMINO ACIDS FOR 3T01_A_PPFA503_1

List of similar pattern of amino acids derived from ASSAM search

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

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


(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism
Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a5i PLASMINOGEN
ACTIVATOR


(Desmodus
rotundus)
PF00089
(Trypsin)
4 THR A 229
ASP A 102
HIS A  57
ILE A 213
None
None
0GJ  A 245 (-2.7A)
None
0.98A 3t01A-1a5iA:
undetectable
3t01A-1a5iA:
20.67
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.
1cyg CYCLODEXTRIN
GLUCANOTRANSFERASE


(Geobacillus
stearothermophilus)
PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C)
4 PHE A   9
THR A  10
ASN A   5
ASP A 315
None
1.07A 3t01A-1cygA:
undetectable
3t01A-1cygA:
22.07
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.
1d0n HORSE PLASMA
GELSOLIN


(Equus caballus)
PF00626
(Gelsolin)
4 PHE A 130
THR A 129
ASP A  84
HIS A  86
None
1.11A 3t01A-1d0nA:
undetectable
3t01A-1d0nA:
20.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ei6 PHOSPHONOACETATE
HYDROLASE


(Pseudomonas
fluorescens)
PF01663
(Phosphodiest)
7 PHE A  63
THR A  64
ASN A  85
ASP A 202
HIS A 206
ILE A 278
HIS A 368
None
ZN  A 408 ( 2.5A)
None
ZN  A 409 (-2.3A)
ZN  A 409 ( 3.3A)
None
ZN  A 409 ( 3.4A)
0.46A 3t01A-1ei6A:
62.6
3t01A-1ei6A:
54.52
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.
1id2 AMICYANIN

(Paracoccus
versutus)
PF00127
(Copper-bind)
4 PHE A  83
THR A  43
ASN A  84
ILE A   4
None
1.05A 3t01A-1id2A:
undetectable
3t01A-1id2A:
16.48
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.
1j5s URONATE ISOMERASE

(Thermotoga
maritima)
PF02614
(UxaC)
4 THR A 151
ASP A 231
HIS A 290
HIS A  30
None
0.93A 3t01A-1j5sA:
undetectable
3t01A-1j5sA:
22.07
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.
1pfx FACTOR IXA

(Sus scrofa)
PF00089
(Trypsin)
4 THR C 229
ASP C 102
HIS C  57
ILE C 213
None
None
0G6  C 301 (-2.5A)
None
0.98A 3t01A-1pfxC:
undetectable
3t01A-1pfxC:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1svv THREONINE ALDOLASE

(Leishmania
major)
PF01212
(Beta_elim_lyase)
4 THR A  40
ASP A  37
HIS A  50
HIS A  42
UNL  A 401 ( 4.2A)
UNL  A 401 (-1.9A)
UNL  A 401 (-3.4A)
UNL  A 401 (-3.0A)
1.06A 3t01A-1svvA:
undetectable
3t01A-1svvA:
25.28
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.
1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE


(Plasmodium
falciparum)
PF01242
(PTPS)
4 THR A 127
HIS A  41
ILE A  31
HIS A  29
BIO  A 175 ( 4.7A)
ZN  A 174 ( 3.3A)
BIO  A 175 (-4.2A)
ZN  A 174 ( 3.5A)
1.08A 3t01A-1y13A:
undetectable
3t01A-1y13A:
15.14
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.
1y3t HYPOTHETICAL PROTEIN
YXAG


(Bacillus
subtilis)
PF07883
(Cupin_2)
4 THR A 118
HIS A  62
ILE A  97
HIS A  64
None
FE  A 401 (-3.6A)
None
FE  A 401 (-3.3A)
1.04A 3t01A-1y3tA:
undetectable
3t01A-1y3tA:
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.
2anu HYPOTHETICAL PROTEIN
TM0559


(Thermotoga
maritima)
no annotation 4 ASN A 101
ASP A 193
HIS A 195
HIS A  15
None
ZN  A 605 (-2.4A)
ZN  A 505 (-3.4A)
ZN  A 405 (-3.4A)
1.09A 3t01A-2anuA:
undetectable
3t01A-2anuA:
20.62
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.
2cja SERYL-TRNA
SYNTHETASE


(Methanosarcina
barkeri)
no annotation 4 THR A 414
ASN A 439
HIS A 373
ILE A 438
None
1.09A 3t01A-2cjaA:
undetectable
3t01A-2cjaA:
23.06
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.
2cw2 SUPEROXIDE DISMUTASE
1


(Perkinsus
marinus)
PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C)
4 PHE A  83
ASN A 160
HIS A 166
HIS A  31
None
None
FE  A 402 (-3.1A)
FE  A 402 (-3.1A)
1.08A 3t01A-2cw2A:
undetectable
3t01A-2cw2A:
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.
2f6k METAL-DEPENDENT
HYDROLASE


(Lactobacillus
plantarum)
PF04909
(Amidohydro_2)
4 ASN A 156
ASP A 266
HIS A   7
HIS A 205
None
MN  A 402 (-2.7A)
MN  A 402 (-3.3A)
None
1.03A 3t01A-2f6kA:
undetectable
3t01A-2f6kA:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gsn PHOSPHODIESTERASE-NU
CLEOTIDE
PYROPHOSPHATASE


(Xanthomonas
citri)
PF01663
(Phosphodiest)
4 THR A  90
ASP A 210
HIS A 214
HIS A 363
ZN  A1000 (-2.4A)
ZN  A1001 (-2.0A)
ZN  A1001 (-3.2A)
ZN  A1001 (-3.3A)
0.53A 3t01A-2gsnA:
28.2
3t01A-2gsnA:
25.87
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.
2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3


(Homo sapiens)
PF13532
(2OG-FeII_Oxy_2)
4 ASN A 271
ASP A 193
HIS A 191
HIS A 257
AKG  A 700 (-3.4A)
FE  A 500 ( 2.6A)
FE  A 500 ( 3.3A)
FE  A 500 ( 3.3A)
1.00A 3t01A-2iuwA:
undetectable
3t01A-2iuwA:
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.
2ogj DIHYDROOROTASE

(Agrobacterium
fabrum)
PF01979
(Amidohydro_1)
4 ASN A 144
ASP A 291
HIS A  77
HIS A 231
None
ZN  A 418 (-2.5A)
KCX  A 175 (-3.3A)
ZN  A 419 (-3.6A)
0.94A 3t01A-2ogjA:
undetectable
3t01A-2ogjA:
22.70
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.
2ogj DIHYDROOROTASE

(Agrobacterium
fabrum)
PF01979
(Amidohydro_1)
4 ASN A 144
ASP A 291
ILE A  87
HIS A  79
None
ZN  A 418 (-2.5A)
None
ZN  A 418 (-3.4A)
0.92A 3t01A-2ogjA:
undetectable
3t01A-2ogjA:
22.70
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.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE


(Medicago
truncatula)
PF00201
(UDPGT)
4 PHE A  66
ASN A  67
ILE A  39
HIS A  33
None
0.93A 3t01A-2pq6A:
undetectable
3t01A-2pq6A:
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.
2q01 URONATE ISOMERASE

(Caulobacter
vibrioides)
PF02614
(UxaC)
4 THR A 169
ASP A 249
HIS A 307
HIS A  39
None
0.93A 3t01A-2q01A:
undetectable
3t01A-2q01A:
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans)
PF14520
(HHH_5)
PF14716
(HHH_8)
4 ASN A 491
ASP A 339
HIS A 364
HIS A 334
None
ZN  A1565 (-2.1A)
ZN  A1565 (-3.2A)
ZN  A1566 (-3.5A)
1.06A 3t01A-2w9mA:
undetectable
3t01A-2w9mA:
25.94
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.
2y7r LYSR-TYPE REGULATORY
PROTEIN


(Burkholderia
sp. DNT)
PF03466
(LysR_substrate)
4 PHE A 167
HIS A 206
ILE A 273
HIS A 169
None
1.13A 3t01A-2y7rA:
undetectable
3t01A-2y7rA:
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.
2zm2 6-AMINOHEXANOATE-DIM
ER HYDROLASE


(Flavobacterium
sp.)
PF00144
(Beta-lactamase)
4 THR A 197
ASP A 221
HIS A 266
HIS A 180
None
None
MES  A 504 (-4.0A)
MES  A 504 (-4.2A)
0.96A 3t01A-2zm2A:
undetectable
3t01A-2zm2A:
24.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3am3 ENOYL-ACP REDUCTASE

(Plasmodium
falciparum)
PF13561
(adh_short_C2)
4 PHE A 368
THR A 367
ASN A 324
ILE A 323
TCL  A 802 (-4.8A)
None
None
None
0.97A 3t01A-3am3A:
undetectable
3t01A-3am3A:
19.72
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.
3aqc COMPONENT A OF
HEXAPRENYL
DIPHOSPHATE SYNTHASE
COMPONENT B OF
HEXAPRENYL
DIPHOSPHATE SYNTHASE


(Micrococcus
luteus)
PF00348
(polyprenyl_synt)
no annotation
4 ASN A 103
ASP A  73
ILE B 109
HIS B  83
None
2DE  B 329 (-3.4A)
None
2DE  B 329 ( 4.5A)
1.04A 3t01A-3aqcA:
undetectable
3t01A-3aqcA:
15.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b2z ADAMTS-4

(Homo sapiens)
PF01421
(Reprolysin)
4 ASN A 373
ASP A 328
HIS A 365
HIS A 361
None
ZN  A   1 (-1.9A)
ZN  A   1 (-3.3A)
ZN  A   1 (-3.0A)
0.93A 3t01A-3b2zA:
undetectable
3t01A-3b2zA:
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.
3bb6 UNCHARACTERIZED
PROTEIN YEAR


(Escherichia
coli)
PF09313
(DUF1971)
4 ASP A  32
HIS A  30
ILE A  85
HIS A  83
ZN  A 128 (-2.9A)
ZN  A 128 (-4.1A)
None
ZN  A 128 (-3.8A)
1.08A 3t01A-3bb6A:
undetectable
3t01A-3bb6A:
16.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3btz ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE ALKB
HOMOLOG 2


(Homo sapiens)
PF13532
(2OG-FeII_Oxy_2)
4 ASN A 159
ASP A 173
ILE A 168
HIS A 236
None
0.96A 3t01A-3btzA:
undetectable
3t01A-3btzA:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3btz ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE ALKB
HOMOLOG 2


(Homo sapiens)
PF13532
(2OG-FeII_Oxy_2)
4 ASN A 250
ASP A 173
HIS A 171
HIS A 236
None
0.97A 3t01A-3btzA:
undetectable
3t01A-3btzA:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dy5 ALLENE OXIDE
SYNTHASE-LIPOXYGENAS
E PROTEIN


(Plexaura
homomalla)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
4 THR A1064
HIS A 757
ILE A1066
HIS A 762
None
FE2  A1099 (-3.1A)
None
FE2  A1099 (-3.4A)
1.04A 3t01A-3dy5A:
undetectable
3t01A-3dy5A:
18.68
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.
3e38 TWO-DOMAIN PROTEIN
CONTAINING PREDICTED
PHP-LIKE
METAL-DEPENDENT
PHOSPHOESTERASE


(Bacteroides
vulgatus)
PF16392
(DUF5001)
4 ASN A 190
ASP A  51
HIS A  76
HIS A  46
None
ZN  A   3 ( 2.0A)
ZN  A   3 ( 3.3A)
ZN  A   2 ( 3.2A)
1.10A 3t01A-3e38A:
undetectable
3t01A-3e38A:
23.13
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE


(Phanerochaete
chrysosporium)
PF12708
(Pectate_lyase_3)
4 ASN A 155
ASP A 488
ILE A 181
HIS A 383
None
ZN  A 757 (-4.6A)
None
ZN  A 757 ( 3.4A)
0.98A 3t01A-3eqnA:
undetectable
3t01A-3eqnA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h9u ADENOSYLHOMOCYSTEINA
SE


(Trypanosoma
brucei)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 THR A 156
ASN A 190
ASP A 130
HIS A  52
NAD  A 438 (-3.8A)
NAD  A 438 (-3.4A)
None
ADN  A 439 ( 4.7A)
1.10A 3t01A-3h9uA:
undetectable
3t01A-3h9uA:
25.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iac GLUCURONATE
ISOMERASE


(Salmonella
enterica)
PF02614
(UxaC)
4 THR A 158
ASP A 239
HIS A 299
HIS A  33
None
0.95A 3t01A-3iacA:
undetectable
3t01A-3iacA:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kjr DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE


(Babesia bovis)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
4 THR A 251
ASN A 247
ASP A 458
HIS A 459
None
1.10A 3t01A-3kjrA:
undetectable
3t01A-3kjrA:
22.10
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.
3kl7 PUTATIVE
METAL-DEPENDENT
HYDROLASE


(Parabacteroides
distasonis)
PF13483
(Lactamase_B_3)
4 ASN A 137
ASP A  83
HIS A  84
HIS A 215
None
ZN  A 303 (-2.7A)
ZN  A 303 (-3.4A)
ZN  A 303 (-3.3A)
0.78A 3t01A-3kl7A:
undetectable
3t01A-3kl7A:
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.
3l5a NADH/FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE


(Staphylococcus
aureus)
PF00724
(Oxidored_FMN)
4 ASP A 190
HIS A 191
ILE A 145
HIS A 142
None
1.13A 3t01A-3l5aA:
undetectable
3t01A-3l5aA:
23.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lm4 CATECHOL
2,3-DIOXYGENASE


(Rhodococcus
jostii)
PF00903
(Glyoxalase)
4 PHE A 270
ASN A 228
HIS A 217
HIS A 155
None
None
FE  A 400 ( 3.4A)
FE  A 400 ( 3.5A)
1.13A 3t01A-3lm4A:
undetectable
3t01A-3lm4A:
20.86
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.
3lxu TRIPEPTIDYL-PEPTIDAS
E 2


(Drosophila
melanogaster)
PF00082
(Peptidase_S8)
PF12580
(TPPII)
PF12583
(TPPII_N)
4 THR X1273
HIS X1297
ILE X1268
HIS X1293
None
1.08A 3t01A-3lxuX:
2.6
3t01A-3lxuX:
15.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m7p FN1 PROTEIN

(Homo sapiens)
PF00039
(fn1)
PF00040
(fn2)
4 THR A 507
ASN A 501
ASP A 522
HIS A 539
None
None
None
ZN  A 955 (-4.9A)
1.01A 3t01A-3m7pA:
undetectable
3t01A-3m7pA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mg3 ORANGE
CAROTENOID-BINDING
PROTEIN


(Synechocystis
sp. PCC 6803)
PF02136
(NTF2)
PF09150
(Carot_N)
4 PHE A  12
THR A  15
ASP A 304
ILE A  11
None
1.08A 3t01A-3mg3A:
undetectable
3t01A-3mg3A:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3od2 NICKEL-RESPONSIVE
REGULATORY PROTEIN


(Escherichia
coli)
PF01402
(RHH_1)
PF08753
(NikR_C)
4 THR A  74
ASP A 114
HIS A 110
HIS A  78
None
NI  A 137 (-3.1A)
NI  A 137 (-3.3A)
NI  A 137 (-3.3A)
1.07A 3t01A-3od2A:
3.1
3t01A-3od2A:
16.99
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.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1)
PF01663
(Phosphodiest)
4 THR A  89
ASP A 300
HIS A 304
HIS A 491
ZN  A1559 ( 2.6A)
ZN  A1561 ( 2.1A)
ZN  A1561 ( 3.2A)
ZN  A1561 ( 3.2A)
0.40A 3t01A-3q3qA:
25.3
3t01A-3q3qA:
23.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3re3 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE


(Francisella
tularensis)
PF02542
(YgbB)
4 PHE A  14
THR A  15
ASP A  39
HIS A  12
None
0.84A 3t01A-3re3A:
undetectable
3t01A-3re3A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rpc POSSIBLE
METAL-DEPENDENT
HYDROLASE


(Veillonella
parvula)
PF12706
(Lactamase_B_2)
4 ASP A  73
HIS A  74
ILE A 201
HIS A 223
ZN  A 302 (-2.8A)
ZN  A 302 (-3.4A)
None
ZN  A 302 (-3.5A)
0.81A 3t01A-3rpcA:
undetectable
3t01A-3rpcA:
21.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t02 PHOSPHONOACETATE
HYDROLASE


(Sinorhizobium
meliloti)
PF01663
(Phosphodiest)
4 PHE A  67
ASN A  89
ASP A  29
HIS A 251
None
None
ZN  A 501 ( 2.2A)
ZN  A 501 ( 3.0A)
0.85A 3t01A-3t02A:
72.6
3t01A-3t02A:
99.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t02 PHOSPHONOACETATE
HYDROLASE


(Sinorhizobium
meliloti)
PF01663
(Phosphodiest)
6 PHE A  67
ASN A  89
ASP A 211
HIS A 215
ILE A 287
HIS A 377
None
None
ZN  A 502 (-2.2A)
ZN  A 502 ( 3.3A)
None
ZN  A 502 ( 3.2A)
0.23A 3t01A-3t02A:
72.6
3t01A-3t02A:
99.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t3o METAL DEPENDENT
HYDROLASE


(Thermus
thermophilus)
PF07521
(RMMBL)
PF12706
(Lactamase_B_2)
4 ASP A 172
HIS A 376
ILE A  21
HIS A 398
ZN  A 600 (-2.4A)
None
None
ZN  A 600 (-3.6A)
1.11A 3t01A-3t3oA:
2.2
3t01A-3t3oA:
23.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8


(Homo sapiens)
PF00076
(RRM_1)
PF13532
(2OG-FeII_Oxy_2)
4 ASN A 227
ASP A 240
ILE A 235
HIS A 292
AKG  A 403 (-3.2A)
MN  A 402 ( 2.6A)
AKG  A 403 (-4.4A)
MN  A 402 ( 3.6A)
1.03A 3t01A-3thtA:
undetectable
3t01A-3thtA:
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.
3ujp MN TRANSPORTER
SUBUNIT


(Synechocystis
sp. PCC 6803)
PF01297
(ZnuA)
4 ASN A 152
ASP A 295
ILE A 240
HIS A  89
None
MN  A   1 (-2.1A)
None
MN  A   1 (-3.3A)
1.06A 3t01A-3ujpA:
undetectable
3t01A-3ujpA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ukf UDP-GALACTOPYRANOSE
MUTASE


(Aspergillus
fumigatus)
PF13450
(NAD_binding_8)
4 ASN A 207
ASP A 459
HIS A 460
HIS A  68
GDU  A 802 (-3.3A)
None
None
None
0.89A 3t01A-3ukfA:
undetectable
3t01A-3ukfA:
21.17
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.
3wl4 UNCHARACTERIZED
PROTEIN


(Pyrococcus
furiosus)
PF02585
(PIG-L)
4 THR A  68
ASP A 150
HIS A 148
HIS A  40
None
None
TAM  A 309 (-4.8A)
CD  A 301 ( 3.4A)
1.12A 3t01A-3wl4A:
undetectable
3t01A-3wl4A:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zq4 RIBONUCLEASE J 1

(Bacillus
subtilis)
PF00753
(Lactamase_B)
PF07521
(RMMBL)
4 ASP A 164
HIS A 368
ILE A  20
HIS A 390
ZN  A1556 ( 2.7A)
None
None
ZN  A1556 (-3.4A)
1.03A 3t01A-3zq4A:
undetectable
3t01A-3zq4A:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aui PORIN (PORB)

(Neisseria
gonorrhoeae)
PF00267
(Porin_1)
4 PHE A 249
THR A 261
ASP A 263
HIS A 247
None
1.08A 3t01A-4auiA:
undetectable
3t01A-4auiA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b56 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 1


(Mus musculus)
PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest)
4 THR A 238
ASP A 358
HIS A 362
HIS A 517
ZN  A1002 ( 2.3A)
ZN  A1001 (-2.1A)
ZN  A1001 ( 3.2A)
ZN  A1001 ( 3.3A)
0.44A 3t01A-4b56A:
26.6
3t01A-4b56A:
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.
4bzi SEC23P

(Saccharomyces
cerevisiae)
PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS)
5 PHE A 608
ASP A 363
HIS A 420
ILE A 612
HIS A 611
None
1.38A 3t01A-4bziA:
undetectable
3t01A-4bziA:
20.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cnk L-AMINO ACID OXIDASE

(Streptococcus
cristatus)
PF03486
(HI0933_like)
4 PHE A 373
THR A 370
ASN A  51
HIS A 225
None
MEU  A1393 (-4.0A)
FAD  A1392 (-4.2A)
None
1.08A 3t01A-4cnkA:
undetectable
3t01A-4cnkA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gxw ADENOSINE DEAMINASE

(Burkholderia
ambifaria)
PF00962
(A_deaminase)
4 ASN A 117
ASP A 300
HIS A  34
HIS A 215
None
ZN  A 401 (-2.6A)
ZN  A 401 (-3.4A)
ZN  A 401 (-3.4A)
1.07A 3t01A-4gxwA:
undetectable
3t01A-4gxwA:
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.
4hfs UNCHARACTERIZED
PROTEIN YNCM


(Bacillus
subtilis)
PF15493
(YrpD)
4 PHE A 215
THR A 245
ASN A 216
ILE A  72
None
1.11A 3t01A-4hfsA:
undetectable
3t01A-4hfsA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lr2 BIS(5'-ADENOSYL)-TRI
PHOSPHATASE ENPP4


(Homo sapiens)
PF01663
(Phosphodiest)
4 THR A  70
ASP A 189
HIS A 193
HIS A 336
ZN  A 505 ( 2.4A)
ZN  A 506 ( 2.1A)
ZN  A 506 ( 3.3A)
ZN  A 506 ( 3.3A)
0.41A 3t01A-4lr2A:
27.5
3t01A-4lr2A:
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.
4m8d PUTATIVE
UNCHARACTERIZED
PROTEIN


(Labrenzia
aggregata)
PF04199
(Cyclase)
4 THR A 197
ASP A  79
HIS A  77
ILE A 195
None
MN  A 301 ( 2.5A)
MN  A 301 ( 3.3A)
None
1.11A 3t01A-4m8dA:
undetectable
3t01A-4m8dA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mhu ECTOINE HYDROXYLASE

(Sphingopyxis
alaskensis)
PF05721
(PhyH)
4 ASN A 258
ASP A 146
HIS A 144
HIS A 245
None
FE  A 401 (-2.6A)
FE  A 401 (-3.7A)
FE  A 401 (-3.9A)
0.88A 3t01A-4mhuA:
undetectable
3t01A-4mhuA:
22.90
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.
4mvc CHOLINE-PHOSPHATE
CYTIDYLYLTRANSFERASE
A


(Rattus
norvegicus)
PF01467
(CTP_transf_like)
4 PHE A 124
THR A 125
ASP A 115
HIS A 119
None
0.94A 3t01A-4mvcA:
undetectable
3t01A-4mvcA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nmi ECTD

(Virgibacillus
salexigens)
PF05721
(PhyH)
4 ASN A 261
ASP A 148
HIS A 146
HIS A 248
None
1.01A 3t01A-4nmiA:
undetectable
3t01A-4nmiA:
22.12
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.
4npl RNA DEMETHYLASE
ALKBH5


(Danio rerio)
PF13532
(2OG-FeII_Oxy_2)
4 ASN A 124
ASP A 137
ILE A 132
HIS A 197
AKG  A 301 (-3.1A)
MN  A 300 (-2.8A)
AKG  A 301 (-4.3A)
MN  A 300 ( 3.4A)
1.03A 3t01A-4nplA:
undetectable
3t01A-4nplA:
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.
4nrq RNA DEMETHYLASE
ALKBH5


(Homo sapiens)
PF13532
(2OG-FeII_Oxy_2)
4 ASN A 193
ASP A 206
ILE A 201
HIS A 266
PD2  A 301 (-3.3A)
MN  A 302 ( 2.7A)
PD2  A 301 (-4.8A)
MN  A 302 ( 3.3A)
1.06A 3t01A-4nrqA:
undetectable
3t01A-4nrqA:
19.86
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.
4rv2 UPF0336 PROTEIN
MSMEG_1340/MSMEI_130
2


(Mycolicibacterium
smegmatis)
PF13452
(MaoC_dehydrat_N)
4 PHE A  59
THR A  58
ILE A  62
HIS A  28
None
0.87A 3t01A-4rv2A:
undetectable
3t01A-4rv2A:
17.06
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.
4xwt DR2417

(Deinococcus
radiodurans)
PF00753
(Lactamase_B)
PF07521
(RMMBL)
4 ASP A 175
HIS A 381
ILE A  30
HIS A 403
ZN  A 602 ( 2.5A)
U5P  A 606 (-3.9A)
None
ZN  A 602 (-3.2A)
1.02A 3t01A-4xwtA:
2.2
3t01A-4xwtA:
23.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2


(Homo sapiens)
PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest)
4 THR A 210
ASP A 312
HIS A 316
HIS A 475
ZN  A 904 ( 2.6A)
ZN  A 903 ( 2.0A)
ZN  A 903 ( 3.2A)
ZN  A 903 ( 3.3A)
0.39A 3t01A-4zg7A:
24.0
3t01A-4zg7A:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a0t RIBONUCLEASE J

(Streptomyces
coelicolor)
PF00753
(Lactamase_B)
PF07521
(RMMBL)
4 ASP A 173
HIS A 377
ILE A  30
HIS A 399
ZN  A1457 ( 2.7A)
G  E   1 ( 3.9A)
C  E   0 ( 3.6A)
ZN  A1457 (-3.5A)
1.01A 3t01A-5a0tA:
undetectable
3t01A-5a0tA:
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.
5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE


(Mycolicibacterium
smegmatis)
PF14765
(PS-DH)
4 ASP A1100
HIS A 934
ILE A1053
HIS A1055
None
EDO  A1202 (-4.3A)
None
None
1.05A 3t01A-5bp3A:
undetectable
3t01A-5bp3A:
23.13
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.
5ebb ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A


(Homo sapiens)
PF00149
(Metallophos)
4 ASN A 211
ASP A  45
HIS A 295
HIS A  47
None
ZN  A 702 ( 3.0A)
ZN  A 702 ( 3.4A)
ZN  A 702 ( 3.4A)
1.03A 3t01A-5ebbA:
undetectable
3t01A-5ebbA:
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.
5fca ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A


(Mus musculus)
PF00149
(Metallophos)
4 ASN A 208
ASP A  42
HIS A 292
HIS A  44
None
ZN  A 501 (-3.1A)
ZN  A 501 (-3.4A)
ZN  A 501 (-3.3A)
1.00A 3t01A-5fcaA:
undetectable
3t01A-5fcaA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fca ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A


(Mus musculus)
PF00149
(Metallophos)
5 THR A 317
ASN A 328
ASP A  79
HIS A 111
HIS A  44
None
None
GOL  A 518 ( 4.9A)
GOL  A 518 (-2.7A)
ZN  A 501 (-3.3A)
1.33A 3t01A-5fcaA:
undetectable
3t01A-5fcaA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gz4 SNAKE VENOM
PHOSPHODIESTERASE
(PDE)


(Naja atra)
PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest)
4 THR A 185
ASN A 206
ASP A 305
HIS A 353
ZN  A 902 (-2.7A)
None
ZN  A 901 (-2.2A)
ZN  A 902 (-3.0A)
0.95A 3t01A-5gz4A:
27.0
3t01A-5gz4A:
18.34
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.
5gz4 SNAKE VENOM
PHOSPHODIESTERASE
(PDE)


(Naja atra)
PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest)
4 THR A 185
ASP A 305
HIS A 309
HIS A 462
ZN  A 902 (-2.7A)
ZN  A 901 (-2.2A)
ZN  A 901 (-3.1A)
ZN  A 901 (-3.2A)
0.37A 3t01A-5gz4A:
27.0
3t01A-5gz4A:
18.34
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.
5hgr ORANGE CAROTENOID
PROTEIN (OCP)


(Nostoc sp. PCC
7120)
PF02136
(NTF2)
PF09150
(Carot_N)
4 PHE A  12
THR A  15
ASP A 306
ILE A  11
None
1.08A 3t01A-5hgrA:
undetectable
3t01A-5hgrA:
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.
5hqn SPHINGOMYELIN
PHOSPHODIESTERASE


(Mus musculus)
PF00149
(Metallophos)
4 ASN A 323
ASP A 204
HIS A 457
HIS A 206
None
ZN  A 701 (-3.0A)
ZN  A 701 ( 3.1A)
ZN  A 701 ( 3.3A)
1.01A 3t01A-5hqnA:
undetectable
3t01A-5hqnA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i35 ATYPICAL KINASE
ADCK3, MITOCHONDRIAL


(Homo sapiens)
PF03109
(ABC1)
4 THR A 606
HIS A 559
ILE A 525
HIS A 610
None
0.82A 3t01A-5i35A:
undetectable
3t01A-5i35A:
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.
5i85 SPHINGOMYELIN
PHOSPHODIESTERASE


(Homo sapiens)
PF00149
(Metallophos)
4 ASN A 325
ASP A 206
HIS A 459
HIS A 208
None
ZN  A 715 ( 3.1A)
ZN  A 715 ( 3.3A)
ZN  A 715 ( 3.4A)
0.98A 3t01A-5i85A:
undetectable
3t01A-5i85A:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikk HISTONE DEACETYLASE
CLR3


(Schizosaccharomyces
pombe)
PF00850
(Hist_deacetyl)
PF09757
(Arb2)
4 ASP A 234
HIS A 195
ILE A 334
HIS A 236
ZN  A 701 ( 1.7A)
ZN  A 701 (-2.9A)
None
ZN  A 701 ( 3.1A)
1.03A 3t01A-5ikkA:
undetectable
3t01A-5ikkA:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kar ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3B


(Mus musculus)
PF00149
(Metallophos)
4 ASN A 141
ASP A  28
HIS A 279
HIS A  30
None
ZN  A 502 (-3.0A)
GOL  A 515 ( 2.6A)
ZN  A 502 (-3.3A)
0.93A 3t01A-5karA:
undetectable
3t01A-5karA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kar ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3B


(Mus musculus)
PF00149
(Metallophos)
4 ASN A 195
ASP A  28
HIS A 279
HIS A  30
None
ZN  A 502 (-3.0A)
GOL  A 515 ( 2.6A)
ZN  A 502 (-3.3A)
1.01A 3t01A-5karA:
undetectable
3t01A-5karA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kku POLYKETIDE SYNTHASE
TYPE I


(Bacillus
amyloliquefaciens)
PF14765
(PS-DH)
4 THR A 201
ASP A 198
HIS A  25
ILE A 220
None
1.10A 3t01A-5kkuA:
undetectable
3t01A-5kkuA:
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.
5nmp ISATIN HYDROLASE

(Ralstonia
solanacearum)
no annotation 4 THR A 199
ASP A  80
HIS A  78
ILE A 197
None
MN  A 301 ( 2.4A)
MN  A 301 (-3.3A)
None
0.92A 3t01A-5nmpA:
undetectable
3t01A-5nmpA:
10.70
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.
5osh VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 29


(Homo sapiens)
no annotation 4 PHE A  63
ASP A   8
HIS A 117
HIS A  10
None
0.81A 3t01A-5oshA:
undetectable
3t01A-5oshA:
11.56
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.
5udy ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 7


(Homo sapiens)
PF01663
(Phosphodiest)
4 THR A  75
ASP A 199
HIS A 203
HIS A 353
ZN  A 501 (-2.6A)
ZN  A 502 (-2.3A)
ZN  A 502 (-3.3A)
ZN  A 502 (-3.3A)
0.39A 3t01A-5udyA:
29.0
3t01A-5udyA:
23.88
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.
5ui2 ORANGE
CAROTENOID-BINDING
PROTEIN


(Arthrospira
maxima)
PF02136
(NTF2)
PF09150
(Carot_N)
4 PHE A  12
THR A  15
ASP A 306
ILE A  11
None
1.11A 3t01A-5ui2A:
undetectable
3t01A-5ui2A:
20.99
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.
5utu ADENOSYLHOMOCYSTEINA
SE


(Cryptosporidium
parvum)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 THR A 212
ASN A 246
ASP A 137
HIS A  53
NAD  A 501 ( 4.1A)
NAD  A 501 (-3.5A)
SAH  A 502 (-3.4A)
SAH  A 502 (-4.0A)
1.00A 3t01A-5utuA:
undetectable
3t01A-5utuA:
22.16
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.
5uyg PERIPLASMIC CHELATED
IRON-BINDING PROTEIN
YFEA


(Yersinia pestis)
PF01297
(ZnuA)
4 ASN A 139
ASP A 282
ILE A 227
HIS A  76
None
ZN  A 401 (-2.1A)
None
ZN  A 401 (-3.3A)
0.98A 3t01A-5uygA:
undetectable
3t01A-5uygA:
21.61
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.
5vem ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 5


(Homo sapiens)
PF01663
(Phosphodiest)
4 THR A  72
ASP A 191
HIS A 195
HIS A 339
ZN  A 501 (-2.4A)
ZN  A 502 (-2.0A)
ZN  A 502 (-3.2A)
ZN  A 502 (-3.2A)
0.32A 3t01A-5vemA:
27.5
3t01A-5vemA:
21.89
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.
5w1u CARBOXYLIC ESTER
HYDROLASE


(Culex
quinquefasciatus)
PF00135
(COesterase)
5 PHE A 506
THR A 502
ASN A 499
ILE A 402
HIS A 399
None
1.32A 3t01A-5w1uA:
undetectable
3t01A-5w1uA:
21.20
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.
5xoi OXIDOREDUCTASE,
2OG-FE OXYGENASE
FAMILY PROTEIN,
PUTATIVE, EXPRESSED


(Oryza sativa)
no annotation 4 ASN A 365
ASP A 281
HIS A 279
HIS A 339
SIN  A 401 (-3.5A)
MN  A 402 (-2.5A)
MN  A 402 ( 3.4A)
MN  A 402 ( 3.4A)
1.12A 3t01A-5xoiA:
undetectable
3t01A-5xoiA:
10.84
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.
5yjp HUMAN CHYMASE

(Homo sapiens)
no annotation 4 PHE A 228
THR A 229
ASP A 102
HIS A  57
None
None
8W6  A 304 (-3.9A)
8W6  A 304 (-3.7A)
0.89A 3t01A-5yjpA:
undetectable
3t01A-5yjpA:
10.53
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.
6bmm HUMAN DHHC20
PALMITOYLTRANSFERASE


(Homo sapiens)
no annotation 4 PHE A  74
THR A  75
ASN A 161
ILE A  73
None
1.01A 3t01A-6bmmA:
undetectable
3t01A-6bmmA:
10.30
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.
6bms PALMITOYLTRANSFERASE

(Danio rerio)
no annotation 4 PHE A  64
THR A  65
ASN A 148
ILE A  63
None
0.98A 3t01A-6bmsA:
undetectable
3t01A-6bmsA:
11.63
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.
6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA


(Pectobacterium
carotovorum)
no annotation 4 ASP A  71
HIS A  72
ILE A 199
HIS A 221
ZN  A 302 (-2.7A)
ZN  A 302 (-3.3A)
None
ZN  A 302 (-3.4A)
0.82A 3t01A-6brmA:
undetectable
3t01A-6brmA:
12.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c01 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 3


(Homo sapiens)
no annotation 4 THR A 205
ASP A 325
HIS A 329
HIS A 483
ZN  A 902 (-2.5A)
ZN  A 901 ( 2.1A)
ZN  A 901 ( 3.3A)
ZN  A 901 ( 3.3A)
0.38A 3t01A-6c01A:
25.6
3t01A-6c01A:
9.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dch SCOE PROTEIN

(Streptomyces
coeruleorubidus)
no annotation 4 THR A 312
ASP A 134
HIS A 295
ILE A 147
None
ZN  A 403 (-2.4A)
ZN  A 403 ( 3.2A)
None
1.10A 3t01A-6dchA:
undetectable
3t01A-6dchA:
15.96
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.
6f2t -

(-)
no annotation 4 THR A 206
ASP A 326
HIS A 330
HIS A 483
ZN  A1002 ( 2.5A)
ZN  A1003 ( 2.1A)
ZN  A1003 (-3.2A)
ZN  A1003 ( 3.1A)
0.48A 3t01A-6f2tA:
26.5
3t01A-6f2tA:
undetectable