SIMILAR PATTERNS OF AMINO ACIDS FOR 3UJ7_B_SAMB302

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.
1a6d THERMOSOME (BETA
SUBUNIT)

(Thermoplasma
acidophilum) 		PF00118
(Cpn60_TCP1) 		5 LEU B 105
GLY B 125
ILE B 511
ARG B 430
ALA B 434
 None
 1.11A 3uj7B-1a6dB:
undetectable		 3uj7B-1a6dB:
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.
1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89

(Zoogloea
ramigera) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 LEU A 258
ILE A 269
GLY A 273
ILE A 275
LEU A 358
 None
 1.04A 3uj7B-1dm3A:
undetectable		 3uj7B-1dm3A:
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT

(Methanopyrus
kandleri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 GLY A 429
GLY A 426
ILE A 494
ALA A 377
LEU A 436
 None
 1.13A 3uj7B-1e6vA:
undetectable		 3uj7B-1e6vA:
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.
1e6y METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanosarcina
barkeri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 GLY A1446
GLY A1443
ILE A1511
ALA A1394
LEU A1453
 None
 1.22A 3uj7B-1e6yA:
undetectable		 3uj7B-1e6yA:
18.07
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.
1ebl BETA-KETOACYL-ACP
SYNTHASE III

(Escherichia
coli) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A  22
GLY A 158
GLY A 273
ILE A  39
ALA A 143
 None
 1.11A 3uj7B-1eblA:
undetectable		 3uj7B-1eblA:
22.02
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.
1mf1 ADENYLOSUCCINATE
SYNTHETASE

(Mus musculus) 		PF00709
(Adenylsucc_synt) 		5 LEU A 128
ILE A  59
GLY A  99
ILE A 130
LEU A  84
 None
 0.90A 3uj7B-1mf1A:
undetectable		 3uj7B-1mf1A:
21.03
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.
1mro METHYL-COENZYME M
REDUCTASE

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 GLY A 426
GLY A 423
ILE A 491
ALA A 374
LEU A 433
 None
 1.15A 3uj7B-1mroA:
undetectable		 3uj7B-1mroA:
17.82
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.
1nt4 GLUCOSE-1-PHOSPHATAS
E

(Escherichia
coli) 		PF00328
(His_Phos_2) 		5 LEU A 366
ILE A 337
ILE A 371
ASP A 380
LEU A 273
 None
 1.07A 3uj7B-1nt4A:
undetectable		 3uj7B-1nt4A:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q1r PUTIDAREDOXIN
REDUCTASE

(Pseudomonas
putida) 		PF07992
(Pyr_redox_2)
PF14759
(Reductase_C) 		5 LEU A 152
ILE A 155
GLY A 161
GLY A 156
LEU A  53
 None
 1.19A 3uj7B-1q1rA:
2.6		 3uj7B-1q1rA:
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.
1sq7 TRIOSEPHOSPHATE
ISOMERASE

(Gallus gallus) 		PF00121
(TIM) 		5 ILE A  83
ILE A  46
ILE A  78
ALA A  43
LEU A  21
 None
 1.14A 3uj7B-1sq7A:
undetectable		 3uj7B-1sq7A:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tdt TETRAHYDRODIPICOLINA
TE-N-SUCCINYLTRANSFE
RASE

(Mycobacterium
bovis) 		PF00132
(Hexapep)
PF14602
(Hexapep_2)
PF14805
(THDPS_N_2) 		5 LEU A  59
ILE A 130
GLY A  36
GLY A 114
LEU A   4
 None
 1.16A 3uj7B-1tdtA:
undetectable		 3uj7B-1tdtA:
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.
1vlu GAMMA-GLUTAMYL
PHOSPHATE REDUCTASE

(Saccharomyces
cerevisiae) 		PF00171
(Aldedh) 		5 ILE A 246
ILE A 266
ILE A 232
ASP A 239
ALA A 238
 None
 1.18A 3uj7B-1vluA:
4.1		 3uj7B-1vluA:
19.31
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.
1xq1 PUTATIVE TROPINONE
REDUCATSE

(Arabidopsis
thaliana) 		PF13561
(adh_short_C2) 		5 GLY A  22
GLY A  27
ILE A  41
ILE A  30
LEU A  55
 None
 1.20A 3uj7B-1xq1A:
7.0		 3uj7B-1xq1A:
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.
1yr2 PROLYL
OLIGOPEPTIDASE

(Novosphingobium
capsulatum) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 LEU A 522
ILE A 406
GLY A 407
ASP A 383
ALA A 384
 None
 1.20A 3uj7B-1yr2A:
undetectable		 3uj7B-1yr2A:
15.11
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.
1z9a NAD(P)H-DEPENDENT
D-XYLOSE REDUCTASE

([Candida]
tenuis) 		PF00248
(Aldo_ket_red) 		5 ILE A 147
ILE A 166
ILE A 113
ARG A 181
ALA A 183
 None
 0.96A 3uj7B-1z9aA:
undetectable		 3uj7B-1z9aA:
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.
2ae0 MEMBRANE-BOUND LYTIC
MUREIN
TRANSGLYCOSYLASE A

(Escherichia
coli) 		PF03562
(MltA)
PF06725
(3D) 		5 GLY X  37
ILE X  43
ARG X 255
ALA X 256
LEU X 296
 None
 1.20A 3uj7B-2ae0X:
undetectable		 3uj7B-2ae0X:
21.74
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.
2d7m FILAMIN-C

(Homo sapiens) 		PF00630
(Filamin) 		5 LEU A  46
GLY A  90
ILE A  86
ASP A  10
ALA A  11
 None
 1.20A 3uj7B-2d7mA:
undetectable		 3uj7B-2d7mA:
19.25
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.
2hm2 PYRIN-ONLY PROTEIN 1

(Homo sapiens) 		PF02758
(PYRIN) 		5 LEU Q  27
GLY Q  45
GLY Q  42
ASP Q  51
LEU Q  20
 None
 1.10A 3uj7B-2hm2Q:
undetectable		 3uj7B-2hm2Q:
16.73
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.
2o57 PUTATIVE SARCOSINE
DIMETHYLGLYCINE
METHYLTRANSFERASE

(Galdieria
sulphuraria) 		PF08241
(Methyltransf_11) 		5 GLY A  90
GLY A  92
ASP A 158
ALA A 159
HIS A 162
 None
 0.63A 3uj7B-2o57A:
27.3		 3uj7B-2o57A:
28.30
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.
2o57 PUTATIVE SARCOSINE
DIMETHYLGLYCINE
METHYLTRANSFERASE

(Galdieria
sulphuraria) 		PF08241
(Methyltransf_11) 		5 GLY A  90
GLY A  92
ILE A 113
ASP A 158
ALA A 159
 None
 0.41A 3uj7B-2o57A:
27.3		 3uj7B-2o57A:
28.30
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.
2px5 GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)]

(Murray Valley
encephalitis
virus) 		PF01728
(FtsJ) 		5 GLY A 148
ILE A 181
CYH A 145
ILE A 147
LEU A 195
 None
None
None
SAH  A 500 ( 4.3A)
None
 0.93A 3uj7B-2px5A:
8.8		 3uj7B-2px5A:
23.68
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.
2v40 ADENYLOSUCCINATE
SYNTHETASE ISOZYME 2

(Homo sapiens) 		PF00709
(Adenylsucc_synt) 		5 LEU A 127
ILE A  56
GLY A  96
ILE A 129
LEU A  81
 None
 0.85A 3uj7B-2v40A:
undetectable		 3uj7B-2v40A:
19.74
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.
2var FRUCTOKINASE

(Sulfolobus
solfataricus) 		PF00294
(PfkB) 		5 LEU A  11
ILE A  79
GLY A  57
ILE A  65
ALA A 112
 KDG  A1313 ( 4.7A)
None
None
None
None
 1.00A 3uj7B-2varA:
3.7		 3uj7B-2varA:
25.91
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.
2wnr PROBABLE EXOSOME
COMPLEX EXONUCLEASE
1

(Methanothermobacter
thermautotrophicus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 ILE B 127
ILE B  31
ILE B  52
ALA B 147
LEU B 234
 None
 1.09A 3uj7B-2wnrB:
undetectable		 3uj7B-2wnrB:
22.95
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.
2zau SELENIDE, WATER
DIKINASE

(Aquifex
aeolicus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 LEU A  81
GLY A  73
ARG A 115
ASP A 119
ALA A 117
 None
 1.12A 3uj7B-2zauA:
undetectable		 3uj7B-2zauA:
24.33
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.
3ckb SUSD

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB) 		5 LEU A 435
GLY A 216
ILE A 286
ILE A 282
LEU A 158
 None
 1.22A 3uj7B-3ckbA:
undetectable		 3uj7B-3ckbA:
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.
3d7r ESTERASE

(Staphylococcus
aureus) 		PF07859
(Abhydrolase_3) 		5 LEU A 176
ILE A 130
GLY A 154
ALA A 156
LEU A 183
 None
 1.20A 3uj7B-3d7rA:
2.8		 3uj7B-3d7rA:
19.77
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.
3dni DEOXYRIBONUCLEASE I

(Bos taurus) 		PF03372
(Exo_endo_phos) 		5 LEU A  81
ILE A  25
GLY A  12
ILE A   8
ALA A  47
 None
 0.85A 3uj7B-3dniA:
undetectable		 3uj7B-3dniA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eeh PUTATIVE LIGHT AND
REDOX SENSING
HISTIDINE KINASE

(Haloarcula
marismortui) 		PF08447
(PAS_3) 		5 ILE A  37
GLY A 119
ILE A 102
ILE A  23
LEU A  78
 None
None
PG5  A 126 ( 4.4A)
None
None
 0.89A 3uj7B-3eehA:
undetectable		 3uj7B-3eehA:
18.80
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.
3fk5 3-OXOACYL-SYNTHASE
III

(Xanthomonas
oryzae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A 108
ILE A  78
ILE A  83
ASP A  75
ALA A  72
 None
 1.14A 3uj7B-3fk5A:
undetectable		 3uj7B-3fk5A:
24.36
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.
3ga2 ENDONUCLEASE V

(Bacillus
subtilis) 		PF04493
(Endonuclease_5) 		5 ILE A 143
GLY A  44
ILE A  65
ASP A 223
ALA A 222
 None
 1.18A 3uj7B-3ga2A:
undetectable		 3uj7B-3ga2A:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gcz POLYPROTEIN

(Yokose virus) 		PF01728
(FtsJ) 		5 GLY A 148
ILE A 182
CYH A 145
ILE A 147
LEU A 196
 None
None
None
SAM  A4633 ( 4.2A)
None
 1.03A 3uj7B-3gczA:
8.9		 3uj7B-3gczA:
25.77
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.
3h7l ENDOGLUCANASE

(Vibrio
parahaemolyticus) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		5 GLY A 250
GLY A 252
ILE A 255
ARG A 248
ALA A 245
 None
 1.04A 3uj7B-3h7lA:
undetectable		 3uj7B-3h7lA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hnr PROBABLE
METHYLTRANSFERASE
BT9727_4108

(Bacillus
thuringiensis) 		PF08241
(Methyltransf_11) 		5 GLY A  53
GLY A  55
ALA A 115
HIS A 118
LEU A 119
 None
 0.40A 3uj7B-3hnrA:
15.8		 3uj7B-3hnrA:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iau THREONINE DEAMINASE

(Solanum
lycopersicum) 		PF00291
(PALP) 		5 LEU A  69
GLY A 324
ILE A 322
ILE A 339
ALA A 327
 None
 1.22A 3uj7B-3iauA:
undetectable		 3uj7B-3iauA:
20.11
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.
3ilw DNA GYRASE SUBUNIT A

(Mycobacterium
tuberculosis) 		PF00521
(DNA_topoisoIV) 		5 GLY A 342
ILE A 189
ASP A 242
ALA A 243
LEU A 358
 None
 0.72A 3uj7B-3ilwA:
undetectable		 3uj7B-3ilwA:
19.15
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.
3o4c DE NOVO DESIGNED
BETA-TREFOIL
ARCHITECTURE WITH
SYMMETRIC PRIMARY
STRUCTURE

(synthetic
construct) 		PF00167
(FGF) 		5 LEU A  65
ILE A 111
GLY A  33
ILE A  25
ASP A 118
 None
 1.16A 3uj7B-3o4cA:
undetectable		 3uj7B-3o4cA:
18.22
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.
3pgb PUTATIVE
UNCHARACTERIZED
PROTEIN

(Aspergillus
nidulans) 		PF01179
(Cu_amine_oxid)
PF09248
(DUF1965) 		5 ILE A 501
GLY A 429
GLY A 427
ALA A 432
LEU A 465
 TPQ  A 504 ( 4.8A)
None
None
None
None
 0.80A 3uj7B-3pgbA:
undetectable		 3uj7B-3pgbA:
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.
3q41 GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
ZETA-1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		5 ILE A  83
GLY A  30
ILE A 116
ASP A  81
LEU A  33
 None
 0.98A 3uj7B-3q41A:
undetectable		 3uj7B-3q41A:
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.
3r2g INOSINE
5'-MONOPHOSPHATE
DEHYDROGENASE

(Legionella
pneumophila) 		PF00478
(IMPDH) 		5 LEU A 218
GLY A 298
GLY A 302
ILE A 214
LEU A  43
 None
 1.20A 3uj7B-3r2gA:
undetectable		 3uj7B-3r2gA:
19.78
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.
3r2h BACTERIOFERRITIN

(Pseudomonas
aeruginosa) 		PF00210
(Ferritin) 		5 LEU A  44
ILE A  76
GLY A  79
ILE A  27
ALA A  88
 None
 0.85A 3uj7B-3r2hA:
undetectable		 3uj7B-3r2hA:
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.
3vtx MAMA

(Candidatus
Magnetobacterium
bavaricum) 		PF00515
(TPR_1)
PF13174
(TPR_6)
PF13181
(TPR_8)
PF13414
(TPR_11) 		5 GLY A 119
ILE A 117
ILE A  98
ASP A 133
ALA A 134
 None
 1.22A 3uj7B-3vtxA:
undetectable		 3uj7B-3vtxA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4crs SERINE/THREONINE-PRO
TEIN KINASE N2

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 LEU A 673
ILE A 937
GLY A 743
ASP A 791
ALA A 740
 None
None
None
None
AGS  A1985 (-3.9A)
 1.21A 3uj7B-4crsA:
undetectable		 3uj7B-4crsA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dad PUTATIVE PILUS
ASSEMBLY-RELATED
PROTEIN

(Burkholderia
pseudomallei) 		PF00072
(Response_reg) 		5 LEU A  70
GLY A  34
ASP A  55
ALA A   7
LEU A   5
 None
 1.03A 3uj7B-4dadA:
4.3		 3uj7B-4dadA:
19.17
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.
4dq1 THYMIDYLATE SYNTHASE

(Staphylococcus
aureus) 		PF00303
(Thymidylat_synt) 		5 LEU A  12
ILE A  19
GLY A  20
ILE A 225
HIS A  37
 None
 1.23A 3uj7B-4dq1A:
undetectable		 3uj7B-4dq1A:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e6y CITRATE SYNTHASE

(Vibrio
vulnificus) 		PF00285
(Citrate_synt) 		5 LEU A 165
ILE A 118
GLY A 140
ILE A 253
ALA A 143
 None
 1.00A 3uj7B-4e6yA:
undetectable		 3uj7B-4e6yA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4egw MAGNESIUM TRANSPORT
PROTEIN CORA

(Methanocaldococcus
jannaschii) 		PF01544
(CorA) 		5 ILE A  77
GLY A  58
ILE A  50
ILE A  57
LEU A 100
 None
 0.79A 3uj7B-4egwA:
undetectable		 3uj7B-4egwA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		5 LEU W 465
GLY W 450
ILE W 447
ARG W 460
ALA W 590
 None
 0.67A 3uj7B-4f5xW:
undetectable		 3uj7B-4f5xW:
13.63
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.
4fno PEPTIDYL-TRNA
HYDROLASE

(Pseudomonas
aeruginosa) 		PF01195
(Pept_tRNA_hydro) 		5 LEU A 118
GLY A   9
GLY A  11
ALA A  93
HIS A  94
 None
 1.13A 3uj7B-4fnoA:
undetectable		 3uj7B-4fnoA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		5 LEU A 182
GLY A 232
GLY A 234
ARG A 298
HIS A 303
 SAH  A 501 (-4.0A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
None
SAH  A 501 (-4.0A)
 0.57A 3uj7B-4ineA:
38.6		 3uj7B-4ineA:
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		6 LEU A 182
ILE A 204
GLY A 232
GLY A 234
ASP A 299
HIS A 303
 SAH  A 501 (-4.0A)
SAH  A 501 (-4.5A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
None
SAH  A 501 (-4.0A)
 0.79A 3uj7B-4ineA:
38.6		 3uj7B-4ineA:
23.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		5 GLY A  61
GLY A  63
CYH A  85
ARG A 125
ASP A 126
 SAM  A 301 (-3.5A)
SAM  A 301 ( 3.9A)
BME  A 302 (-1.9A)
None
None
 0.80A 3uj7B-4iv8A:
35.5		 3uj7B-4iv8A:
59.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		8 GLY A  61
GLY A  63
ILE A  84
ARG A 125
ASP A 126
ALA A 127
HIS A 130
LEU A 131
 SAM  A 301 (-3.5A)
SAM  A 301 ( 3.9A)
SAM  A 301 (-3.8A)
None
None
SAM  A 301 (-3.4A)
SAM  A 301 (-3.9A)
None
 0.36A 3uj7B-4iv8A:
35.5		 3uj7B-4iv8A:
59.01
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.
4jga 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Rickettsia
rickettsii) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 LEU A 336
ILE A 307
ILE A 312
ASP A 304
ALA A 301
 None
 1.03A 3uj7B-4jgaA:
undetectable		 3uj7B-4jgaA:
19.50
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		5 LEU A 178
GLY A 228
GLY A 230
ARG A 294
HIS A 299
 SAH  A 701 ( 4.2A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.5A)
None
SAH  A 701 (-4.2A)
 0.54A 3uj7B-4kriA:
38.7		 3uj7B-4kriA:
23.80
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		6 LEU A 178
ILE A 200
GLY A 228
GLY A 230
ASP A 295
HIS A 299
 SAH  A 701 ( 4.2A)
SAH  A 701 ( 4.5A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.5A)
None
SAH  A 701 (-4.2A)
 0.66A 3uj7B-4kriA:
38.7		 3uj7B-4kriA:
23.80
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		5 LEU A 314
GLY A 361
ILE A 310
ASP A 364
ALA A 427
 None
 0.86A 3uj7B-4kriA:
38.7		 3uj7B-4kriA:
23.80
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.
4kws D-MANNONATE
DEHYDRATASE

(Chromohalobacter
salexigens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A   3
ILE A  24
GLY A  32
ILE A  98
ASP A   7
 None
 1.08A 3uj7B-4kwsA:
undetectable		 3uj7B-4kwsA:
19.80
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.
4lmp ALANINE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01262
(AlaDh_PNT_C)
PF05222
(AlaDh_PNT_N) 		5 GLY A 180
GLY A 138
ILE A 267
ARG A 185
ALA A 184
 None
 1.22A 3uj7B-4lmpA:
5.3		 3uj7B-4lmpA:
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.
4lz6 BH2163 PROTEIN

(Bacillus
halodurans) 		PF01554
(MatE) 		5 LEU A 101
ILE A  81
GLY A  74
GLY A  77
ILE A 104
 None
 1.07A 3uj7B-4lz6A:
undetectable		 3uj7B-4lz6A:
17.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		6 ILE A  33
GLY A  60
GLY A  62
CYH A  84
ARG A 124
ASP A 125
 SAM  A 301 (-4.3A)
SAM  A 301 (-3.7A)
SAM  A 301 ( 3.8A)
BME  A 303 (-1.9A)
None
None
 0.74A 3uj7B-4mwzA:
41.5		 3uj7B-4mwzA:
63.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		8 ILE A  33
GLY A  60
GLY A  62
ILE A  83
ARG A 124
ASP A 125
HIS A 129
LEU A 130
 SAM  A 301 (-4.3A)
SAM  A 301 (-3.7A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-3.7A)
None
None
SAM  A 301 (-3.9A)
None
 0.18A 3uj7B-4mwzA:
41.5		 3uj7B-4mwzA:
63.53
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.
4oyd APOPTOSIS REGULATOR
BHRF1

(Human
gammaherpesvirus
4) 		PF00452
(Bcl-2) 		5 LEU A  54
ILE A 154
GLY A  99
ILE A  57
ALA A 101
 None
 1.18A 3uj7B-4oydA:
undetectable		 3uj7B-4oydA:
18.25
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.
4p9n CARBOXYLESTERASE

(Sulfolobus
shibatae) 		PF07859
(Abhydrolase_3) 		5 LEU A 198
ILE A  84
ILE A 203
ILE A  19
ALA A 152
 None
 1.00A 3uj7B-4p9nA:
4.0		 3uj7B-4p9nA:
23.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4peq RIBONUCLEASE/ANGIOGE
NIN INHIBITOR 1

(Bos taurus) 		PF13516
(LRR_6) 		5 LEU B 271
GLY B 238
CYH B 243
ARG B 233
ASP B 262
 None
 1.21A 3uj7B-4peqB:
undetectable		 3uj7B-4peqB:
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.
4pvv ADENOSINE KINASE

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		5 ILE A 127
GLY A   7
GLY A  68
ILE A 143
ASP A 148
 None
 1.22A 3uj7B-4pvvA:
2.8		 3uj7B-4pvvA:
20.81
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.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23

(Saccharomyces
cerevisiae) 		PF08241
(Methyltransf_11) 		5 GLY B  55
GLY B  57
ILE B  78
ALA B 119
LEU B 123
 SAM  B 301 (-3.7A)
SAM  B 301 (-3.3A)
SAM  B 301 (-3.7A)
SAM  B 301 (-3.5A)
CSO  B 124 ( 4.4A)
 0.53A 3uj7B-4qtuB:
19.1		 3uj7B-4qtuB:
22.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		10 LEU A  14
ILE A  36
GLY A  63
GLY A  65
ILE A  86
CYH A  87
ARG A 127
ALA A 129
HIS A 132
LEU A 133
 None
SAH  A 302 ( 3.9A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.6A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.4A)
None
SAH  A 302 (-3.3A)
SAH  A 302 (-4.3A)
None
 0.28A 3uj7B-4r6wA:
46.2		 3uj7B-4r6wA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		8 LEU A  14
ILE A  36
GLY A  65
ILE A  86
CYH A  87
ILE A  90
ARG A 127
HIS A 132
 None
SAH  A 302 ( 3.9A)
SAH  A 302 (-3.6A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.4A)
None
None
SAH  A 302 (-4.3A)
 0.49A 3uj7B-4r6wA:
46.2		 3uj7B-4r6wA:
99.61
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.
4r7u UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Vibrio cholerae) 		PF00275
(EPSP_synthase) 		5 LEU A 199
GLY A 223
GLY A 225
ALA A  36
LEU A 176
 None
 1.20A 3uj7B-4r7uA:
undetectable		 3uj7B-4r7uA:
19.81
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.
4rsl FRUCTOSYL PEPTIDE
OXIDASE

(Penicillium
terrenum) 		PF01266
(DAO) 		5 GLY A 266
GLY A 263
CYH A  97
ALA A 328
LEU A 333
 None
 1.11A 3uj7B-4rslA:
2.5		 3uj7B-4rslA:
19.50
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.
4woq N-ACETYLNEURAMINATE
LYASE

(Clostridioides
difficile) 		PF00701
(DHDPS) 		5 LEU A  22
ILE A  32
GLY A  36
ILE A  76
LEU A 269
 None
 1.22A 3uj7B-4woqA:
undetectable		 3uj7B-4woqA:
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.
4xhp PARM HYBRID FUSION
PROTEIN

(Bacillus
thuringiensis) 		no annotation 5 LEU A 384
GLY A 377
GLY A 373
ASP A 350
ALA A 348
 None
None
ADP  A 901 (-4.2A)
None
None
 0.98A 3uj7B-4xhpA:
undetectable		 3uj7B-4xhpA:
16.07
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.
4yxm DNA INTEGRITY
SCANNING PROTEIN
DISA

(Thermotoga
maritima) 		PF00633
(HHH)
PF02457
(DisA_N)
PF10635
(DisA-linker) 		5 LEU A  80
ILE A  18
ILE A  78
ILE A 124
ALA A  27
 None
 0.95A 3uj7B-4yxmA:
undetectable		 3uj7B-4yxmA:
21.35
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.
4zlv ORNITHINE
AMINOTRANSFERASE,
MITOCHONDRIAL,
PUTATIVE

(Toxoplasma
gondii) 		PF00202
(Aminotran_3) 		5 LEU A 132
GLY A 285
GLY A 136
ILE A 295
LEU A 331
 None
None
PLP  A 501 (-3.1A)
None
None
 0.93A 3uj7B-4zlvA:
undetectable		 3uj7B-4zlvA:
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.
4zm4 AMINOTRANSFERASE

(Streptomyces
pactum) 		PF00202
(Aminotran_3) 		5 GLY A 289
GLY A 110
ARG A 291
ALA A 293
LEU A 130
 None
 1.24A 3uj7B-4zm4A:
2.3		 3uj7B-4zm4A:
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.
5b3j NMDA GLUTAMATE
RECEPTOR SUBUNIT

(Xenopus laevis) 		PF01094
(ANF_receptor) 		5 ILE A  83
GLY A  30
ILE A 116
ASP A  81
LEU A  33
 None
 1.07A 3uj7B-5b3jA:
undetectable		 3uj7B-5b3jA:
22.34
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.
5b3j NMDA GLUTAMATE
RECEPTOR SUBUNIT

(Xenopus laevis) 		PF01094
(ANF_receptor) 		5 ILE A 374
GLY A 271
GLY A 289
ILE A 241
ILE A 288
 None
 0.95A 3uj7B-5b3jA:
undetectable		 3uj7B-5b3jA:
22.34
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.
5dgq PUTATIVE
ENDOGLUCANASE-RELATE
D PROTEIN

(Photobacterium
profundum) 		PF00759
(Glyco_hydro_9) 		5 GLY A 249
GLY A 251
ILE A 254
ARG A 247
ALA A 244
 None
 0.96A 3uj7B-5dgqA:
undetectable		 3uj7B-5dgqA:
18.76
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.
5e1b N-TERMINAL
XAA-PRO-LYS
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF05891
(Methyltransf_PK) 		5 GLY A  69
GLY A  71
ILE A  92
HIS A 140
LEU A 141
 SAH  A 301 (-3.9A)
SAH  A 301 (-3.1A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.8A)
None
 0.61A 3uj7B-5e1bA:
18.4		 3uj7B-5e1bA:
20.81
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.
5e9q GENOME POLYPROTEIN

(Dengue virus) 		PF01728
(FtsJ) 		5 GLY A 148
ILE A 179
CYH A 145
ILE A 147
LEU A 193
 None
None
None
SAM  A 301 ( 4.2A)
None
 1.00A 3uj7B-5e9qA:
8.3		 3uj7B-5e9qA:
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.
5gt5 PECTATE LYASE

(Paenibacillus
sp. 0602) 		no annotation 5 ILE A 273
GLY A 175
GLY A 246
ILE A 154
ALA A 172
 None
 0.92A 3uj7B-5gt5A:
undetectable		 3uj7B-5gt5A:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hdt SISTER CHROMATID
COHESION PROTEIN
PDS5 HOMOLOG B

(Homo sapiens) 		no annotation 5 LEU A 604
ILE A 449
ILE A 532
ASP A 538
ALA A 542
 None
 1.22A 3uj7B-5hdtA:
undetectable		 3uj7B-5hdtA:
12.12
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.
5hei NFRA2

(Bacillus
megaterium) 		PF00881
(Nitroreductase) 		5 LEU A  60
GLY A 135
ILE A  78
ILE A 134
LEU A 150
 None
FMN  A 301 (-3.5A)
None
FMN  A 301 ( 4.1A)
None
 1.02A 3uj7B-5heiA:
undetectable		 3uj7B-5heiA:
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.
5ikm NS5 METHYL
TRANSFERASE

(Dengue virus) 		PF01728
(FtsJ) 		5 GLY A 148
ILE A 179
CYH A 145
ILE A 147
LEU A 193
 None
None
None
SAM  A 311 ( 4.3A)
None
 0.98A 3uj7B-5ikmA:
8.5		 3uj7B-5ikmA:
21.12
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.
5jjr GENOME POLYPROTEIN

(Dengue virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		5 GLY A 148
ILE A 179
CYH A 145
ILE A 147
LEU A 193
 None
None
None
SAH  A1003 ( 4.3A)
None
 0.96A 3uj7B-5jjrA:
8.4		 3uj7B-5jjrA:
15.82
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.
5ltm PHENYLALANINE
AMMONIA LYASE

(Anabaena) 		no annotation 5 LEU B 181
ILE B 139
ILE B 177
ALA B 129
LEU B 151
 None
 1.17A 3uj7B-5ltmB:
undetectable		 3uj7B-5ltmB:
18.27
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.
5n28 METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanotorris
formicicus) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 GLY A 428
GLY A 425
ILE A 493
ALA A 376
LEU A 435
 TRX  A 429 ( 2.4A)
None
None
None
None
 1.15A 3uj7B-5n28A:
undetectable		 3uj7B-5n28A:
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.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 5 GLY A 304
GLY A 302
ILE A 308
ILE A 314
LEU A 324
 None
 0.96A 3uj7B-5nitA:
undetectable		 3uj7B-5nitA:
17.63
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.
5nju GENOME POLYPROTEIN

(Zika virus) 		no annotation 5 GLY A 148
ILE A 181
CYH A 145
ILE A 147
LEU A 195
 None
None
None
SAH  A1001 (-4.2A)
None
 1.06A 3uj7B-5njuA:
8.8		 3uj7B-5njuA:
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.
5nrm DOCCEL5: TYPE I
DOCKERIN REPEAT
DOMAIN FROM A.
CELLULOLYTICUS
FAMILY 5
ENDOGLUCANASE
WP_010249057 S51I,
L52N MUTANT

(Acetivibrio
cellulolyticus) 		no annotation 5 GLY B  10
ILE B  14
ASP B  37
ALA B  41
LEU B  44
 None
 0.81A 3uj7B-5nrmB:
undetectable		 3uj7B-5nrmB:
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.
5tw7 GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Neisseria
gonorrhoeae) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 LEU A 183
ILE A  51
GLY A 167
GLY A  79
ILE A  80
 None
 1.24A 3uj7B-5tw7A:
2.3		 3uj7B-5tw7A:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u2p SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Treponema
pallidum) 		PF01547
(SBP_bac_1) 		5 LEU A 352
GLY A 310
CYH A 143
ILE A 127
LEU A 279
 None
EDO  A 504 ( 3.9A)
None
None
None
 1.05A 3uj7B-5u2pA:
undetectable		 3uj7B-5u2pA:
20.92
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 6 LEU A 241
GLY A 290
GLY A 292
ARG A 355
ASP A 356
HIS A 360
 SAH  A 703 (-4.0A)
SAH  A 703 (-4.0A)
SAH  A 703 ( 3.7A)
None
PC  A 702 ( 4.6A)
SAH  A 703 (-4.0A)
 0.36A 3uj7B-5wp4A:
40.5		 3uj7B-5wp4A:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 5 GLY A 290
GLY A 292
ARG A 355
ASP A 356
HIS A 360
 SAH  A 501 (-3.8A)
SAH  A 501 (-3.6A)
None
None
SAH  A 501 (-4.0A)
 0.18A 3uj7B-5wp5A:
33.4		 3uj7B-5wp5A:
23.89
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.
5wug BETA-GLUCOSIDASE

(Paenibacillus
barengoltzii) 		no annotation 5 LEU A 524
GLY A 553
GLY A 555
ILE A 532
LEU A 507
 None
 1.02A 3uj7B-5wugA:
undetectable		 3uj7B-5wugA:
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.
5x3j GLYCOSIDE HYDROLASE
FAMILY 31

(Kribbella
flavida) 		no annotation 5 LEU A 718
GLY A 689
CYH A 710
ILE A 684
LEU A 612
 None
 1.07A 3uj7B-5x3jA:
undetectable		 3uj7B-5x3jA:
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.
5ykd D-HYDANTOINASE/DIHYD
ROPYRIMIDINASE

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A  51
ILE A   5
ILE A  31
ASP A 390
ALA A 391
 None
 0.89A 3uj7B-5ykdA:
undetectable		 3uj7B-5ykdA:
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.
6bj9 ACETYL-COA
ACETYLTRANSFERASE A

(Ascaris suum) 		no annotation 5 LEU A 300
GLY A 384
GLY A 279
ILE A 386
ALA A 374
 None
 1.17A 3uj7B-6bj9A:
undetectable		 3uj7B-6bj9A:
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.
6gdt -

(-) 		no annotation 5 GLY A 250
GLY A 252
ILE A 255
ARG A 248
ALA A 245
 None
 0.95A 3uj7B-6gdtA:
undetectable		 3uj7B-6gdtA:
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.
1b3q PROTEIN (CHEMOTAXIS
PROTEIN CHEA)

(Thermotoga
maritima) 		PF01584
(CheW)
PF02518
(HATPase_c)
PF02895
(H-kinase_dim) 		4 SER A 435
ASP A 449
ASP A 412
ILE A 411
 None
 1.30A 3uj7B-1b3qA:
undetectable		 3uj7B-1b3qA:
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.
1e4o MALTODEXTRIN
PHOSPHORYLASE

(Escherichia
coli) 		PF00343
(Phosphorylase) 		4 SER A 425
ASP A 786
ASP A 781
ILE A 784
 None
 1.28A 3uj7B-1e4oA:
1.6		 3uj7B-1e4oA:
15.52
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.
1eh5 PALMITOYL PROTEIN
THIOESTERASE 1

(Bos taurus) 		PF02089
(Palm_thioest) 		4 SER A 157
ASP A 237
ASP A 233
ILE A 235
 None
 1.07A 3uj7B-1eh5A:
2.1		 3uj7B-1eh5A:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mpp PEPSIN

(Rhizomucor
pusillus) 		PF00026
(Asp) 		4 TYR A 133
SER A  35
ASP A  87
ILE A  20
 None
 1.31A 3uj7B-1mppA:
undetectable		 3uj7B-1mppA:
19.94
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.
1p5v F1 CAPSULE ANTIGEN

(Yersinia pestis) 		PF09255
(Antig_Caf1) 		4 SER B 147
ASP B 111
ASP B  92
ILE B  98
 None
 1.40A 3uj7B-1p5vB:
undetectable		 3uj7B-1p5vB:
19.63
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.
1q48 NIFU-LIKE PROTEIN

(Haemophilus
influenzae) 		PF01592
(NifU_N) 		4 TYR A 121
SER A  81
ASP A   9
ILE A   8
 None
 1.14A 3uj7B-1q48A:
undetectable		 3uj7B-1q48A:
21.13
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.
1qe0 HISTIDINE--TRNA
LIGASE

(Staphylococcus
aureus) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		4 TYR A 151
SER A 309
ASP A 272
ILE A 280
 None
 1.27A 3uj7B-1qe0A:
undetectable		 3uj7B-1qe0A:
21.59
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 SER A 334
ASP A 325
ASP A 341
ILE A 374
 None
 1.31A 3uj7B-1ud3A:
undetectable		 3uj7B-1ud3A:
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 TYR A 293
ASP A 325
ASP A 341
ILE A 374
 None
 1.05A 3uj7B-1ud3A:
undetectable		 3uj7B-1ud3A:
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.
1uyo NALP

(Neisseria
meningitidis) 		PF03797
(Autotransporter) 		4 SER X 809
ASP X 892
ASP X 895
ILE X 896
 None
 1.18A 3uj7B-1uyoX:
undetectable		 3uj7B-1uyoX:
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.
1z6r MLC PROTEIN

(Escherichia
coli) 		PF00480
(ROK) 		4 SER A 273
ASP A 221
ASP A 195
ILE A 196
 None
 1.25A 3uj7B-1z6rA:
undetectable		 3uj7B-1z6rA:
20.29
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.
2aqx PREDICTED: INOSITOL
1,4,5-TRISPHOSPHATE
3-KINASE B

(Mus musculus) 		PF03770
(IPK) 		4 TYR A 921
SER A 876
ASP A 930
ILE A 931
 None
MG  A 600 ( 3.7A)
None
None
 1.29A 3uj7B-2aqxA:
undetectable		 3uj7B-2aqxA:
19.74
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.
2b4v RNA EDITING COMPLEX
PROTEIN MP57

(Trypanosoma
brucei) 		PF01909
(NTP_transf_2)
PF03828
(PAP_assoc) 		4 TYR A 423
SER A 278
ASP A 421
ILE A 419
 None
 1.28A 3uj7B-2b4vA:
undetectable		 3uj7B-2b4vA:
18.66
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.
2c0y PROCATHEPSIN S

(Homo sapiens) 		PF00112
(Peptidase_C1)
PF08246
(Inhibitor_I29) 		4 TYR A 191
SER A 284
ASP A 186
ILE A 183
 None
 1.38A 3uj7B-2c0yA:
undetectable		 3uj7B-2c0yA:
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.
2e4u METABOTROPIC
GLUTAMATE RECEPTOR 3

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		4 SER A 388
ASP A 334
ASP A 380
ILE A 379
 None
 1.37A 3uj7B-2e4uA:
undetectable		 3uj7B-2e4uA:
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.
2o6r VARIABLE LYMPHOCYTE
RECEPTOR B

(Eptatretus
burgeri) 		PF01462
(LRRNT)
PF11921
(DUF3439)
PF13855
(LRR_8) 		4 SER A 162
ASP A 140
ASP A 144
ILE A 142
 None
 1.25A 3uj7B-2o6rA:
undetectable		 3uj7B-2o6rA:
21.77
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.
2oux MAGNESIUM
TRANSPORTER

(Enterococcus
faecalis) 		PF00571
(CBS)
PF03448
(MgtE_N) 		4 TYR A  79
SER A  44
ASP A  67
ILE A  35
 None
 1.29A 3uj7B-2ouxA:
undetectable		 3uj7B-2ouxA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ozk URIDYLATE-SPECIFIC
ENDORIBONUCLEASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06471
(NSP11) 		4 SER A 207
ASP A 296
ASP A 323
ILE A 322
 None
 1.34A 3uj7B-2ozkA:
undetectable		 3uj7B-2ozkA:
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.
2pff FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00106
(adh_short)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 SER A1201
ASP A1209
ASP A1334
ILE A1211
 None
 1.38A 3uj7B-2pffA:
5.1		 3uj7B-2pffA:
9.10
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.
2pmi CYCLIN-DEPENDENT
PROTEIN KINASE PHO85

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase) 		4 TYR A 186
SER A 167
ASP A 191
ILE A 129
 None
 1.28A 3uj7B-2pmiA:
undetectable		 3uj7B-2pmiA:
21.36
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.
2pxj JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 3A

(Homo sapiens) 		PF02373
(JmjC)
PF02375
(JmjN) 		4 TYR A 141
SER A 288
ASP A  61
ILE A  62
 None
OGA  A5001 (-3.5A)
None
None
 1.34A 3uj7B-2pxjA:
undetectable		 3uj7B-2pxjA:
23.25
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.
2qor GUANYLATE KINASE

(Plasmodium
vivax) 		PF00625
(Guanylate_kin) 		4 TYR A 121
SER A 113
ASP A 118
ILE A   4
 None
 1.32A 3uj7B-2qorA:
undetectable		 3uj7B-2qorA:
22.06
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.
2qzw CANDIDAPEPSIN-1

(Candida
albicans) 		PF00026
(Asp) 		4 TYR A 137
SER A  35
ASP A  97
ILE A  20
 None
 1.30A 3uj7B-2qzwA:
undetectable		 3uj7B-2qzwA:
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.
2w43 HYPOTHETICAL
2-HALOALKANOIC ACID
DEHALOGENASE

(Sulfurisphaera
tokodaii) 		PF13419
(HAD_2) 		4 TYR A 134
SER A  95
ASP A 184
ILE A 167
 None
PO4  A 400 (-2.6A)
None
None
 1.30A 3uj7B-2w43A:
undetectable		 3uj7B-2w43A:
22.68
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.
2x63 ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		4 TYR A 162
SER A 132
ASP A 242
ILE A 243
 C  A1261 (-4.2A)
C  A1261 (-2.8A)
None
None
 1.11A 3uj7B-2x63A:
undetectable		 3uj7B-2x63A:
24.48
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.
2xwb COMPLEMENT C3B
ALPHA' CHAIN
COMPLEMENT FACTOR B

(Homo sapiens;
Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl)
PF00084
(Sushi)
PF00089
(Trypsin)
PF00092
(VWA) 		4 TYR F 664
SER B1283
ASP F 666
ILE F 622
 None
 1.00A 3uj7B-2xwbF:
undetectable		 3uj7B-2xwbF:
16.94
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.
2yy6 PHOSPHOGLYCOLATE
PHOSPHATASE

(Aquifex
aeolicus) 		PF13419
(HAD_2) 		4 SER A 197
ASP A 162
ASP A 164
ILE A 167
 None
 1.24A 3uj7B-2yy6A:
undetectable		 3uj7B-2yy6A:
22.43
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.
2z7x TOLL-LIKE RECEPTOR
1, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 SER B 507
ASP B 485
ASP B 489
ILE B 487
 None
 1.25A 3uj7B-2z7xB:
undetectable		 3uj7B-2z7xB:
20.46
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.
2z7x TOLL-LIKE RECEPTOR
2, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 SER A 538
ASP A 516
ASP A 520
ILE A 518
 None
 1.36A 3uj7B-2z7xA:
undetectable		 3uj7B-2z7xA:
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.
2z80 TOLL-LIKE RECEPTOR
2, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 SER A 316
ASP A 294
ASP A 298
ILE A 296
 None
 1.19A 3uj7B-2z80A:
undetectable		 3uj7B-2z80A:
23.94
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.
3ada SARCOSINE OXIDASE
BETA SUBUNIT

(Corynebacterium
sp. U-96) 		PF01266
(DAO) 		4 TYR B 292
SER B 229
ASP B 287
ILE B 286
 None
 1.37A 3uj7B-3adaB:
undetectable		 3uj7B-3adaB:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3afl OLIGO ALGINATE LYASE

(Agrobacterium
fabrum) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		4 TYR A 349
SER A 310
ASP A 356
ILE A 501
 None
LGU  A1002 ( 2.8A)
None
None
 1.38A 3uj7B-3aflA:
undetectable		 3uj7B-3aflA:
14.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bbl REGULATORY PROTEIN
OF LACI FAMILY

(Chloroflexus
aggregans) 		PF13377
(Peripla_BP_3) 		4 TYR A  68
SER A  87
ASP A 165
ILE A 166
 None
 1.28A 3uj7B-3bblA:
undetectable		 3uj7B-3bblA:
20.85
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.
3e03 SHORT CHAIN
DEHYDROGENASE

(Xanthomonas
campestris) 		PF13561
(adh_short_C2) 		4 SER A 100
ASP A 269
ASP A 244
ILE A 242
 None
 1.37A 3uj7B-3e03A:
5.8		 3uj7B-3e03A:
21.97
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.
3fzq PUTATIVE HYDROLASE

(Clostridioides
difficile) 		PF08282
(Hydrolase_3) 		4 SER A 243
ASP A  17
ASP A  54
ILE A  22
 None
 1.27A 3uj7B-3fzqA:
undetectable		 3uj7B-3fzqA:
23.76
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.
3gbv PUTATIVE LACI-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Bacteroides
fragilis) 		PF13407
(Peripla_BP_4) 		4 TYR A  80
SER A 208
ASP A 341
ILE A 340
 EDO  A 363 (-3.5A)
None
None
None
 1.20A 3uj7B-3gbvA:
2.5		 3uj7B-3gbvA:
21.84
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.
3gpi NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Methylobacillus
flagellatus) 		PF13460
(NAD_binding_10) 		4 SER A 266
ASP A 186
ASP A  11
ILE A 155
 None
 1.25A 3uj7B-3gpiA:
5.4		 3uj7B-3gpiA:
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 TYR A 620
SER A 604
ASP A 608
ASP A 624
 None
 1.30A 3uj7B-3h0gA:
undetectable		 3uj7B-3h0gA:
9.93
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.
3i4x TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Aspergillus
fumigatus) 		PF11991
(Trp_DMAT) 		4 TYR A 394
SER A 416
ASP A 353
ASP A 390
 None
 1.27A 3uj7B-3i4xA:
undetectable		 3uj7B-3i4xA:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 1

(Thermus
thermophilus) 		PF01512
(Complex1_51K)
PF10531
(SLBB)
PF10589
(NADH_4Fe-4S) 		4 TYR 1 180
SER 1 100
ASP 1  94
ILE 1 218
 FMN  1 440 ( 4.1A)
None
FMN  1 440 (-4.4A)
None
 1.18A 3uj7B-3i9v1:
undetectable		 3uj7B-3i9v1:
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.
3jtx AMINOTRANSFERASE

(Neisseria
meningitidis) 		PF00155
(Aminotran_1_2) 		4 TYR A 209
SER A 180
ASP A 206
ILE A 131
 LLP  A 244 ( 4.3A)
None
LLP  A 244 ( 2.8A)
None
 1.17A 3uj7B-3jtxA:
3.2		 3uj7B-3jtxA:
21.21
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.
3n58 ADENOSYLHOMOCYSTEINA
SE

(Brucella
abortus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 SER A 158
ASP A 316
ASP A 321
ILE A 320
 None
 1.39A 3uj7B-3n58A:
2.9		 3uj7B-3n58A:
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.
3psg PEPSINOGEN

(Sus scrofa) 		PF00026
(Asp)
PF07966
(A1_Propeptide) 		5 TYR A   9
SER A  36
ASP A 215
ASP A 303
ILE A 306
 None
 1.42A 3uj7B-3psgA:
undetectable		 3uj7B-3psgA:
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.
3r2t PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		4 TYR A  49
SER A  54
ASP A 169
ASP A 211
 None
None
None
SO4  A 234 (-2.2A)
 1.39A 3uj7B-3r2tA:
undetectable		 3uj7B-3r2tA:
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.
3rp7 FLAVOPROTEIN
MONOOXYGENASE

(Klebsiella
pneumoniae) 		PF01494
(FAD_binding_3) 		4 SER A 206
ASP A 293
ASP A 345
ILE A 346
 None
 1.37A 3uj7B-3rp7A:
undetectable		 3uj7B-3rp7A:
20.38
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.
3rwb PYRIDOXAL
4-DEHYDROGENASE

(Mesorhizobium
loti) 		PF13561
(adh_short_C2) 		4 SER A 189
ASP A  38
ASP A  61
ILE A  62
 NAD  A 251 (-2.6A)
NAD  A 251 (-2.7A)
NAD  A 251 (-3.8A)
NAD  A 251 (-3.9A)
 1.00A 3uj7B-3rwbA:
6.6		 3uj7B-3rwbA:
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.
3s25 HYPOTHETICAL
7-BLADED
BETA-PROPELLER-LIKE
PROTEIN

([Eubacterium]
rectale) 		PF16472
(DUF5050) 		4 TYR A  97
SER A 117
ASP A  91
ILE A 164
 None
 1.39A 3uj7B-3s25A:
undetectable		 3uj7B-3s25A:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u8e PAPAIN-LIKE CYSTEINE
PROTEASE

(Crocus sativus) 		PF00112
(Peptidase_C1) 		4 TYR A  89
SER A 184
ASP A  84
ILE A  81
 GOL  A 226 ( 4.4A)
SO4  A 227 ( 4.7A)
GOL  A 226 ( 4.0A)
None
 1.36A 3uj7B-3u8eA:
undetectable		 3uj7B-3u8eA:
20.50
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.
3utn THIOSULFATE
SULFURTRANSFERASE
TUM1

(Saccharomyces
cerevisiae) 		PF00581
(Rhodanese) 		4 SER X 154
ASP X 159
ASP X 164
ILE X 162
 None
DMS  X 405 (-3.1A)
None
None
 1.32A 3uj7B-3utnX:
undetectable		 3uj7B-3utnX:
20.12
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.
3v94 CYCLIC NUCLEOTIDE
SPECIFIC
PHOSPHODIESTERASE

(Trypanosoma
cruzi) 		PF00233
(PDEase_I) 		4 TYR A 367
SER A 525
ASP A 521
ASP A 481
 WYQ  A 701 (-4.5A)
None
ZN  A 702 (-1.9A)
None
 1.35A 3uj7B-3v94A:
undetectable		 3uj7B-3v94A:
21.13
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 TYR A1957
SER A1989
ASP A2104
ILE A2108
 None
None
None
ADP  A9001 (-4.3A)
 1.25A 3uj7B-3vkgA:
undetectable		 3uj7B-3vkgA:
6.53
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.
4arr TOLL RECEPTOR,
VARIABLE LYMPHOCYTE
RECEPTOR B.61
CHIMERA

(Drosophila
melanogaster;
Eptatretus
burgeri) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 SER A 260
ASP A 238
ASP A 242
ILE A 240
 None
 1.34A 3uj7B-4arrA:
undetectable		 3uj7B-4arrA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eei ADENYLOSUCCINATE
LYASE

(Francisella
tularensis) 		PF00206
(Lyase_1) 		4 TYR A 312
SER A 224
ASP A  99
ILE A 214
 None
 1.10A 3uj7B-4eeiA:
undetectable		 3uj7B-4eeiA:
21.35
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.
4es6 UROPORPHYRINOGEN-III
SYNTHASE

(Pseudomonas
aeruginosa) 		PF02602
(HEM4) 		4 TYR A 169
SER A  31
ASP A  38
ILE A  37
 None
 1.21A 3uj7B-4es6A:
undetectable		 3uj7B-4es6A:
19.13
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.
4fhn NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		4 SER B 738
ASP B 682
ASP B 552
ILE B 548
 None
 1.33A 3uj7B-4fhnB:
undetectable		 3uj7B-4fhnB:
12.53
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.
4ifd EXOSOME COMPLEX
COMPONENT RRP43
EXOSOME COMPLEX
EXONUCLEASE RRP6

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01138
(RNase_PH)
no annotation 		4 TYR C  46
SER C  36
ASP K 582
ILE K 599
 None
 1.35A 3uj7B-4ifdC:
undetectable		 3uj7B-4ifdC:
20.90
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		4 TYR A 187
SER A 205
ASP A 254
ASP A 281
 SAH  A 501 ( 4.1A)
SAH  A 501 (-2.7A)
SAH  A 501 (-2.6A)
SAH  A 501 (-3.5A)
 0.38A 3uj7B-4ineA:
38.6		 3uj7B-4ineA:
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		4 TYR A 183
SER A 201
ASP A 250
ASP A 277
 SAH  A 701 ( 4.2A)
SAH  A 701 (-2.7A)
SAH  A 701 (-2.7A)
SAH  A 701 (-3.4A)
 0.42A 3uj7B-4kriA:
38.7		 3uj7B-4kriA:
23.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		5 TYR A  16
SER A  34
ASP A  82
ASP A 107
ILE A 108
 SAM  A 301 ( 4.3A)
SAM  A 301 (-2.4A)
SAM  A 301 (-2.8A)
SAM  A 301 (-3.5A)
SAM  A 301 (-4.0A)
 0.27A 3uj7B-4mwzA:
41.5		 3uj7B-4mwzA:
63.53
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		4 SER A 363
ASP A 302
ASP A 299
ILE A 300
 None
 1.35A 3uj7B-4mzdA:
undetectable		 3uj7B-4mzdA:
20.58
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.
4nng 30S RIBOSOMAL
PROTEIN S1

(Mycobacterium
tuberculosis) 		PF00575
(S1) 		4 SER A 383
ASP A 374
ASP A 368
ILE A 296
 None
 0.96A 3uj7B-4nngA:
undetectable		 3uj7B-4nngA:
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.
4obm UNCHARACTERIZED
PROTEIN

([Eubacterium]
siraeum) 		no annotation 4 SER A 110
ASP A 268
ASP A 258
ILE A 265
 None
 1.40A 3uj7B-4obmA:
undetectable		 3uj7B-4obmA:
23.87
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.
4q3i OSSERK2 D128N

(Oryza sativa) 		PF08263
(LRRNT_2)
PF11921
(DUF3439) 		4 SER A 209
ASP A 187
ASP A 191
ILE A 189
 None
 1.28A 3uj7B-4q3iA:
undetectable		 3uj7B-4q3iA:
24.01
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.
4q3o MGS-MT1

(unidentified) 		PF07859
(Abhydrolase_3) 		4 TYR A 219
SER A 194
ASP A 123
ILE A 138
 None
CL  A 401 (-2.5A)
None
None
 1.29A 3uj7B-4q3oA:
4.1		 3uj7B-4q3oA:
19.25
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.
4q3o MGS-MT1

(unidentified) 		PF07859
(Abhydrolase_3) 		4 TYR A 219
SER A 194
ASP A 123
ILE A 142
 None
CL  A 401 (-2.5A)
None
None
 1.07A 3uj7B-4q3oA:
4.1		 3uj7B-4q3oA:
19.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		5 TYR A  19
SER A  37
ASP A  85
ASP A 110
ILE A 111
 SAH  A 302 ( 4.1A)
SAH  A 302 (-2.5A)
SAH  A 302 (-2.6A)
SAH  A 302 (-3.6A)
SAH  A 302 (-4.1A)
 0.16A 3uj7B-4r6wA:
46.2		 3uj7B-4r6wA:
99.61
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.
4r7o GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE,
PUTATIVE

(Bacillus
anthracis) 		PF03009
(GDPD) 		4 TYR A  68
SER A 183
ASP A  72
ILE A  73
 None
None
MG  A 401 (-3.0A)
None
 1.34A 3uj7B-4r7oA:
undetectable		 3uj7B-4r7oA:
23.10
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.
4rt6 HEME/HEMOPEXIN-BINDI
NG PROTEIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		4 TYR A 523
SER A 515
ASP A 511
ILE A 580
 None
 1.31A 3uj7B-4rt6A:
undetectable		 3uj7B-4rt6A:
15.43
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.
4we6 HEMAGGLUTININ HA1
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 SER A 169
ASP A  64
ASP A  61
ILE A 192
 None
 1.13A 3uj7B-4we6A:
undetectable		 3uj7B-4we6A:
23.47
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.
4wxu MYOCILIN

(Homo sapiens) 		PF02191
(OLF) 		4 SER A 324
ASP A 478
ASP A 384
ILE A 431
 None
NA  A 607 ( 2.3A)
None
None
 1.17A 3uj7B-4wxuA:
undetectable		 3uj7B-4wxuA:
21.31
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.
4xat NOELIN

(Homo sapiens) 		PF02191
(OLF) 		4 SER A 353
ASP A 453
ASP A 360
ILE A 407
 None
NA  A 504 ( 2.8A)
None
None
 1.25A 3uj7B-4xatA:
undetectable		 3uj7B-4xatA:
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.
4xe7 UNCHARACTERIZED
PROTEIN

(Bacillus
thuringiensis) 		no annotation 4 TYR A 401
SER A 133
ASP A 212
ILE A 213
 None
 1.31A 3uj7B-4xe7A:
undetectable		 3uj7B-4xe7A:
22.82
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.
4y4v CONSERVED
HYPOTHETICAL
SECRETED PROTEIN

(Helicobacter
pylori) 		PF03734
(YkuD) 		4 TYR A 280
SER A 283
ASP A 147
ILE A 157
 None
None
None
CSO  A 176 ( 4.7A)
 1.38A 3uj7B-4y4vA:
undetectable		 3uj7B-4y4vA:
22.13
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.
4ydo UNCHARACTERIZED
PROTEIN

(Candida
albicans) 		PF00432
(Prenyltrans) 		4 TYR B 379
SER B 400
ASP B 309
ILE B 362
 None
 1.35A 3uj7B-4ydoB:
undetectable		 3uj7B-4ydoB:
17.45
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.
4zdn AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 SER A 898
ASP A 870
ASP A 936
ILE A 937
 None
 1.19A 3uj7B-4zdnA:
undetectable		 3uj7B-4zdnA:
15.56
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.
5amo NOELIN

(Mus musculus) 		PF02191
(OLF) 		4 SER A 353
ASP A 453
ASP A 360
ILE A 407
 None
 1.40A 3uj7B-5amoA:
undetectable		 3uj7B-5amoA:
19.76
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.
5fav CHOLINE
TRIMETHYLAMINE-LYASE

(Desulfovibrio
alaskensis) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 SER A 595
ASP A 253
ASP A 251
ILE A 255
 None
 1.35A 3uj7B-5favA:
undetectable		 3uj7B-5favA:
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.
5fq6 PUTATIVE LIPOPROTEIN

(Bacteroides
thetaiotaomicron) 		PF12771
(SusD-like_2) 		4 TYR A 388
ASP A 195
ASP A 478
ILE A 479
 None
 1.36A 3uj7B-5fq6A:
undetectable		 3uj7B-5fq6A:
19.38
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.
5fv0 ESSC

(Geobacillus
thermodenitrificans) 		PF01580
(FtsK_SpoIIIE) 		4 SER A1441
ASP A1470
ASP A1263
ILE A1473
 None
 1.34A 3uj7B-5fv0A:
undetectable		 3uj7B-5fv0A:
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 SER A 330
ASP A  12
ASP A   8
ILE A   5
 None
 1.25A 3uj7B-5hc4A:
undetectable		 3uj7B-5hc4A:
20.21
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00202
(Aminotran_3) 		4 TYR A 400
SER A  67
ASP A  57
ILE A  56
 None
 1.03A 3uj7B-5hdmA:
undetectable		 3uj7B-5hdmA:
20.45
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.
5hrm HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 4 SER A 345
ASP A 350
ASP A 454
ILE A 462
 None
 1.33A 3uj7B-5hrmA:
undetectable		 3uj7B-5hrmA:
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.
5ido 3' TERMINAL URIDYLYL
TRANSFERASE

(Trypanosoma
brucei) 		PF03828
(PAP_assoc) 		4 TYR A 656
SER A 484
ASP A 654
ILE A 652
 None
UTP  A 701 (-3.1A)
None
None
 1.19A 3uj7B-5idoA:
undetectable		 3uj7B-5idoA:
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.
5jir OOP FAMILY OMPA-OMPF
PORIN

(Treponema
pallidum) 		no annotation 4 SER B 195
ASP B 294
ASP B 204
ILE B 203
 None
 1.31A 3uj7B-5jirB:
undetectable		 3uj7B-5jirB:
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.
5jtw COMPLEMENT C4-A

(Homo sapiens) 		PF00207
(A2M)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 SER B 842
ASP B 973
ASP B 971
ILE B 969
 None
 1.39A 3uj7B-5jtwB:
undetectable		 3uj7B-5jtwB:
18.27
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.
5mzh DYNEIN ASSEMBLY
FACTOR WITH WDR
REPEAT DOMAINS 1

(Chlamydomonas
reinhardtii) 		PF00400
(WD40) 		4 SER A 367
ASP A 306
ASP A 284
ILE A 283
 None
 1.37A 3uj7B-5mzhA:
undetectable		 3uj7B-5mzhA:
20.45
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.
5oo7 SLA2

(Chaetomium
thermophilum) 		no annotation 4 TYR A 233
SER A 211
ASP A 172
ILE A 171
 None
 1.15A 3uj7B-5oo7A:
undetectable		 3uj7B-5oo7A:
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.
5sva MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 31
DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF05669
(Med31)
PF13656
(RNA_pol_L_2) 		4 TYR k  17
SER k  11
ASP X  97
ASP X 104
 None
 1.24A 3uj7B-5svak:
undetectable		 3uj7B-5svak:
4.83
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.
5t9x GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		no annotation 4 TYR A 195
SER A 306
ASP A 177
ILE A 121
 None
None
IMD  A 402 (-3.5A)
None
 1.29A 3uj7B-5t9xA:
undetectable		 3uj7B-5t9xA:
19.25
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.
5ukh UNCHARACTERIZED
PROTEIN

(Streptococcus
intermedius) 		no annotation 4 SER A 281
ASP A 454
ASP A 537
ILE A 451
 None
CA  A 601 (-3.1A)
None
None
 1.20A 3uj7B-5ukhA:
undetectable		 3uj7B-5ukhA:
20.11
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 4 TYR A 246
SER A 264
ASP A 312
ASP A 338
 SAH  A 703 ( 4.0A)
SAH  A 703 (-2.6A)
SAH  A 703 (-2.6A)
SAH  A 703 (-3.3A)
 0.20A 3uj7B-5wp4A:
40.5		 3uj7B-5wp4A:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ze4 DIHYDROXY-ACID
DEHYDRATASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 4 TYR A 559
SER A 110
ASP A 568
ILE A 295
 None
 1.28A 3uj7B-5ze4A:
undetectable		 3uj7B-5ze4A:
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.
5znn SORTILIN

(Mus musculus) 		no annotation 4 TYR A 384
SER A 336
ASP A 378
ASP A 357
 None
 1.35A 3uj7B-5znnA:
undetectable		 3uj7B-5znnA:
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 VP2

(Aquareovirus C) 		no annotation 4 TYR 2 233
SER 2 143
ASP 2  92
ILE 2  84
 None
 1.11A 3uj7B-5zvs2:
undetectable		 3uj7B-5zvs2:
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.
6bxa TOLL-LIKE RECEPTOR
5B, VARIABLE
LYMPHOCYTE RECEPTOR
B CHIMERA

(Eptatretus
burgeri;
Danio rerio) 		no annotation 4 SER A 427
ASP A 405
ASP A 409
ILE A 407
 None
 1.31A 3uj7B-6bxaA:
undetectable		 3uj7B-6bxaA:
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.
6cn0 16S RRNA
(GUANINE(1405)-N(7))
-METHYLTRANSFERASE

(Proteus
mirabilis) 		no annotation 4 TYR A  60
ASP A 160
ASP A 188
ILE A 189
 None
 1.16A 3uj7B-6cn0A:
11.9		 3uj7B-6cn0A:
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.
6d3i -

(-) 		no annotation 4 TYR A 282
SER A  85
ASP A 258
ILE A  62
 None
 1.11A 3uj7B-6d3iA:
undetectable		 3uj7B-6d3iA:
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.
6f5d ATP SYNTHASE ALPHA
CHAIN, MITOCHONDRIAL

(Trypanosoma
brucei) 		no annotation 4 TYR A 307
SER A 295
ASP A 283
ILE A 219
 None
 1.33A 3uj7B-6f5dA:
undetectable		 3uj7B-6f5dA:
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.
6fb3 TENEURIN-2

(Gallus gallus) 		no annotation 4 SER A1094
ASP A1681
ASP A1944
ILE A1943
 None
 1.27A 3uj7B-6fb3A:
undetectable		 3uj7B-6fb3A:
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.
6fdf TRNA
(CYTOSINE(38)-C(5))-
METHYLTRANSFERASE

(Schizosaccharomyces
pombe) 		no annotation 4 SER A 311
ASP A  37
ASP A  58
ILE A  59
 SAH  A 401 (-2.8A)
SAH  A 401 (-2.7A)
SAH  A 401 (-3.8A)
SAH  A 401 (-3.7A)
 1.04A 3uj7B-6fdfA:
8.3		 3uj7B-6fdfA:
undetectable