SIMILAR PATTERNS OF AMINO ACIDS FOR 3DEU_B_SALB306

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.
1aye PROCARBOXYPEPTIDASE
A2


(Homo sapiens)
PF00246
(Peptidase_M14)
PF02244
(Propep_M14)
4 THR A 289
THR A 293
LEU A 195
THR A  78
None
0.73A 3deuB-1ayeA:
1.4
3deuB-1ayeA:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cwu ENOYL ACP REDUCTASE

(Brassica napus)
PF13561
(adh_short_C2)
4 THR A 288
THR A 230
LEU A 209
THR A 187
None
0.96A 3deuB-1cwuA:
0.0
3deuB-1cwuA:
18.89
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.
1dtd CARBOXYPEPTIDASE A2

(Homo sapiens)
PF00246
(Peptidase_M14)
4 THR A 645
THR A 649
LEU A 551
THR A 433
None
0.73A 3deuB-1dtdA:
0.0
3deuB-1dtdA:
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.
1fc9 PHOTOSYSTEM II D1
PROTEASE


(Tetradesmus
obliquus)
PF03572
(Peptidase_S41)
PF13180
(PDZ_2)
4 THR A 289
ILE A 312
SER A 374
LEU A 377
None
0.89A 3deuB-1fc9A:
undetectable
3deuB-1fc9A:
16.23
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.
1g6o CAG-ALPHA

(Helicobacter
pylori)
PF00437
(T2SSE)
4 THR A 270
THR A 268
ILE A 310
LEU A 261
None
0.78A 3deuB-1g6oA:
0.0
3deuB-1g6oA:
19.16
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.
1hs7 SYNTAXIN VAM3

(Saccharomyces
cerevisiae)
PF14523
(Syntaxin_2)
4 THR A  27
ILE A  85
SER A  92
LEU A  91
None
0.94A 3deuB-1hs7A:
undetectable
3deuB-1hs7A:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iip CYCLOPHILIN 40

(Bos taurus)
PF00160
(Pro_isomerase)
PF13176
(TPR_7)
4 THR A 139
SER A 119
LEU A 117
THR A 135
None
0.88A 3deuB-1iipA:
undetectable
3deuB-1iipA:
17.99
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.
1jsd HAEMAGGLUTININ (HA1
CHAIN)


(Influenza A
virus)
PF00509
(Hemagglutinin)
4 THR A 261
ILE A  51
SER A 265
LEU A  41
None
0.88A 3deuB-1jsdA:
undetectable
3deuB-1jsdA:
18.21
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.
1k27 5'-DEOXY-5'-METHYLTH
IOADENOSINE
PHOSPHORYLASE


(Homo sapiens)
PF01048
(PNP_UDP_1)
4 THR A 155
SER A 249
LEU A 250
THR A 253
None
0.94A 3deuB-1k27A:
undetectable
3deuB-1k27A:
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.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum)
PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ)
4 THR A1004
ILE A 735
SER A 732
LEU A 731
None
0.87A 3deuB-1k32A:
0.0
3deuB-1k32A:
9.20
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.
1kzl RIBOFLAVIN SYNTHASE

(Schizosaccharomyces
pombe)
PF00677
(Lum_binding)
4 THR A  47
ILE A  63
LEU A  73
THR A  71
CRM  A 502 (-4.0A)
CRM  A 502 (-4.6A)
None
None
0.72A 3deuB-1kzlA:
undetectable
3deuB-1kzlA:
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.
1nhw ENOYL-ACYL CARRIER
REDUCTASE


(Plasmodium
falciparum)
PF13561
(adh_short_C2)
4 THR C 410
THR A 309
LEU A 288
THR A 266
None
0.97A 3deuB-1nhwC:
undetectable
3deuB-1nhwC:
16.87
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.
1p1m HYPOTHETICAL PROTEIN
TM0936


(Thermotoga
maritima)
PF01979
(Amidohydro_1)
4 THR A  56
ILE A 108
LEU A 289
THR A 278
None
0.77A 3deuB-1p1mA:
2.1
3deuB-1p1mA:
15.22
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.
1rlj NRDI PROTEIN

(Bacillus
subtilis)
PF07972
(Flavodoxin_NdrI)
4 THR A  42
ILE A  87
LEU A  58
THR A  54
None
0.97A 3deuB-1rljA:
undetectable
3deuB-1rljA:
19.10
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.)
PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5)
4 THR A 478
ILE A 459
LEU A 457
THR A 452
None
None
EDO  A9081 (-4.5A)
None
0.72A 3deuB-1xc6A:
undetectable
3deuB-1xc6A:
9.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zi0 DNA GYRASE SUBUNIT A

(Escherichia
coli)
PF03989
(DNA_gyraseA_C)
4 THR A 654
THR A 650
ILE A 674
LEU A 676
None
0.93A 3deuB-1zi0A:
undetectable
3deuB-1zi0A:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zmf PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
E


(Homo sapiens)
PF00160
(Pro_isomerase)
4 THR A 255
SER A 235
LEU A 233
THR A 251
None
0.88A 3deuB-1zmfA:
undetectable
3deuB-1zmfA:
18.44
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.
2afb 2-KETO-3-DEOXYGLUCON
ATE KINASE


(Thermotoga
maritima)
PF00294
(PfkB)
4 THR A 160
ILE A 287
SER A 290
LEU A 291
None
0.88A 3deuB-2afbA:
undetectable
3deuB-2afbA:
19.03
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.
2boa CARBOXYPEPTIDASE A4

(Homo sapiens)
PF00246
(Peptidase_M14)
PF02244
(Propep_M14)
4 THR A1289
THR A1293
LEU A1195
THR A1078
None
0.63A 3deuB-2boaA:
1.3
3deuB-2boaA:
16.54
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.
2cfe ALLERGEN

(Malassezia
sympodialis)
PF00160
(Pro_isomerase)
4 THR A 117
SER A  97
LEU A  95
THR A 113
None
None
GOL  A1163 ( 4.7A)
None
0.83A 3deuB-2cfeA:
undetectable
3deuB-2cfeA:
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.
2exr CYTOKININ
DEHYDROGENASE 7


(Arabidopsis
thaliana)
PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind)
4 THR A 167
ILE A 228
SER A 173
LEU A 172
FAD  A 525 (-3.1A)
FAD  A 525 (-4.0A)
FAD  A 525 (-3.1A)
None
0.96A 3deuB-2exrA:
undetectable
3deuB-2exrA:
13.54
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.
2g7z CONSERVED
HYPOTHETICAL PROTEIN
SPY1493


(Streptococcus
pyogenes)
PF02645
(DegV)
4 THR A  25
ILE A  85
LEU A  77
THR A  73
None
0.88A 3deuB-2g7zA:
undetectable
3deuB-2g7zA:
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.
2gwn DIHYDROOROTASE

(Porphyromonas
gingivalis)
PF01979
(Amidohydro_1)
4 THR A 261
ILE A 309
LEU A 368
THR A 255
None
0.94A 3deuB-2gwnA:
undetectable
3deuB-2gwnA:
16.44
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.
2hi9 PLASMA SERINE
PROTEASE INHIBITOR


(Homo sapiens)
PF00079
(Serpin)
4 THR A 116
ILE A 317
LEU A 122
THR A 138
None
0.83A 3deuB-2hi9A:
undetectable
3deuB-2hi9A:
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.
2nmp CYSTATHIONINE
GAMMA-LYASE


(Homo sapiens)
PF01053
(Cys_Met_Meta_PP)
4 THR A  98
ILE A 132
SER A 126
LEU A 130
None
0.88A 3deuB-2nmpA:
undetectable
3deuB-2nmpA:
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.
2pcu CARBOXYPEPTIDASE A4

(Homo sapiens)
PF00246
(Peptidase_M14)
4 THR A 289
THR A 293
LEU A 195
THR A  78
None
0.65A 3deuB-2pcuA:
1.5
3deuB-2pcuA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qdx FERREDOXIN REDUCTASE

(Pseudomonas
aeruginosa)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
4 THR A 192
ILE A 218
SER A 229
LEU A 232
None
0.94A 3deuB-2qdxA:
undetectable
3deuB-2qdxA:
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.
2qv3 VACUOLATING
CYTOTOXIN


(Helicobacter
pylori)
PF02691
(VacA)
4 THR A 502
THR A 478
LEU A 486
THR A 505
None
0.77A 3deuB-2qv3A:
undetectable
3deuB-2qv3A:
16.19
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)


(Saccharomyces
cerevisiae)
PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT)
4 ILE G 483
SER G 274
LEU G 277
THR G 462
None
0.94A 3deuB-2uv8G:
undetectable
3deuB-2uv8G:
5.90
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.
2vbf BRANCHED-CHAIN
ALPHA-KETOACID
DECARBOXYLASE


(Lactococcus
lactis)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
4 ILE A 427
SER A 431
LEU A 432
THR A 435
ILE  A 427 ( 0.7A)
SER  A 431 (-0.0A)
LEU  A 432 ( 0.5A)
THR  A 435 ( 0.8A)
0.86A 3deuB-2vbfA:
undetectable
3deuB-2vbfA:
14.91
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.
2vhl N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE


(Bacillus
subtilis)
PF01979
(Amidohydro_1)
4 THR A 332
ILE A 342
SER A 273
LEU A 276
None
0.92A 3deuB-2vhlA:
undetectable
3deuB-2vhlA:
16.49
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.
2vn7 GLUCOAMYLASE

(Trichoderma
reesei)
PF00686
(CBM_20)
PF00723
(Glyco_hydro_15)
4 THR A  10
SER A 425
LEU A 427
THR A 430
None
0.96A 3deuB-2vn7A:
undetectable
3deuB-2vn7A:
11.91
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.
2vrc TRIPHENYLMETHANE
REDUCTASE


(Citrobacter sp.
MY-5)
PF05368
(NmrA)
4 THR A 174
THR A 144
LEU A 277
THR A 280
None
0.80A 3deuB-2vrcA:
undetectable
3deuB-2vrcA:
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.
2wfi PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
G


(Homo sapiens)
PF00160
(Pro_isomerase)
4 THR A 131
SER A 111
LEU A 109
THR A 127
None
0.84A 3deuB-2wfiA:
undetectable
3deuB-2wfiA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wsu PUTATIVE FIBER
PROTEIN


(Porcine
mastadenovirus
B)
PF00337
(Gal-bind_lectin)
4 THR A 560
THR A 639
ILE A 666
LEU A 663
None
0.89A 3deuB-2wsuA:
undetectable
3deuB-2wsuA:
20.06
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.
2zbk TYPE 2 DNA
TOPOISOMERASE 6
SUBUNIT B


(Sulfolobus
shibatae)
PF02518
(HATPase_c)
PF09239
(Topo-VIb_trans)
4 ILE B  56
SER B  43
LEU B  44
THR B  47
None
RDC  B 531 (-3.2A)
None
None
0.79A 3deuB-2zbkB:
undetectable
3deuB-2zbkB:
15.31
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.
2zux YESW PROTEIN

(Bacillus
subtilis)
no annotation 4 THR A 269
ILE A 203
LEU A 205
THR A 235
None
0.74A 3deuB-2zuxA:
undetectable
3deuB-2zuxA:
13.37
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.
2zuy YESX PROTEIN

(Bacillus
subtilis)
PF01839
(FG-GAP)
4 THR A 236
ILE A 170
LEU A 172
THR A 202
None
0.76A 3deuB-2zuyA:
undetectable
3deuB-2zuyA:
12.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a24 ALPHA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron)
PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C)
4 ILE A 272
SER A 288
LEU A 287
THR A 285
None
0.93A 3deuB-3a24A:
undetectable
3deuB-3a24A:
10.71
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.
3am3 ENOYL-ACP REDUCTASE

(Plasmodium
falciparum)
PF13561
(adh_short_C2)
4 THR A 410
THR A 309
LEU A 288
THR A 266
None
0.94A 3deuB-3am3A:
undetectable
3deuB-3am3A:
18.10
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.
3b0h NITRITE REDUCTASE

(Nicotiana
tabacum)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr)
4 THR A 122
ILE A 404
LEU A 396
THR A 117
None
0.90A 3deuB-3b0hA:
undetectable
3deuB-3b0hA:
18.24
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.
3bt6 INFLUENZA B
HEMAGGLUTININ (HA)


(Influenza B
virus)
PF00509
(Hemagglutinin)
4 THR A  47
THR A  49
ILE A 315
LEU A 293
None
0.96A 3deuB-3bt6A:
undetectable
3deuB-3bt6A:
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.
3co8 ALANINE RACEMASE

(Oenococcus oeni)
PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N)
4 THR A 165
ILE A 189
LEU A 188
THR A 131
None
0.93A 3deuB-3co8A:
undetectable
3deuB-3co8A:
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE


(Exiguobacterium
sibiricum)
PF13649
(Methyltransf_25)
4 THR A 118
ILE A 101
SER A 105
LEU A 106
None
0.77A 3deuB-3d2lA:
undetectable
3deuB-3d2lA:
21.25
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.
3dy5 ALLENE OXIDE
SYNTHASE-LIPOXYGENAS
E PROTEIN


(Plexaura
homomalla)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
4 THR A 765
SER A 934
LEU A 935
THR A 938
None
0.91A 3deuB-3dy5A:
undetectable
3deuB-3dy5A:
8.75
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.
3euj CHROMOSOME PARTITION
PROTEIN MUKB, LINKER


([Haemophilus]
ducreyi)
PF04310
(MukB)
PF13558
(SbcCD_C)
4 THR A1378
ILE A 238
SER A1390
LEU A1393
None
0.82A 3deuB-3eujA:
1.7
3deuB-3eujA:
16.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f4b ENOYL-ACYL CARRIER
PROTEIN REDUCTASE


(Plasmodium
berghei)
PF13561
(adh_short_C2)
4 THR A 374
THR A 294
LEU A 273
THR A 251
None
0.97A 3deuB-3f4bA:
undetectable
3deuB-3f4bA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fg4 ALLENE OXIDE
SYNTHASE-LIPOXYGENAS
E PROTEIN


(Plexaura
homomalla)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
4 THR A 765
SER A 934
LEU A 935
THR A 938
None
0.82A 3deuB-3fg4A:
undetectable
3deuB-3fg4A:
13.91
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.
3jb9 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
PPI1


(Schizosaccharomyces
pombe)
PF01423
(LSM)
4 THR d 109
ILE d 118
SER d  89
THR d 105
None
0.74A 3deuB-3jb9d:
undetectable
3deuB-3jb9d:
21.08
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.
3k6k ESTERASE/LIPASE

(uncultured
bacterium)
PF07859
(Abhydrolase_3)
4 THR A 164
ILE A 245
SER A 257
LEU A 260
None
0.91A 3deuB-3k6kA:
undetectable
3deuB-3k6kA:
19.88
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.
3l6v DNA GYRASE SUBUNIT A

(Xanthomonas
campestris)
PF03989
(DNA_gyraseA_C)
4 THR A 653
THR A 649
ILE A 673
LEU A 675
None
0.91A 3deuB-3l6vA:
undetectable
3deuB-3l6vA:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mq0 TRANSCRIPTIONAL
REPRESSOR OF THE
BLCABC OPERON


(Agrobacterium
tumefaciens)
PF01614
(IclR)
PF09339
(HTH_IclR)
4 THR A 105
ILE A 225
SER A 265
LEU A 268
None
0.88A 3deuB-3mq0A:
5.3
3deuB-3mq0A:
20.91
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.
3o3x GP41-5

(synthetic
construct)
no annotation 4 THR A 105
THR A  24
LEU A 183
THR A 186
None
MPD  A 199 ( 4.6A)
None
None
0.96A 3deuB-3o3xA:
undetectable
3deuB-3o3xA:
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.
3o7t CYCLOPHILIN A

(Moniliophthora
perniciosa)
PF00160
(Pro_isomerase)
4 THR A 117
SER A  97
LEU A  95
THR A 113
None
0.89A 3deuB-3o7tA:
undetectable
3deuB-3o7tA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei)
PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5)
4 THR A 475
ILE A 456
LEU A 454
THR A 449
None
0.81A 3deuB-3ogrA:
undetectable
3deuB-3ogrA:
9.54
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.
3pie 5'->3'
EXORIBONUCLEASE
(XRN1)


(Kluyveromyces
lactis)
PF03159
(XRN_N)
4 THR A 814
THR A 811
SER A 783
LEU A 782
None
0.74A 3deuB-3pieA:
undetectable
3deuB-3pieA:
8.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3prl NADP-DEPENDENT
GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Bacillus
halodurans)
PF00171
(Aldedh)
4 THR A 179
SER A 472
LEU A 471
THR A 474
None
0.95A 3deuB-3prlA:
undetectable
3deuB-3prlA:
15.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3qpt TRANSCRIPTIONAL
REGULATOR SLYA


(Salmonella
enterica)
PF01047
(MarR)
5 THR A  32
THR A  36
SER A  62
LEU A  63
THR A  66
None
0.71A 3deuB-3qptA:
17.4
3deuB-3qptA:
94.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3qpt TRANSCRIPTIONAL
REGULATOR SLYA


(Salmonella
enterica)
PF01047
(MarR)
5 THR A  36
ILE A  58
SER A  62
LEU A  63
THR A  66
None
0.73A 3deuB-3qptA:
17.4
3deuB-3qptA:
94.16
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.
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 THR A1006
ILE A 982
SER A1023
LEU A1024
None
0.96A 3deuB-3s51A:
undetectable
3deuB-3s51A:
8.26
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.
3t7v METHYLORNITHINE
SYNTHASE PYLB


(Methanosarcina
barkeri)
PF04055
(Radical_SAM)
4 THR A 219
SER A 257
LEU A 256
THR A 210
None
0.93A 3deuB-3t7vA:
undetectable
3deuB-3t7vA:
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.
3uw3 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Burkholderia
thailandensis)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
4 THR A  70
ILE A 130
LEU A 100
THR A  77
None
0.94A 3deuB-3uw3A:
undetectable
3deuB-3uw3A:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wec CYTOCHROME P450

(Rhodococcus
erythropolis)
PF00067
(p450)
4 ILE A 167
SER A 162
LEU A 165
THR A 251
None
0.92A 3deuB-3wecA:
undetectable
3deuB-3wecA:
18.20
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.
3wxm PROTEIN PELOTA
HOMOLOG


(Aeropyrum
pernix)
PF03463
(eRF1_1)
PF03465
(eRF1_3)
4 THR B  96
ILE B  60
LEU B  58
THR B  40
None
0.56A 3deuB-3wxmB:
undetectable
3deuB-3wxmB:
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.
3x38 MITOCHONDRIAL
MORPHOGENESIS
PROTEIN SLD7


(Saccharomyces
cerevisiae)
no annotation 4 THR A 222
SER A 242
LEU A 243
THR A 246
None
0.91A 3deuB-3x38A:
undetectable
3deuB-3x38A:
18.82
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.
4a64 CULLIN-4B

(Homo sapiens)
PF00888
(Cullin)
4 THR A 375
SER A 421
LEU A 422
THR A 425
None
0.76A 3deuB-4a64A:
undetectable
3deuB-4a64A:
18.18
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.
4ac1 ENDO-N-ACETYL-BETA-D
-GLUCOSAMINIDASE


(Trichoderma
reesei)
PF00704
(Glyco_hydro_18)
4 ILE X 234
SER X 238
LEU X 239
THR X 242
None
0.61A 3deuB-4ac1X:
undetectable
3deuB-4ac1X:
18.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4aij TRANSCRIPTIONAL
REGULATOR SLYA


(Yersinia
pseudotuberculosis)
PF01047
(MarR)
4 THR A  32
THR A  36
LEU A  63
THR A  66
None
0.46A 3deuB-4aijA:
17.9
3deuB-4aijA:
63.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4aij TRANSCRIPTIONAL
REGULATOR SLYA


(Yersinia
pseudotuberculosis)
PF01047
(MarR)
4 THR A  36
ILE A  58
LEU A  63
THR A  66
None
0.65A 3deuB-4aijA:
17.9
3deuB-4aijA:
63.01
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.
4cag POLYSACCHARIDE LYASE
FAMILY 11 PROTEIN


(Bacillus
licheniformis)
PF01839
(FG-GAP)
4 THR A 239
ILE A 173
LEU A 175
THR A 205
None
0.75A 3deuB-4cagA:
undetectable
3deuB-4cagA:
14.12
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.
4eyv PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Serendipita
indica)
PF00160
(Pro_isomerase)
4 THR A 119
SER A  99
LEU A  97
THR A 115
None
0.85A 3deuB-4eyvA:
undetectable
3deuB-4eyvA:
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.
4fha DIHYDRODIPICOLINATE
SYNTHASE


(Streptococcus
pneumoniae)
PF00701
(DHDPS)
4 THR A  13
ILE A  34
LEU A  38
THR A  42
None
0.84A 3deuB-4fhaA:
undetectable
3deuB-4fhaA:
18.91
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.
4fmc RORF2

(Escherichia
coli)
PF06872
(EspG)
4 THR A 393
THR A 362
LEU A 173
THR A 176
None
0.91A 3deuB-4fmcA:
undetectable
3deuB-4fmcA:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fqj HEMAGGLUTININ

(Influenza B
virus)
PF00509
(Hemagglutinin)
4 THR A  47
THR A  49
ILE A 315
LEU A 293
None
0.93A 3deuB-4fqjA:
undetectable
3deuB-4fqjA:
18.10
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.
4g1p CYS-GLY
METALLODIPEPTIDASE
DUG1


(Saccharomyces
cerevisiae)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
4 THR A 165
ILE A  61
SER A  50
LEU A  53
None
0.95A 3deuB-4g1pA:
undetectable
3deuB-4g1pA:
15.92
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.
4h1x PHOSPHATE-BINDING
PROTEIN PSTS 2


(Streptococcus
pneumoniae)
PF12849
(PBP_like_2)
4 ILE A  97
SER A 101
LEU A 102
THR A 103
None
0.83A 3deuB-4h1xA:
undetectable
3deuB-4h1xA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h8n CONJUGATED
POLYKETONE REDUCTASE
C2


(Candida
parapsilosis)
PF00248
(Aldo_ket_red)
4 THR A  59
ILE A  46
LEU A  42
THR A  65
None
0.90A 3deuB-4h8nA:
undetectable
3deuB-4h8nA:
19.11
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.
4hkt INOSITOL
2-DEHYDROGENASE


(Sinorhizobium
meliloti)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
4 THR A  74
ILE A  54
LEU A   8
THR A  70
None
0.81A 3deuB-4hktA:
undetectable
3deuB-4hktA:
17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hqs THIOREDOXIN FAMILY
PROTEIN


(Streptococcus
pneumoniae)
PF00578
(AhpC-TSA)
4 THR A 109
SER A  90
LEU A  91
THR A  94
None
0.81A 3deuB-4hqsA:
undetectable
3deuB-4hqsA:
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.
4jwy GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2D


(Rattus
norvegicus)
PF10613
(Lig_chan-Glu_bd)
4 THR A 134
THR A 243
ILE A 136
THR A 116
None
None
None
1N4  A 301 (-3.6A)
0.97A 3deuB-4jwyA:
undetectable
3deuB-4jwyA:
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.
4mla CYTOKININ OXIDASE 2

(Zea mays)
PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind)
4 THR A 163
ILE A 224
SER A 169
LEU A 168
FAD  A 601 (-2.9A)
FAD  A 601 (-3.9A)
FAD  A 601 (-3.2A)
None
0.96A 3deuB-4mlaA:
undetectable
3deuB-4mlaA:
16.90
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.
4r3u 2-HYDROXYISOBUTYRYL-
COA MUTASE LARGE
SUBUNIT


(Aquincola
tertiaricarbonis)
PF01642
(MM_CoA_mutase)
4 THR A 116
ILE A 144
LEU A 153
THR A  99
None
0.95A 3deuB-4r3uA:
1.5
3deuB-4r3uA:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w87 XYLOGLUCAN-SPECIFIC
ENDO-BETA-1,4-GLUCAN
ASE


(uncultured
bacterium)
PF00150
(Cellulase)
4 THR A 133
ILE A 151
LEU A 113
THR A 112
None
0.97A 3deuB-4w87A:
undetectable
3deuB-4w87A:
16.22
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.
4wwu MRNA TRANSPORT
REGULATOR MTR2


(Saccharomyces
cerevisiae)
PF10429
(Mtr2)
4 THR C  19
THR C  23
ILE C 153
LEU C 151
None
0.78A 3deuB-4wwuC:
undetectable
3deuB-4wwuC:
17.11
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.
4wy9 PUTATIVE MCP-TYPE
SIGNAL TRANSDUCTION
PROTEIN


(Campylobacter
jejuni)
PF02743
(dCache_1)
4 THR A  99
ILE A 213
SER A  72
LEU A  75
None
0.67A 3deuB-4wy9A:
undetectable
3deuB-4wy9A:
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.
4xgj UNCHARACTERIZED
PROTEIN


(Pectobacterium
atrosepticum)
PF07005
(DUF1537)
PF17042
(DUF1357_C)
4 THR A 312
ILE A 378
SER A 340
LEU A 343
None
0.95A 3deuB-4xgjA:
undetectable
3deuB-4xgjA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bnt ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Pseudomonas
aeruginosa)
no annotation 4 THR C  71
ILE C 131
LEU C 101
THR C  78
None
0.95A 3deuB-5bntC:
undetectable
3deuB-5bntC:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ckm MANNAN-BINDING
LECTIN SERINE
PEPTIDASE 2


(Rattus
norvegicus)
PF00431
(CUB)
PF07645
(EGF_CA)
4 THR A  78
THR A  76
SER A  50
LEU A  49
None
0.92A 3deuB-5ckmA:
undetectable
3deuB-5ckmA:
18.35
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.
5cxf ENVELOPE
GLYCOPROTEIN B


(Human
betaherpesvirus
5)
PF00606
(Glycoprotein_B)
PF17416
(Glycoprot_B_PH1)
PF17417
(Glycoprot_B_PH2)
4 THR A 255
THR A 253
ILE A 332
THR A 270
None
0.83A 3deuB-5cxfA:
undetectable
3deuB-5cxfA:
13.18
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.
5czl GLUCANASE

(Raoultella
ornithinolytica)
PF01270
(Glyco_hydro_8)
4 THR A  94
SER A 126
LEU A 127
THR A 131
None
0.83A 3deuB-5czlA:
undetectable
3deuB-5czlA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ern FUSICOCCADIENE
SYNTHASE


(Diaporthe
amygdali)
PF00348
(polyprenyl_synt)
4 ILE A 286
SER A 291
LEU A 292
THR A 295
None
0.63A 3deuB-5ernA:
undetectable
3deuB-5ernA:
21.71
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.
5iob BETA-GLUCOSIDASE-REL
ATED GLYCOSIDASES


(Corynebacterium
glutamicum)
PF00933
(Glyco_hydro_3)
4 THR A 214
SER A 268
LEU A 267
THR A 270
None
0.91A 3deuB-5iobA:
undetectable
3deuB-5iobA:
17.85
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.
5nva PUTATIVE
SODIUM:SOLUTE
SYMPORTER


(Proteus
mirabilis)
no annotation 4 THR A 264
ILE A 179
SER A  53
THR A 273
None
0.92A 3deuB-5nvaA:
undetectable
3deuB-5nvaA:
15.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5opt ACTIVATED PROTEIN
KINASE C RECEPTOR,
PUTATIVE


(Trypanosoma
cruzi)
no annotation 4 THR p  27
SER p  76
LEU p  75
THR p  25
None
0.85A 3deuB-5optp:
undetectable
3deuB-5optp:
19.06
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.
5vmn BAK PROTEIN

(Singapore
grouper
iridovirus)
no annotation 4 THR A  30
ILE A  72
SER A  73
LEU A  75
None
0.93A 3deuB-5vmnA:
undetectable
3deuB-5vmnA:
20.71
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.
5wuq ECF RNA POLYMERASE
SIGMA FACTOR SIGW


(Bacillus
subtilis)
PF04542
(Sigma70_r2)
PF08281
(Sigma70_r4_2)
4 THR A 143
ILE A 158
LEU A 162
THR A  78
None
0.95A 3deuB-5wuqA:
3.1
3deuB-5wuqA:
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.
5x5t ALPHA-KETOGLUTARIC
SEMIALDEHYDE
DEHYDROGENASE


(Azospirillum
brasilense)
PF00171
(Aldedh)
4 THR A   9
THR A   7
SER A 186
LEU A  91
None
0.92A 3deuB-5x5tA:
undetectable
3deuB-5x5tA:
17.50
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.
5yba PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Trichomonas
vaginalis)
no annotation 4 THR A 127
SER A 107
LEU A 105
THR A 123
None
0.84A 3deuB-5ybaA:
undetectable
3deuB-5ybaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zvs PUTATIVE CORE
PROTEIN NTPASE/VP5
VP2


(Aquareovirus C)
no annotation 4 THR 2 652
ILE 2 515
SER 4 218
THR 2 631
None
0.78A 3deuB-5zvs2:
undetectable
3deuB-5zvs2:
18.63