POTENTIAL TARGETS FROM HUMAN (RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES)
1) User may click on the DrReposER ID (the second column) to get information on the binding sites and drug molecule.
2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).
3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera through AutoDock Vina.


DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD 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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
1lw3 MYOTUBULARIN-RELATED
PROTEIN 2
(Homo
sapiens)
4 / 6GLY A 130
ALA A 183
LEU A 192
PRO A 185
None
1.00A16.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
6 / 6PHE A  40
ARG A 152
GLY A 153
ALA A 157
LEU A 185
PRO A 196
SAH  A1246 (-3.4A)
SAH  A1246 (-4.0A)
SAH  A1246 (-3.9A)
SAH  A1246 ( 3.7A)
None
None
0.27A71.43
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2vgq SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN,MITOCHONDRIA
L
ANTIVIRAL-SIGNALING
PROTEIN
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 258
ALA A 162
LEU A 247
PRO A 159
None
0.92A20.53
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2wmo DEDICATOR OF
CYTOKINESIS PROTEIN
9
(Homo
sapiens)
4 / 6PHE A 160
GLY A 162
ALA A 223
LEU A 218
None
0.94A19.48
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3hd6 AMMONIUM TRANSPORTER
RH TYPE C
(Homo
sapiens)
4 / 6GLY A 289
ALA A 292
LEU A 343
PRO A 347
None
0.98A19.92
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3n93 MALTOSE BINDING
PROTEIN-CRFR2 ALPHA
(Homo
sapiens)
4 / 6PHE A-112
ALA A-208
LEU A-123
PRO A-211
None
0.96A19.71
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3o3u MALTOSE-BINDING
PERIPLASMIC PROTEIN,
ADVANCED
GLYCOSYLATION END
PRODUCT-SPECIFIC
RECEPTOR
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE N 258
ALA N 162
LEU N 247
PRO N 159
None
0.99A18.40
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3oai MALTOSE-BINDING
PERIPLASMIC PROTEIN,
MYELIN PROTEIN P0
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 258
ALA A 162
LEU A 247
PRO A 159
None
0.95A19.00
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3py7 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PAXILLIN
LD1,PROTEIN E6
CHIMERA
(Deltapapillomavi
rus
4;
Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 259
ALA A 163
LEU A 248
PRO A 160
None
0.97A20.28
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3vd8 MALTOSE-BINDING
PERIPLASMIC PROTEIN,
INTERFERON-INDUCIBLE
PROTEIN AIM2
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 258
ALA A 162
LEU A 247
PRO A 159
None
0.98A19.60
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4egc MALTOSE-BINDING
PERIPLASMIC PROTEIN,
HOMEOBOX PROTEIN
SIX1 CHIMERA
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 258
ALA A 162
LEU A 247
PRO A 159
None
0.98A17.47
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4ifp MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NACHT, LRR
AND PYD
DOMAINS-CONTAINING
PROTEIN 1
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 259
ALA A 163
LEU A 248
PRO A 160
None
0.95A19.17
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4ikm MALTOSE-BINDING
PERIPLASMIC PROTEIN,
CASPASE RECRUITMENT
DOMAIN-CONTAINING
PROTEIN 8
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 259
ALA A 163
LEU A 248
PRO A 160
None
0.98A20.42
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4my2 MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NORRIN FUSION
PROTEIN
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 260
ALA A 164
LEU A 249
PRO A 161
None
0.96A19.46
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4rwf MALTOSE TRANSPORTER
SUBUNIT, RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 2,
CALCITONIN
GENE-RELATED PEPTIDE
TYPE 1 RECEPTOR
FUSION PROTEIN
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 260
ALA A 164
LEU A 249
PRO A 161
None
0.95A18.47
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4wrn MALTOSE-BINDING
PERIPLASMIC
PROTEIN,UROMODULIN
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 282
ALA A 186
LEU A 271
PRO A 183
None
0.98A18.06
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4xaj MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NUCLEAR
RECEPTOR SUBFAMILY 2
GROUP E MEMBER 1
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 260
ALA A 164
LEU A 249
PRO A 161
None
0.98A18.64
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4yzf BAND 3 ANION
TRANSPORT PROTEIN
(Homo
sapiens)
4 / 6GLY A 763
ALA A 452
LEU A 459
PRO A 458
None
0.92A13.58
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5h7n NLRP12-PYD WITH MBP
TAG
(Homo
sapiens)
4 / 6PHE A 259
ALA A 163
LEU A 248
PRO A 160
EDO  A 505 (-4.9A)
None
None
None
0.98A19.87
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5hzv MALTOSE-BINDING
PERIPLASMIC
PROTEIN,ENDOGLIN
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 625
ALA A 529
LEU A 614
PRO A 526
None
0.99A17.11
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5jj4 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,SINGLE-STRAN
DED DNA CYTOSINE
DEAMINASE
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE C 258
ALA C 162
LEU C 247
PRO C 159
None
0.96A19.71
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5tj2 SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN,GASDERMIN-B
FUSION PROTEIN
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 258
ALA A 162
LEU A 247
PRO A 159
None
0.96A18.95
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5v6y MALTOSE-BINDING
PERIPLASMIC
PROTEIN,RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 1,CALCITONIN
GENE-RELATED PEPTIDE
TYPE 1 RECEPTOR
(Escherichia
coli;
Homo
sapiens)
4 / 6PHE A 260
ALA A 164
LEU A 249
PRO A 161
None
0.98A17.46
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5wdi UBIQUITIN-ASSOCIATED
AND SH3
DOMAIN-CONTAINING
PROTEIN A
(Homo
sapiens)
4 / 6ARG A 564
GLY A 510
LEU A 549
PRO A 482
None
0.90A21.60
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5xfo PHD FINGER PROTEIN 1
(Homo
sapiens)
4 / 6PHE A 141
ARG A  40
GLY A  44
ALA A 214
None
None
ZN  A 403 ( 4.1A)
None
0.98A18.54
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
6d43 TRIOSEPHOSPHATE
ISOMERASE
(Homo
sapiens)
4 / 6ARG B  17
ALA B  46
LEU B  21
PRO B  44
None
0.88A15.10
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1cok PROTEIN (SECOND
SPLICE VARIANT P73)
(Homo
sapiens)
4 / 6THR A  24
PHE A  23
LEU A   7
LEU A  11
None
1.13A16.06
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1fsu N-ACETYLGALACTOSAMIN
E-4-SULFATASE
(Homo
sapiens)
4 / 6THR A 164
PHE A 162
LEU A 232
LEU A 234
None
1.03A17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1x1f SIGNAL-TRANSDUCING
ADAPTOR PROTEIN 1
(Homo
sapiens)
4 / 6THR A  70
PHE A  82
LEU A  66
LEU A  84
None
1.17A22.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
5 / 6HIS A  52
THR A  55
GLN A 179
LEU A 217
LEU A 241
None
0.52A71.43
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2e5o ACTIVATING SIGNAL
COINTEGRATOR 1
(Homo
sapiens)
4 / 6HIS A  36
THR A  34
LEU A  40
LEU A  10
None
0.89A20.41
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2ik8 GUANINE
NUCLEOTIDE-BINDING
PROTEIN G(I),
ALPHA-1 SUBUNIT
(Homo
sapiens)
4 / 6HIS A 322
THR A 324
PHE A 323
LEU A 266
None
1.07A19.29
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
3cqc NUCLEAR PORE COMPLEX
PROTEIN NUP133
(Homo
sapiens)
4 / 6HIS B1004
THR B1007
LEU B1054
LEU B1031
None
1.16A23.44
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
3i4r NUCLEAR PORE COMPLEX
PROTEIN NUP133
(Homo
sapiens)
4 / 6HIS B1004
THR B1007
LEU B1054
LEU B1031
None
1.18A19.02
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
3zwf ZINC
PHOSPHODIESTERASE
ELAC PROTEIN 1
(Homo
sapiens)
4 / 6HIS A  62
THR A  61
PHE A 187
LEU A 180
ZN  A1364 (-3.5A)
None
None
None
1.18A23.67
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4ifs FACT COMPLEX SUBUNIT
SSRP1
(Homo
sapiens)
4 / 6HIS A 363
GLN A 252
LEU A 208
LEU A 276
None
0.83A23.97
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4iyp IMMUNOGLOBULIN-BINDI
NG PROTEIN 1
(Homo
sapiens)
4 / 6HIS A 196
GLN A 198
LEU A 172
LEU A 168
None
1.18A22.34
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4jgv NUCLEAR RECEPTOR
SUBFAMILY 4 GROUP A
MEMBER 1
(Homo
sapiens)
4 / 6PHE A 387
GLN A 474
LEU A 468
LEU A 470
None
0.99A26.37
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4wd4 HEME OXYGENASE 1
(Homo
sapiens)
4 / 6HIS A 132
THR A 135
LEU A 118
LEU A  61
None
HEM  A 300 ( 4.9A)
None
None
1.04A21.94
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5gvb WD REPEAT AND
HMG-BOX DNA-BINDING
PROTEIN 1
(Homo
sapiens)
4 / 6THR A 637
PHE A 632
GLN A 582
LEU A 603
None
1.07A20.13
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5ogs WD REPEAT AND
HMG-BOX DNA-BINDING
PROTEIN 1
(Homo
sapiens)
4 / 6THR A 637
PHE A 632
GLN A 582
LEU A 603
None
1.07A19.22
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5ums FACT COMPLEX SUBUNIT
SSRP1
(Homo
sapiens)
4 / 6HIS A 363
GLN A 252
LEU A 208
LEU A 276
None
0.89A17.76
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
6c0t CGMP-DEPENDENT
PROTEIN KINASE 1
(Homo
sapiens)
4 / 6THR A 460
PHE A 463
LEU A 446
LEU A 492
None
1.14A16.67
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)
6fcx METHYLENETETRAHYDROF
OLATE REDUCTASE
(Homo
sapiens)
4 / 6THR A 235
PHE A 237
LEU A 305
LEU A 309
None
1.17A15.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
6 / 8PHE A  40
ARG A 152
GLY A 153
VAL A 156
LEU A 185
PRO A 196
SAH  A1246 (-3.4A)
SAH  A1246 (-4.0A)
SAH  A1246 (-3.9A)
None
None
None
0.35A71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
6 / 8PHE A  40
GLY A 153
VAL A 156
LEU A 185
PRO A 196
ARG A 226
SAH  A1246 (-3.4A)
SAH  A1246 (-3.9A)
None
None
None
None
0.62A71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
5 / 8PHE A  40
VAL A 156
PRO A 196
ARG A 226
TRP A 230
SAH  A1246 (-3.4A)
None
None
None
None
0.78A71.43
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2q7r ARACHIDONATE
5-LIPOXYGENASE-ACTIV
ATING PROTEIN
(Homo
sapiens)
4 / 8PHE A  85
GLY A  87
VAL A  15
LEU A  12
None
0.86A22.47
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3e0j DNA POLYMERASE
SUBUNIT DELTA-2
(Homo
sapiens)
4 / 8PHE A 341
VAL A 423
LEU A 369
PRO A 399
None
1.14A19.16
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3hd6 AMMONIUM TRANSPORTER
RH TYPE C
(Homo
sapiens)
4 / 8GLY A 289
VAL A 291
LEU A 343
PRO A 347
None
1.03A19.92
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3pua PHD FINGER PROTEIN 2
(Homo
sapiens)
4 / 8PHE A 314
VAL A 105
LEU A 270
PRO A 126
None
0.81A24.43
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
3u1k POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE 1, MITOCHONDRIAL
(Homo
sapiens)
4 / 8GLY A 161
VAL A 159
PRO A 165
ARG A 192
None
1.14A16.80
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4egc MALTOSE-BINDING
PERIPLASMIC PROTEIN,
HOMEOBOX PROTEIN
SIX1 CHIMERA
(Escherichia
coli;
Homo
sapiens)
4 / 8PHE A 258
GLY A 327
LEU A 247
PRO A 159
None
1.11A17.47
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4rcd BETA-SECRETASE 1
(Homo
sapiens)
4 / 8GLY A 177
VAL A 146
LEU A 140
PRO A  91
None
1.15A20.33
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5c08 1E6 TCR BETA CHAIN
(Homo
sapiens)
4 / 8GLY E 218
VAL E 122
LEU E 116
PRO E 154
None
1.10A22.38
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5k13 RETINOIC ACID
RECEPTOR ALPHA
(Homo
sapiens)
4 / 8PHE A 249
VAL A 191
LEU A 187
PRO A 247
None
1.14A20.35
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5txf PHOSPHATIDYLCHOLINE-
STEROL
ACYLTRANSFERASE
(Homo
sapiens)
4 / 8GLY A 205
VAL A 309
LEU A 191
TRP A 198
None
0.92A19.58
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
5xtd NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
9, MITOCHONDRIAL
(Homo
sapiens)
4 / 8PHE J  64
GLY J  66
VAL J  70
LEU J  94
None
1.04A23.08
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
6cph TCR BETA CHAIN
(Homo
sapiens)
4 / 8GLY E 232
VAL E 136
LEU E 130
PRO E 168
None
1.14A17.86
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
6en4 SPLICING FACTOR 3B
SUBUNIT 3
(Homo
sapiens)
4 / 8GLY A 247
VAL A 238
LEU A 315
PRO A 245
None
1.07A18.91
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1d4v TNF-RELATED
APOPTOSIS INDUCING
LIGAND
(Homo
sapiens)
4 / 7PHE B 275
LEU B 174
LEU B 164
LEU B 169
None
0.78A20.08
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1dg6 APO2L/TNF-RELATED
APOPOTIS INDUCING
LIGAND (TRAIL)
(Homo
sapiens)
4 / 7PHE A 275
LEU A 174
LEU A 164
LEU A 169
None
0.64A20.83
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1jjx BRAIN-TYPE FATTY
ACID BINDING PROTEIN
(Homo
sapiens)
4 / 7PHE A   4
LEU A  91
LEU A  66
LEU A  86
None
0.93A22.31
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1ozn RETICULON 4 RECEPTOR
(Homo
sapiens)
4 / 7THR A 125
LEU A 135
LEU A 112
LEU A 110
None
0.80A22.74
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1ozn RETICULON 4 RECEPTOR
(Homo
sapiens)
4 / 7THR A 173
LEU A 183
LEU A 161
LEU A 159
None
0.90A22.74
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1ozn RETICULON 4 RECEPTOR
(Homo
sapiens)
4 / 7THR A 173
LEU A 185
LEU A 166
LEU A 161
None
0.89A22.74
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
1tow FATTY ACID-BINDING
PROTEIN, ADIPOCYTE
(Homo
sapiens)
4 / 7PHE A   4
LEU A  91
LEU A  66
LEU A  86
None
0.65A17.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
5 / 7HIS A  52
THR A  55
GLN A 179
LEU A 217
LEU A 241
None
0.55A71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2bzg THIOPURINE
S-METHYLTRANSFERASE
(Homo
sapiens)
4 / 7THR A  55
GLN A 179
LEU A 181
LEU A 241
None
0.88A71.43
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2knh PROTEIN CBFA2T1
(Homo
sapiens)
4 / 7GLN A 341
LEU A 340
LEU A 333
LEU A 337
None
0.88A18.08
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
2wfh SLIT HOMOLOG 2
PROTEIN C-PRODUCT
(Homo
sapiens)
4 / 7THR A 820
LEU A 830
LEU A 808
LEU A 806
None
0.91A20.15
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
3dxb THIOREDOXIN
N-TERMINALLY FUSED
TO PUF60(UHM)
(Escherichia
coli;
Homo
sapiens)
4 / 7PHE A 446
LEU A 424
LEU A 397
LEU A 368
None
0.80A24.65
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
3nr3 PMP2 PROTEIN
(Homo
sapiens)
4 / 7PHE A   5
LEU A  92
LEU A  67
LEU A  87
None
0.73A22.75
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
3wbg FATTY ACID-BINDING
PROTEIN, HEART
(Homo
sapiens)
4 / 7PHE A   4
LEU A  91
LEU A  66
LEU A  86
None
0.60A27.86
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4a6e HYDROXYINDOLE
O-METHYLTRANSFERASE
(Homo
sapiens)
4 / 7PHE A 175
LEU A 342
LEU A 247
LEU A 280
None
0.61A23.23
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4ifs FACT COMPLEX SUBUNIT
SSRP1
(Homo
sapiens)
4 / 7HIS A 363
GLN A 252
LEU A 208
LEU A 276
None
0.77A23.97
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
4nns FATTY ACID-BINDING
PROTEIN, ADIPOCYTE
(Homo
sapiens)
4 / 7PHE A   4
LEU A  91
LEU A  66
LEU A  86
None
0.72A26.17
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5b29 FATTY ACID-BINDING
PROTEIN, HEART
(Homo
sapiens)
4 / 7PHE A   4
LEU A  91
LEU A  66
LEU A  86
None
0.71A21.37
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5cvo WD REPEAT-CONTAINING
PROTEIN 48
(Homo
sapiens)
4 / 7PHE A 264
GLN A 224
LEU A 226
LEU A 236
None
0.76A18.94
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5fah KALLIKREIN-7
(Homo
sapiens)
4 / 7HIS A  67
LEU A  34
LEU A  73
LEU A  40
None
0.82A21.45
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5iz5 CYTOSOLIC
PHOSPHOLIPASE A2
DELTA
(Homo
sapiens)
4 / 7PHE B 209
LEU B 189
LEU B 244
LEU B 219
None
0.91A15.58
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5k1c WD REPEAT-CONTAINING
PROTEIN 48
(Homo
sapiens)
4 / 7PHE B 264
GLN B 224
LEU B 226
LEU B 236
None
0.56A18.94
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5mpo MOLYBDOPTERIN
SYNTHASE SULFUR
CARRIER SUBUNIT
(Homo
sapiens)
4 / 7PHE A  57
LEU A  37
LEU A  73
LEU A  71
None
0.88A27.61
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5ums FACT COMPLEX SUBUNIT
SSRP1
(Homo
sapiens)
4 / 7HIS A 363
GLN A 252
LEU A 208
LEU A 276
None
0.81A17.76
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)
5xoc THIOREDOXIN
1,FORKHEAD BOX
PROTEIN H1
(Escherichia
coli;
Homo
sapiens)
4 / 7PHE B 313
LEU B 291
LEU B 264
LEU B 235
None
0.81A17.76
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
1hyn BAND 3 ANION
TRANSPORT PROTEIN
(Homo
sapiens)
4 / 6ARG P 283
THR P 103
ALA P 285
ALA P 284
None
1.17A19.97
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
2n1b GTP-BINDING NUCLEAR
PROTEIN RAN
(Homo
sapiens)
4 / 6GLU A   6
ARG A  56
ALA A   3
ALA A   2
None
1.04A15.23
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
2vr2 DIHYDROPYRIMIDINASE
(Homo
sapiens)
4 / 6GLU A 226
THR A 307
ALA A 254
ALA A 255
None
1.16A21.69
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
3wo4 INTERLEUKIN-18
RECEPTOR 1
(Homo
sapiens)
4 / 6GLU B 266
THR B 299
ALA B 278
ALA B 239
None
1.25A17.07
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4cnt DIHYDROPYRIMIDINASE-
LIKE 3
(Homo
sapiens)
4 / 6GLU A 232
THR A 313
ALA A 260
ALA A 261
None
1.21A22.06
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4ky9 BAND 3 ANION
TRANSPORT PROTEIN
(Homo
sapiens)
4 / 6ARG A 283
THR A 103
ALA A 285
ALA A 284
None
1.19A18.26
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4po6 NON-RECEPTOR
TYROSINE-PROTEIN
KINASE TYK2
(Homo
sapiens)
4 / 6PHE A 160
THR A 262
ALA A 165
ALA A 267
None
1.23A22.63
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4x0q DNA POLYMERASE THETA
(Homo
sapiens)
4 / 6GLU A2335
THR A2237
ALA A2477
ALA A2478
DG3  A2604 ( 4.4A)
None
None
None
1.04A22.26
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4xvm DNA POLYMERASE NU
(Homo
sapiens)
4 / 6GLU A 628
THR A 567
ALA A 772
ALA A 773
None
0.93A22.33
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
5aga DNA POLYMERASE THETA
(Homo
sapiens)
4 / 6GLU A 830
THR A 861
ALA A 876
ALA A 875
None
1.23A22.47
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
5brr TISSUE-TYPE
PLASMINOGEN
ACTIVATOR
(Homo
sapiens)
4 / 6ARG E  60
PHE E  59
ALA E  55
ALA E  56
None
1.20A15.38
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR
(Homo
sapiens)
4 / 6GLU A2388
ARG A2322
THR A2399
ALA A1428
None
1.08A14.53
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
5tf2 PROLACTIN REGULATORY
ELEMENT-BINDING
PROTEIN
(Homo
sapiens)
4 / 6PHE A  14
THR A  67
ALA A  30
ALA A  31
None
1.17A19.74
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
5xbk IMPORTIN-4
(Homo
sapiens)
4 / 6PHE D 851
THR D 885
ALA D 845
ALA D 844
None
1.05A7.77
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
6fuz KINESIN LIGHT CHAIN
1,KINESIN LIGHT
CHAIN
1,C-JUN-AMINO-TERMIN
AL
KINASE-INTERACTING
PROTEIN 1
(Homo
sapiens;
Mus
musculus)
4 / 6GLU A 434
ARG A 475
ALA A 482
ALA A 483
None
1.22A8.63
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
2a30 DEOXYCYTIDINE KINASE
(Homo
sapiens)
4 / 8THR A 181
LEU A 205
ALA A  31
ALA A  32
None
0.97A16.26
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
2i6b ADENOSINE KINASE
(Homo
sapiens)
4 / 8PHE A 302
LEU A 285
ALA A 326
ALA A 327
None
0.95A20.18
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
3gzd SELENOCYSTEINE LYASE
(Homo
sapiens)
4 / 8ARG C 185
LEU C 152
ALA C 161
ALA C 162
None
0.99A19.81
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
3gzd SELENOCYSTEINE LYASE
(Homo
sapiens)
4 / 8ARG C 185
THR C 164
LEU C 152
ALA C 161
None
0.87A19.81
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
3kvo HYDROXYSTEROID
DEHYDROGENASE-LIKE
PROTEIN 2
(Homo
sapiens)
4 / 8SER A  19
LEU A  50
ALA A 205
ALA A 204
NAP  A 501 (-2.7A)
None
NAP  A 501 (-3.3A)
None
0.94A18.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
3thz DNA MISMATCH REPAIR
PROTEIN MSH2
(Homo
sapiens)
4 / 8ARG A 308
LEU A 302
ALA A 710
ALA A 305
None
0.85A22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4bc5 XYLULOSE KINASE
(Homo
sapiens)
4 / 8PHE A 478
LEU A  11
ALA A  91
ALA A 477
None
0.97A22.11
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4cns DIHYDROPYRIMIDINASE-
LIKE 3
(Homo
sapiens)
5 / 8GLU A 232
SER A 308
THR A 313
ALA A 260
ALA A 261
None
1.46A21.75
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4cnt DIHYDROPYRIMIDINASE-
LIKE 3
(Homo
sapiens)
5 / 8GLU A 232
SER A 308
THR A 313
ALA A 260
ALA A 261
None
1.41A22.06
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4cyf PANTETHEINASE
(Homo
sapiens)
4 / 8SER A 265
LEU A  60
ALA A  34
ALA A  33
None
1.00A21.34
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4fgu LEGUMAIN
(Homo
sapiens)
4 / 8GLU A 187
SER A 307
ALA A 209
ALA A 210
None
0.91A20.58