SIMILAR PATTERNS OF AMINO ACIDS FOR 6C2M_A_SUEA1202

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.
1b3n PROTEIN (KETOACYL
ACYL CARRIER PROTEIN
SYNTHASE 2)

(Escherichia
coli) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ILE A 408
LEU A 394
GLY A 298
PHE A 322
ALA A 294
 None
 1.12A 6c2mA-1b3nA:
0.0		 6c2mA-1b3nA:
11.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bjn PHOSPHOSERINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00266
(Aminotran_5) 		5 ARG A  58
ILE A 179
GLY A 201
SER A 249
PHE A 253
 None
 1.01A 6c2mA-1bjnA:
0.0		 6c2mA-1bjnA:
13.25
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.
1bxz NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 179
VAL A 204
ILE A 262
GLY A 158
ALA A 171
 None
 0.93A 6c2mA-1bxzA:
undetectable		 6c2mA-1bxzA:
14.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		10 GLN A  41
PHE A  43
HIS A  57
GLY A  58
VAL A  78
ARG A 123
LEU A 135
GLY A 137
PHE A 154
ALA A 156
 None
 0.55A 6c2mA-1cu1A:
34.7		 6c2mA-1cu1A:
47.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		10 GLN A  41
PHE A  43
HIS A  57
GLY A  58
VAL A  78
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.63A 6c2mA-1cu1A:
34.7		 6c2mA-1cu1A:
47.97
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.
1efp PROTEIN (ELECTRON
TRANSFER
FLAVOPROTEIN)

(Paracoccus
denitrificans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 240
HIS A 264
GLY A 242
ILE A 212
ALA A 255
 FAD  A 399 (-3.9A)
FAD  A 399 (-3.9A)
FAD  A 399 (-3.1A)
None
None
 1.07A 6c2mA-1efpA:
undetectable		 6c2mA-1efpA:
15.91
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.
1efv ELECTRON TRANSFER
FLAVOPROTEIN

(Homo sapiens) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 262
HIS A 286
GLY A 264
GLY A 246
ALA A 277
 FAD  A 599 (-3.8A)
FAD  A 599 (-3.8A)
FAD  A 599 (-3.1A)
None
None
 1.11A 6c2mA-1efvA:
undetectable		 6c2mA-1efvA:
10.16
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.
1gju MALTODEXTRIN
GLYCOSYLTRANSFERASE

(Thermotoga
maritima) 		PF00128
(Alpha-amylase)
PF09083
(DUF1923) 		5 PHE A 320
GLY A 303
ILE A 214
LEU A 213
ALA A 208
 None
 1.08A 6c2mA-1gjuA:
undetectable		 6c2mA-1gjuA:
9.31
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 GLY A 388
ILE A 442
GLY A 327
SER A 439
ALA A 453
 None
 1.07A 6c2mA-1gpeA:
0.0		 6c2mA-1gpeA:
9.29
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.
1ijt FIBROBLAST GROWTH
FACTOR 4

(Homo sapiens) 		PF00167
(FGF) 		5 PHE A 135
GLY A 102
LEU A 115
GLY A 130
SER A 133
 None
 1.01A 6c2mA-1ijtA:
0.0		 6c2mA-1ijtA:
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.
1jsc ACETOHYDROXY-ACID
SYNTHASE

(Saccharomyces
cerevisiae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 HIS A 500
GLY A 498
LEU A 529
GLY A 526
SER A 552
 TPP  A 700 (-3.9A)
TPP  A 700 (-3.3A)
None
None
TPP  A 700 (-2.8A)
 1.13A 6c2mA-1jscA:
undetectable		 6c2mA-1jscA:
8.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mo2 ERYTHRONOLIDE
SYNTHASE, MODULES 5
AND 6

(Saccharopolyspora
erythraea) 		PF00975
(Thioesterase) 		5 ARG A 202
LEU A  38
GLY A  40
SER A  42
ALA A 205
 None
 0.95A 6c2mA-1mo2A:
undetectable		 6c2mA-1mo2A:
16.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 GLN A  41
HIS A  57
VAL A  78
GLY A 137
SER A 139
 None
 0.96A 6c2mA-1ns3A:
30.5		 6c2mA-1ns3A:
39.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		10 GLN A  41
PHE A  43
HIS A  57
GLY A  58
VAL A  78
ARG A 123
LEU A 135
GLY A 137
PHE A 154
ALA A 156
 None
 0.82A 6c2mA-1ns3A:
30.5		 6c2mA-1ns3A:
39.37
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.
1p9h INVASIN

(Yersinia
enterocolitica) 		PF05658
(YadA_head)
PF05662
(YadA_stalk) 		5 GLY A 131
ILE A 171
GLY A 158
SER A 147
ALA A 149
 None
 0.88A 6c2mA-1p9hA:
undetectable		 6c2mA-1p9hA:
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.
1pxt PEROXISOMAL
3-KETOACYL-COA
THIOLASE

(Saccharomyces
cerevisiae) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 VAL A  93
ILE A 228
LEU A 229
PHE A  66
ALA A 281
 None
 1.01A 6c2mA-1pxtA:
undetectable		 6c2mA-1pxtA:
11.55
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.
1q6y HYPOTHETICAL PROTEIN
YFDW

(Escherichia
coli) 		PF02515
(CoA_transf_3) 		5 GLY A  44
VAL A  18
GLY A 392
SER A  71
ALA A 388
 None
COA  A 500 (-4.0A)
None
None
None
 1.09A 6c2mA-1q6yA:
undetectable		 6c2mA-1q6yA:
9.95
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.
1rhi HUMAN RHINOVIRUS 3
COAT PROTEIN
HUMAN RHINOVIRUS 3
COAT PROTEIN
HUMAN RHINOVIRUS 3
COAT PROTEIN

(Rhinovirus B;
Rhinovirus B;
Rhinovirus B) 		PF00073
(Rhv)
PF00073
(Rhv)
PF00073
(Rhv) 		5 HIS 2 186
GLY 1  40
ARG 1 256
LEU 3  96
GLY 3  50
 None
 1.05A 6c2mA-1rhi2:
undetectable		 6c2mA-1rhi2:
14.90
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.
1su1 HYPOTHETICAL PROTEIN
YFCE

(Escherichia
coli) 		PF12850
(Metallophos_2) 		5 HIS A  11
GLY A  42
ILE A  34
LEU A  35
GLY A  72
 ZN  A 302 ( 3.4A)
None
None
None
None
 1.03A 6c2mA-1su1A:
undetectable		 6c2mA-1su1A:
15.38
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.
1xr4 PUTATIVE CITRATE
LYASE ALPHA
CHAIN/CITRATE-ACP
TRANSFERASE

(Salmonella
enterica) 		PF04223
(CitF) 		5 HIS A 142
GLY A 392
ILE A  97
LEU A  96
SER A 118
 None
 0.99A 6c2mA-1xr4A:
undetectable		 6c2mA-1xr4A:
10.38
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.
2dht 409AA LONG
HYPOTHETICAL
NADP-DEPENDENT
ISOCITRATE
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00180
(Iso_dh) 		5 GLY A  97
VAL A 110
ILE A 311
LEU A 314
GLY A 346
 None
 0.95A 6c2mA-2dhtA:
undetectable		 6c2mA-2dhtA:
10.27
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.
2dkk CYTOCHROME P450

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 PHE A 155
VAL A 360
ARG A 291
ILE A 181
ALA A 248
 None
None
HEM  A 430 ( 4.4A)
None
HEM  A 430 ( 3.5A)
 0.96A 6c2mA-2dkkA:
undetectable		 6c2mA-2dkkA:
12.90
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.
2dq3 SERYL-TRNA
SYNTHETASE

(Aquifex
aeolicus) 		PF00587
(tRNA-synt_2b)
PF02403
(Seryl_tRNA_N) 		5 ARG A 173
ILE A 179
LEU A 178
GLY A 390
ALA A 172
 None
 1.14A 6c2mA-2dq3A:
undetectable		 6c2mA-2dq3A:
11.27
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.
2gvk HEME PEROXIDASE

(Bacteroides
thetaiotaomicron) 		PF04261
(Dyp_perox) 		5 GLY A  18
ILE A  25
SER A  65
PHE A  64
ALA A 114
 None
 1.07A 6c2mA-2gvkA:
undetectable		 6c2mA-2gvkA:
12.03
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.
2ixd LMBE-RELATED PROTEIN

(Bacillus cereus) 		PF02585
(PIG-L) 		5 PHE A 205
GLY A 216
VAL A  16
LEU A 212
GLY A 206
 None
 0.89A 6c2mA-2ixdA:
undetectable		 6c2mA-2ixdA:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j3m PROLYL-TRNA
SYNTHETASE

(Enterococcus
faecalis) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF04073
(tRNA_edit) 		5 GLY A 152
VAL A  35
ILE A 135
GLY A 444
SER A 446
 ATP  A 701 (-4.0A)
None
None
ATP  A 701 (-3.3A)
ATP  A 701 ( 4.7A)
 1.12A 6c2mA-2j3mA:
undetectable		 6c2mA-2j3mA:
9.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oh1 ACETYLTRANSFERASE,
GNAT FAMILY

(Listeria
monocytogenes) 		no annotation 5 PHE A 114
ARG A  35
ILE A  26
GLY A  78
SER A 111
 None
None
None
None
UNL  A 179 (-4.7A)
 1.04A 6c2mA-2oh1A:
undetectable		 6c2mA-2oh1A:
19.19
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.
2paj PUTATIVE
CYTOSINE/GUANINE
DEAMINASE

(unidentified) 		PF01979
(Amidohydro_1) 		5 GLY A 337
ARG A 116
ILE A 124
SER A  82
ALA A 119
 None
 1.06A 6c2mA-2pajA:
undetectable		 6c2mA-2pajA:
10.62
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.
2pro ALPHA-LYTIC PROTEASE

(Lysobacter
enzymogenes) 		PF02983
(Pro_Al_protease) 		5 VAL A 128
ARG A  82
ILE A  40
GLY A  45
ALA A  66
 None
 1.12A 6c2mA-2proA:
undetectable		 6c2mA-2proA:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qfe CALPAIN-7

(Homo sapiens) 		PF01067
(Calpain_III) 		5 HIS A 711
GLY A 705
ILE A 784
GLY A 740
SER A 787
 None
 1.07A 6c2mA-2qfeA:
undetectable		 6c2mA-2qfeA:
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.
2vfv XYLITOL OXIDASE

(Streptomyces
coelicolor) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 PHE A 407
GLY A 167
VAL A 148
GLY A 405
ALA A 400
 None
 1.05A 6c2mA-2vfvA:
undetectable		 6c2mA-2vfvA:
10.17
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.
2wda PUTATIVE SECRETED
LYASE

(Streptomyces
violaceoruber) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		5 GLY A 262
VAL A 287
ILE A 145
LEU A 198
ALA A 193
 None
 1.10A 6c2mA-2wdaA:
undetectable		 6c2mA-2wdaA:
7.45
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.
2x2i ALPHA-1,4-GLUCAN
LYASE ISOZYME 1

(Gracilariopsis
lemaneiformis) 		PF01055
(Glyco_hydro_31) 		5 HIS A 731
VAL A 663
ILE A 395
GLY A 374
ALA A 410
 QPS  A1050 (-4.3A)
None
None
None
None
 1.04A 6c2mA-2x2iA:
undetectable		 6c2mA-2x2iA:
6.35
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.
2xrm INTRACELLULAR
SUBTILISIN PROTEASE

(Bacillus
clausii) 		PF00082
(Peptidase_S8) 		5 HIS A 255
GLY A  24
VAL A 209
ILE A  45
GLY A 105
 None
 1.14A 6c2mA-2xrmA:
undetectable		 6c2mA-2xrmA:
14.92
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.
2xsz RUVB-LIKE 1

(Homo sapiens) 		PF06068
(TIP49) 		5 HIS A 259
GLY A 245
ILE A 272
GLY A  84
SER A 242
 None
 1.14A 6c2mA-2xszA:
undetectable		 6c2mA-2xszA:
14.60
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.
2y0k PYROGLUTATMATE PORIN
OPDO

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 PHE A 177
GLY A 146
VAL A 107
GLY A 195
ALA A 174
 None
 0.98A 6c2mA-2y0kA:
undetectable		 6c2mA-2y0kA:
12.64
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.
2ybq METHYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00590
(TP_methylase) 		5 GLN A 214
GLY A 219
ILE A  58
LEU A  57
GLY A  28
 None
 1.07A 6c2mA-2ybqA:
undetectable		 6c2mA-2ybqA:
17.20
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		5 HIS A  24
VAL A  22
LEU A 504
PHE A 517
ALA A 101
 None
 1.03A 6c2mA-2yevA:
undetectable		 6c2mA-2yevA:
7.82
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.
2z2n VIRGINIAMYCIN B
LYASE

(Staphylococcus
aureus) 		no annotation 5 PHE A 198
GLY A 207
ILE A 272
GLY A 187
ALA A 232
 None
 1.00A 6c2mA-2z2nA:
undetectable		 6c2mA-2z2nA:
16.00
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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		6 GLN A  63
PHE A  38
GLY A  40
GLY A  37
SER A  32
ALA A  30
 None
 1.34A 6c2mA-2zsgA:
undetectable		 6c2mA-2zsgA:
12.28
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.
3ayr ENDOGLUCANASE

(Piromyces
rhizinflatus) 		PF00150
(Cellulase) 		5 PHE A 323
GLY A 280
ILE A 333
LEU A 326
GLY A 324
 None
 0.80A 6c2mA-3ayrA:
undetectable		 6c2mA-3ayrA:
13.39
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.
3fpl NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Clostridium
beijerinckii;
Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 179
VAL A 204
ILE A 262
GLY A 158
ALA A 171
 None
 1.10A 6c2mA-3fplA:
undetectable		 6c2mA-3fplA:
11.11
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.
3g4e REGUCALCIN

(Homo sapiens) 		PF08450
(SGL) 		5 PHE A 102
VAL A  88
ARG A  41
GLY A 105
SER A  60
 None
 1.00A 6c2mA-3g4eA:
undetectable		 6c2mA-3g4eA:
13.38
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.
3h5l PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC TRANSPORTER

(Ruegeria
pomeroyi) 		PF13458
(Peripla_BP_6) 		5 VAL A 378
LEU A 279
GLY A 282
SER A 284
ALA A 302
 None
 1.11A 6c2mA-3h5lA:
undetectable		 6c2mA-3h5lA:
12.99
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.
3i09 PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Burkholderia
mallei) 		PF13458
(Peripla_BP_6) 		5 HIS A 200
LEU A 253
GLY A 228
PHE A 175
ALA A 225
 None
None
EDO  A   8 ( 4.0A)
AAE  A 501 (-3.6A)
None
 1.03A 6c2mA-3i09A:
undetectable		 6c2mA-3i09A:
12.16
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.
3ip1 ALCOHOL
DEHYDROGENASE,
ZINC-CONTAINING

(Thermotoga
maritima) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 HIS A  95
GLY A  94
VAL A 155
ILE A 223
SER A  68
 CD  A 501 (-3.4A)
None
None
None
CD  A 501 ( 3.7A)
 1.11A 6c2mA-3ip1A:
undetectable		 6c2mA-3ip1A:
13.35
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.
3iz3 STRUCTURAL PROTEIN
VP1
VIRAL STRUCTURAL
PROTEIN 5

(Cypovirus 1;
Cypovirus 1) 		no annotation
no annotation 		5 GLY D  88
VAL B 337
LEU D  56
GLY D 138
SER D  91
 None
 1.08A 6c2mA-3iz3D:
undetectable		 6c2mA-3iz3D:
15.17
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.
3k7t 6-HYDROXY-L-NICOTINE
OXIDASE

(Paenarthrobacter
nicotinovorans) 		PF01593
(Amino_oxidase) 		5 GLN A 170
HIS A 281
GLY A 282
VAL A 276
GLY A 285
 None
 1.03A 6c2mA-3k7tA:
undetectable		 6c2mA-3k7tA:
13.62
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.
3kx6 FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Babesia bovis) 		PF00274
(Glycolytic) 		5 VAL A 232
ARG A 301
ILE A  74
LEU A  28
GLY A  26
 None
CIT  A 400 (-3.5A)
None
None
None
 1.08A 6c2mA-3kx6A:
undetectable		 6c2mA-3kx6A:
12.13
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.
3lp8 PHOSPHORIBOSYLAMINE-
GLYCINE LIGASE

(Ehrlichia
chaffeensis) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 PHE A 175
GLY A 152
VAL A 141
GLY A 176
ALA A 181
 None
 1.08A 6c2mA-3lp8A:
undetectable		 6c2mA-3lp8A:
13.62
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.
3q3w 3-ISOPROPYLMALATE
DEHYDRATASE SMALL
SUBUNIT

(Campylobacter
jejuni) 		PF00694
(Aconitase_C) 		5 HIS A   7
LEU A  92
GLY A  96
SER A  71
ALA A  99
 None
 0.95A 6c2mA-3q3wA:
undetectable		 6c2mA-3q3wA:
15.54
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.
3qom 6-PHOSPHO-BETA-GLUCO
SIDASE

(Lactobacillus
plantarum) 		PF00232
(Glyco_hydro_1) 		5 GLY A 229
VAL A 163
LEU A 304
GLY A 307
ALA A 221
 None
 1.02A 6c2mA-3qomA:
undetectable		 6c2mA-3qomA:
8.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT J
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT K
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT N

(Escherichia
coli;
Escherichia
coli;
Escherichia
coli) 		no annotation
no annotation
no annotation 		5 VAL K  60
ILE J 111
GLY N 206
PHE N 172
ALA K  45
 None
 1.10A 6c2mA-3rkoK:
undetectable		 6c2mA-3rkoK:
20.56
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.
3tij NUPC FAMILY PROTEIN

(Vibrio cholerae) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		5 GLY A 137
ILE A 125
LEU A 128
GLY A 131
ALA A 146
 None
None
DMU  A 425 ( 4.5A)
DMU  A 425 ( 4.3A)
None
 1.04A 6c2mA-3tijA:
undetectable		 6c2mA-3tijA:
10.89
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.
3ubm FORMYL-COA:OXALATE
COA-TRANSFERASE

(Acetobacter
aceti) 		PF02515
(CoA_transf_3) 		5 GLY A  48
VAL A  22
GLY A 408
SER A  75
ALA A 404
 None
COA  A2001 ( 4.9A)
None
None
None
 1.08A 6c2mA-3ubmA:
undetectable		 6c2mA-3ubmA:
10.91
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.
3vup BETA-1,4-MANNANASE

(Aplysia kurodai) 		PF00150
(Cellulase) 		5 GLY A 328
ILE A 338
GLY A  20
SER A 321
PHE A 294
 None
 1.02A 6c2mA-3vupA:
undetectable		 6c2mA-3vupA:
11.37
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.
3ze7 PERIPLASMIC [NIFESE]
HYDROGENASE, LARGE
SUBUNIT,
SELENOCYSTEINE-CONTA
INING

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases) 		5 PHE B 417
GLY B 416
ARG B 422
GLY B 249
ALA B 420
 None
None
FCO  B 500 (-4.2A)
None
FCO  B 500 (-3.2A)
 1.11A 6c2mA-3ze7B:
undetectable		 6c2mA-3ze7B:
9.73
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.
4d2j FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Toxoplasma
gondii) 		PF00274
(Glycolytic) 		5 VAL A 305
ARG A 374
ILE A 147
LEU A 101
GLY A  99
 None
SO4  A1418 (-4.1A)
None
None
None
 0.97A 6c2mA-4d2jA:
undetectable		 6c2mA-4d2jA:
12.07
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.
4fx5 VON WILLEBRAND
FACTOR TYPE A

(Catenulispora
acidiphila) 		PF13768
(VWA_3) 		5 GLY A 284
ILE A 179
GLY A 184
PHE A 186
ALA A 188
 None
 0.91A 6c2mA-4fx5A:
undetectable		 6c2mA-4fx5A:
9.91
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.
4gpn 6-PHOSPHO-BETA-D-GLU
COSIDASE

(Streptococcus
mutans) 		PF00232
(Glyco_hydro_1) 		5 GLY A 225
VAL A 159
LEU A 300
GLY A 303
ALA A 217
 None
 0.98A 6c2mA-4gpnA:
undetectable		 6c2mA-4gpnA:
10.68
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.
4h09 HYPOTHETICAL LEUCINE
RICH REPEAT PROTEIN

(Eubacterium
ventriosum) 		PF13306
(LRR_5) 		5 GLY A 185
ILE A 253
GLY A 247
SER A 245
ALA A 266
 None
 0.89A 6c2mA-4h09A:
undetectable		 6c2mA-4h09A:
12.73
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.
4j05 PHOSPHATE
TRANSPORTER

(Serendipita
indica) 		PF00083
(Sugar_tr) 		5 PHE A  50
ILE A 189
LEU A 186
GLY A 184
PHE A 182
 None
 0.97A 6c2mA-4j05A:
undetectable		 6c2mA-4j05A:
10.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ksi LEUCINE
AMINOPEPTIDASE 1,
CHLOROPLASTIC

(Solanum
lycopersicum) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 GLY A 558
ARG A 570
ILE A 384
LEU A 381
GLY A 376
 None
 1.12A 6c2mA-4ksiA:
undetectable		 6c2mA-4ksiA:
9.85
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.
4n14 CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 ILE A 415
LEU A 406
GLY A 455
SER A 452
ALA A 459
 None
 1.12A 6c2mA-4n14A:
undetectable		 6c2mA-4n14A:
14.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		6 ARG A 123
ILE A 132
LEU A 135
GLY A 137
SER A 139
PHE A 154
 None
2R8  A 301 (-4.3A)
2R8  A 301 (-4.4A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
 0.87A 6c2mA-4nwkA:
34.6		 6c2mA-4nwkA:
95.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		11 GLN A  41
PHE A  43
HIS A  57
GLY A  58
VAL A  78
ILE A 132
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 156
 2R8  A 301 ( 3.5A)
2R8  A 301 (-4.6A)
2R8  A 301 (-3.3A)
2R8  A 301 (-3.5A)
None
2R8  A 301 (-4.3A)
2R8  A 301 (-4.4A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.1A)
 0.44A 6c2mA-4nwkA:
34.6		 6c2mA-4nwkA:
95.00
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.
4qdr NEUROPILIN-2

(Homo sapiens) 		PF00754
(F5_F8_type_C) 		5 ARG A 408
ILE A 418
LEU A 420
GLY A 317
ALA A 295
 None
 1.05A 6c2mA-4qdrA:
undetectable		 6c2mA-4qdrA:
13.02
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.
4wk0 INTEGRIN BETA-1

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		5 ILE B 363
LEU B 364
GLY B 392
SER B 379
PHE B 406
 None
 1.10A 6c2mA-4wk0B:
undetectable		 6c2mA-4wk0B:
10.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A 182
ILE A 190
LEU A 191
GLY A 314
ALA A 223
 None
 1.11A 6c2mA-4x0oA:
undetectable		 6c2mA-4x0oA:
13.93
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 ILE A 310
GLY A 412
SER A 414
PHE A 417
ALA A 303
 None
 1.13A 6c2mA-5a8rA:
undetectable		 6c2mA-5a8rA:
8.44
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.
5b0s LIN0857 PROTEIN

(Listeria
innocua) 		PF04041
(Glyco_hydro_130) 		5 GLY A 330
ARG A 113
ILE A 319
GLY A 338
PHE A 120
 None
 1.07A 6c2mA-5b0sA:
undetectable		 6c2mA-5b0sA:
14.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5by3 BTGH115A

(Bacteroides
thetaiotaomicron) 		PF15979
(Glyco_hydro_115) 		5 GLN A 322
GLY A 293
ILE A 288
LEU A 289
ALA A 241
 None
 1.00A 6c2mA-5by3A:
undetectable		 6c2mA-5by3A:
7.71
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.
5by3 BTGH115A

(Bacteroides
thetaiotaomicron) 		PF15979
(Glyco_hydro_115) 		5 GLN A 322
VAL A 297
ILE A 288
LEU A 289
ALA A 241
 None
 1.04A 6c2mA-5by3A:
undetectable		 6c2mA-5by3A:
7.71
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.
5da0 SULPHATE TRANSPORTER

(Deinococcus
geothermalis) 		PF00916
(Sulfate_transp)
PF01740
(STAS) 		5 GLY A 267
ARG A 118
LEU A 240
GLY A 238
ALA A 117
 None
None
DMU  A 601 (-3.9A)
None
None
 1.11A 6c2mA-5da0A:
undetectable		 6c2mA-5da0A:
12.75
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.
5dmx D-ALANINE--D-ALANINE
LIGASE

(Acinetobacter
baumannii) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		5 GLY A  97
ARG A 241
ILE A 186
GLY A 252
ALA A 242
 None
 1.05A 6c2mA-5dmxA:
undetectable		 6c2mA-5dmxA:
13.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dzv PROTEIN PCDHA7

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		5 GLY A 127
VAL A 160
LEU A 193
GLY A 195
ALA A 137
 None
 1.13A 6c2mA-5dzvA:
undetectable		 6c2mA-5dzvA:
10.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eqq NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		11 GLN A1041
PHE A1043
HIS A1057
GLY A1058
VAL A1078
ARG A1123
ILE A1132
LEU A1135
GLY A1137
PHE A1154
ALA A1156
 5RS  A1203 (-2.9A)
5RS  A1203 (-4.3A)
5RS  A1203 (-2.5A)
5RS  A1203 ( 2.9A)
5RS  A1203 (-3.9A)
5RS  A1203 ( 3.3A)
5RS  A1203 ( 4.1A)
5RS  A1203 (-4.2A)
5RS  A1203 (-3.2A)
5RS  A1203 (-3.3A)
5RS  A1203 (-2.9A)
 0.35A 6c2mA-5eqqA:
35.6		 6c2mA-5eqqA:
98.63
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.
5fav CHOLINE
TRIMETHYLAMINE-LYASE

(Desulfovibrio
alaskensis) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 GLN A 793
GLY A 821
LEU A 723
GLY A 726
SER A 699
 None
 1.07A 6c2mA-5favA:
undetectable		 6c2mA-5favA:
7.54
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.
5ffq SHUY-LIKE PROTEIN

(Escherichia
coli) 		PF13460
(NAD_binding_10) 		5 PHE A   7
HIS A  86
ARG A 149
GLY A   8
SER A  75
 None
 1.12A 6c2mA-5ffqA:
undetectable		 6c2mA-5ffqA:
18.99
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.
5h8w ATP-DEPENDENT DNA
HELICASE TA0057

(Thermoplasma
acidophilum) 		PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2) 		5 GLN A  66
GLY A 509
ILE A 209
LEU A  57
ALA A 213
 None
 1.04A 6c2mA-5h8wA:
undetectable		 6c2mA-5h8wA:
8.38
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.
5i32 AQUAPORIN TIP2-1

(Arabidopsis
thaliana) 		PF00230
(MIP) 		5 GLY A 194
VAL A 143
ILE A 177
GLY A 182
ALA A 152
 None
 1.09A 6c2mA-5i32A:
undetectable		 6c2mA-5i32A:
17.39
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.
5i5d INNER MEMBRANE
PROTEIN YEJM

(Salmonella
enterica) 		PF00884
(Sulfatase)
PF11893
(DUF3413) 		5 GLY A 312
VAL A 321
ILE A 538
SER A 298
ALA A 531
 None
 1.13A 6c2mA-5i5dA:
undetectable		 6c2mA-5i5dA:
10.33
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.
5iof SULPHATE TRANSPORTER

(Deinococcus
geothermalis) 		PF00916
(Sulfate_transp) 		5 GLY A 267
ARG A 118
LEU A 240
GLY A 238
ALA A 117
 None
 1.11A 6c2mA-5iofA:
undetectable		 6c2mA-5iofA:
12.82
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.
5k0y 40S RIBOSOMAL
PROTEIN S21

(Oryctolagus
cuniculus) 		no annotation 5 GLY b  25
VAL b  13
GLY b  57
SER b  31
ALA b  54
 None
 0.97A 6c2mA-5k0yb:
undetectable		 6c2mA-5k0yb:
18.39
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.
5mif 'CARBOXYL ESTERASE 2

(Tuber
melanosporum) 		PF07859
(Abhydrolase_3) 		5 HIS A 317
GLY A 318
VAL A 286
ARG A 245
GLY A 118
 None
 1.12A 6c2mA-5mifA:
undetectable		 6c2mA-5mifA:
13.20
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.
5nfh METHIONYL-TRNA
SYNTHETASE, PUTATIVE

(Trypanosoma
brucei) 		no annotation 5 GLY A 611
VAL A 723
ILE A 599
GLY A 604
ALA A 576
 None
 1.11A 6c2mA-5nfhA:
undetectable		 6c2mA-5nfhA:
8.65
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.
5swu PENTAFUNCTIONAL AROM
POLYPEPTIDE

(Aspergillus
fumigatus) 		PF01487
(DHquinase_I) 		5 PHE A1255
ILE A1288
GLY A1254
SER A1052
PHE A1053
 None
 1.00A 6c2mA-5swuA:
undetectable		 6c2mA-5swuA:
16.13
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.
5t5i TUNGSTEN-CONTAINING
FORMYLMETHANOFURAN
DEHYDROGENASE 2
SUBUNIT C

(Methanothermobacter
wolfeii) 		PF01493
(GXGXG) 		5 GLY C 118
VAL C  94
ILE C 192
GLY C 163
ALA C 158
 None
 1.13A 6c2mA-5t5iC:
undetectable		 6c2mA-5t5iC:
14.07
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.
5t98 GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 PHE A 581
GLY A 619
VAL A 790
GLY A 613
ALA A 795
 None
 1.08A 6c2mA-5t98A:
undetectable		 6c2mA-5t98A:
6.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w3f TUBULIN ALPHA-1
CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 GLY A 145
VAL A 189
ILE A  16
GLY A  10
ALA A 171
 GTP  A 502 (-4.6A)
None
None
GTP  A 502 (-3.6A)
None
 1.12A 6c2mA-5w3fA:
undetectable		 6c2mA-5w3fA:
11.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 9 GLN A  41
PHE A  43
ARG A 123
ILE A 132
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.69A 6c2mA-5wdxA:
27.2		 6c2mA-5wdxA:
37.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 10 PHE A  43
HIS A  57
GLY A  58
ARG A 123
ILE A 132
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.47A 6c2mA-5wdxA:
27.2		 6c2mA-5wdxA:
37.01
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.
5xeo CYSTEINE SYNTHASE

(Fusobacterium
nucleatum) 		no annotation 5 GLY A 174
ARG A  39
ILE A 261
GLY A 268
SER A 266
 None
None
None
None
PLP  A 401 (-2.5A)
 1.13A 6c2mA-5xeoA:
undetectable		 6c2mA-5xeoA:
27.17
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.
5y4m -

(-) 		no annotation 5 GLY A  56
ARG A 160
ILE A 172
LEU A 174
GLY A  73
 None
EDO  A 203 (-3.1A)
None
None
None
 1.00A 6c2mA-5y4mA:
undetectable		 6c2mA-5y4mA:
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.
5yay KN MOTIF AND ANKYRIN
REPEAT DOMAINS 1
KINESIN-LIKE PROTEIN
KIF21A

(Mus musculus;
Mus musculus) 		no annotation
no annotation 		5 GLN A1200
GLY A1204
ARG B1156
ILE A1270
LEU A1246
 None
 1.13A 6c2mA-5yayA:
undetectable		 6c2mA-5yayA:
24.66
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.
6aun PLA2G6, IPLA2BETA

(Cricetulus
griseus) 		no annotation 5 GLY A 468
LEU A 597
GLY A 532
SER A 583
ALA A 586
 None
 1.05A 6c2mA-6aunA:
undetectable		 6c2mA-6aunA:
18.39
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.
6b4e NUCLEOPORIN GLE1

(Saccharomyces
cerevisiae) 		no annotation 5 PHE B 381
LEU B 449
GLY B 384
PHE B 425
ALA B 426
 None
 1.13A 6c2mA-6b4eB:
undetectable		 6c2mA-6b4eB:
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.
6dbr -

(-) 		no annotation 5 PHE B 206
GLY B 139
ILE B 234
GLY B 221
ALA B 209
 None
 0.97A 6c2mA-6dbrB:
undetectable		 6c2mA-6dbrB:
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 3

(Homo sapiens) 		no annotation 5 GLN A  28
HIS A  19
GLY A  20
VAL A  32
ALA A 291
 None
 1.07A 6c2mA-6en4A:
undetectable		 6c2mA-6en4A:
26.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fm9 UDP-N-ACETYLGLUCOSAM
INE--DOLICHYL-PHOSPH
ATE
N-ACETYLGLUCOSAMINEP
HOSPHOTRANSFERASE

(Homo sapiens) 		no annotation 5 VAL A  60
ILE A  74
LEU A  98
GLY A 100
PHE A 227
 None
 1.11A 6c2mA-6fm9A:
undetectable		 6c2mA-6fm9A:
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.
1a87 COLICIN N

(Escherichia
coli) 		PF01024
(Colicin) 		5 ASP A 102
ARG A 108
ALA A 125
SER A 127
ASP A 124
 None
 1.14A 6c2mA-1a87A:
0.0		 6c2mA-1a87A:
10.90
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.
1aif ANTI-IDIOTYPIC FAB
409.5.3 (IGG2A) FAB
(HEAVY CHAIN)

(Mus musculus) 		no annotation 5 ARG H  38
ALA H  90
VAL H 119
SER H 120
ASP H  92
 None
 1.40A 6c2mA-1aifH:
undetectable		 6c2mA-1aifH:
18.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		6 VAL A  55
ASP A  81
LYS A 136
ALA A 157
VAL A 158
ASP A 168
 None
 0.71A 6c2mA-1cu1A:
34.7		 6c2mA-1cu1A:
47.97
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.
1fgv H52 FV (HEAVY CHAIN)

(Homo sapiens) 		PF07686
(V-set) 		5 ARG H  38
ALA H  88
VAL H 122
SER H 123
ASP H  90
 ARG  H  38 ( 0.7A)
ALA  H  88 ( 0.0A)
VAL  H 122 ( 0.6A)
SER  H 123 ( 0.0A)
ASP  H  90 ( 0.6A)
 1.43A 6c2mA-1fgvH:
undetectable		 6c2mA-1fgvH:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fr9 MOLYBDOPTERIN-GUANIN
E DINUCLEOTIDE
BIOSYNTHESIS PROTEIN

(Escherichia
coli) 		PF12804
(NTP_transf_3) 		5 VAL A 169
HIS A 126
ARG A 112
ALA A 110
ASP A 108
 None
 1.11A 6c2mA-1fr9A:
0.0		 6c2mA-1fr9A:
17.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 VAL A  55
ASP A  81
ALA A 157
VAL A 158
ASP A 168
 None
 0.74A 6c2mA-1ns3A:
30.5		 6c2mA-1ns3A:
39.37
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.
1ohq IMMUNOGLOBULIN

(Homo sapiens) 		PF07686
(V-set) 		5 ARG A  38
ALA A  88
VAL A 118
SER A 119
ASP A  90
 None
 1.41A 6c2mA-1ohqA:
undetectable		 6c2mA-1ohqA:
18.33
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.
1qb4 PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Escherichia
coli) 		PF00311
(PEPcase) 		5 VAL A 672
ARG A 669
ALA A 545
SER A 554
ASP A 547
 None
 1.49A 6c2mA-1qb4A:
0.0		 6c2mA-1qb4A:
6.59
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.
2c7z 3-KETOACYL-COA
THIOLASE 2

(Arabidopsis
thaliana) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ARG A 211
ALA A 217
VAL A 219
SER A 221
ASP A 215
 None
 1.29A 6c2mA-2c7zA:
0.0		 6c2mA-2c7zA:
12.47
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.
2eyq TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02559
(CarD_CdnL_TRCF)
PF03461
(TRCF) 		5 VAL A 197
ARG A 783
ALA A 785
VAL A 786
ASP A 938
 None
None
None
None
EPE  A1151 (-3.5A)
 1.24A 6c2mA-2eyqA:
undetectable		 6c2mA-2eyqA:
5.65
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.
2mcp IGA-KAPPA MCPC603
FAB (HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ARG H  38
ALA H  90
VAL H 120
SER H 121
ASP H  92
 None
 1.35A 6c2mA-2mcpH:
undetectable		 6c2mA-2mcpH:
19.02
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.
2pa5 TYROSINE-PROTEIN
PHOSPHATASE
NON-RECEPTOR TYPE 9

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 HIS A 450
ARG A 458
ALA A 494
VAL A 495
SER A 496
 None
 1.22A 6c2mA-2pa5A:
undetectable		 6c2mA-2pa5A:
14.01
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.
2yjt ATP-DEPENDENT RNA
HELICASE SRMB

(Escherichia
coli) 		PF00271
(Helicase_C) 		5 VAL D 320
ARG D 335
ALA D 309
VAL D 307
ASP D 306
 None
 1.39A 6c2mA-2yjtD:
undetectable		 6c2mA-2yjtD:
16.57
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.
2zws NEUTRAL CERAMIDASE

(Pseudomonas
aeruginosa) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		5 HIS A  37
ARG A  39
ALA A  12
SER A 133
ASP A  13
 GOL  A 659 ( 4.5A)
None
None
None
None
 1.41A 6c2mA-2zwsA:
undetectable		 6c2mA-2zwsA:
9.92
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.
3b9v HEAVY CHAIN VARIABLE
DOMAIN

(Homo sapiens) 		PF07686
(V-set) 		5 ARG A  38
ALA A  84
VAL A 111
SER A 112
ASP A  86
 None
 1.46A 6c2mA-3b9vA:
undetectable		 6c2mA-3b9vA:
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.
3d3u 4-HYDROXYBUTYRATE
COA-TRANSFERASE

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 VAL A 180
ALA A  17
VAL A  19
SER A  21
ASP A  15
 None
 1.43A 6c2mA-3d3uA:
undetectable		 6c2mA-3d3uA:
9.52
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.
3ehm SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		5 VAL A 213
HIS A 214
ARG A 212
VAL A 137
ASP A 136
 None
 1.45A 6c2mA-3ehmA:
undetectable		 6c2mA-3ehmA:
8.99
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.
3fn4 NAD-DEPENDENT
FORMATE
DEHYDROGENASE

(Moraxella sp.) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 VAL A 194
HIS A 218
ALA A 151
VAL A 150
SER A 147
 None
None
None
GOL  A 402 (-4.8A)
SO4  A 403 ( 4.5A)
 1.45A 6c2mA-3fn4A:
undetectable		 6c2mA-3fn4A:
12.18
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.
3iy5 ANTIBODY FRAGMENT
IGG2A (HEAVY CHAIN)

(Mus musculus) 		PF07686
(V-set) 		5 ARG B 146
ALA B 198
VAL B 227
SER B 228
ASP B 200
 None
 1.40A 6c2mA-3iy5B:
undetectable		 6c2mA-3iy5B:
22.41
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.
3p9w HUMAN VEGF

(Homo sapiens) 		PF07686
(V-set) 		5 ARG B  38
ALA B  84
VAL B 111
SER B 112
ASP B  86
 ARG  B  38 ( 0.6A)
ALA  B  84 ( 0.0A)
VAL  B 111 ( 0.6A)
SER  B 112 ( 0.0A)
ASP  B  86 ( 0.5A)
 1.47A 6c2mA-3p9wB:
undetectable		 6c2mA-3p9wB:
23.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qyc VH DOMAIN OF IGG
MOLECULE

(Homo sapiens) 		PF07686
(V-set) 		5 ARG A  40
ALA A  90
VAL A 125
SER A 126
ASP A  92
 None
 1.48A 6c2mA-3qycA:
undetectable		 6c2mA-3qycA:
20.27
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.
4c4o CARBONYL REDUCTASE
CPCR2

(Candida
parapsilosis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A 333
ASP A 147
ALA A  88
VAL A  87
SER A 138
 None
 1.35A 6c2mA-4c4oA:
undetectable		 6c2mA-4c4oA:
12.30
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.
4ifd EXOSOME COMPLEX
COMPONENT RRP43

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH) 		5 ARG C 391
ALA C 385
VAL C 383
SER C 381
ASP C 387
 None
 1.46A 6c2mA-4ifdC:
undetectable		 6c2mA-4ifdC:
11.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kc5 RHIE PROTEIN

(Paraburkholderia
rhizoxinica) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 VAL A3940
HIS A3905
ALA A3714
VAL A3713
ASP A3712
 None
 1.37A 6c2mA-4kc5A:
undetectable		 6c2mA-4kc5A:
7.48
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.
4krf PROTEIN ARGONAUTE-1

(Homo sapiens) 		PF02170
(PAZ)
PF02171
(Piwi)
PF08699
(ArgoL1)
PF16486
(ArgoN)
PF16487
(ArgoMid)
PF16488
(ArgoL2) 		5 ARG A 165
ALA A 159
VAL A 157
SER A 156
ASP A 161
 None
 1.44A 6c2mA-4krfA:
undetectable		 6c2mA-4krfA:
7.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		7 VAL A  55
ASP A  81
LYS A 136
ARG A 155
ALA A 157
VAL A 158
ASP A 168
 None
2R8  A 301 (-3.6A)
GOL  A 310 ( 2.6A)
2R8  A 301 (-3.6A)
2R8  A 301 (-3.8A)
2R8  A 301 ( 4.4A)
2R8  A 301 ( 4.5A)
 0.32A 6c2mA-4nwkA:
34.6		 6c2mA-4nwkA:
95.00
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.
4od1 CAP256-VRC26.03
HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ARG H  38
ALA H  84
VAL H 111
SER H 112
ASP H  86
 None
 1.40A 6c2mA-4od1H:
undetectable		 6c2mA-4od1H:
14.58
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.
4yzk TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Streptomyces
blastmyceticus) 		PF11991
(Trp_DMAT) 		5 HIS A 364
ASP A 327
LYS A  54
ALA A 354
ASP A 353
 None
 1.43A 6c2mA-4yzkA:
undetectable		 6c2mA-4yzkA:
13.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eqq NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		6 VAL A1055
ASP A1081
ARG A1155
ALA A1157
VAL A1158
ASP A1168
 None
5RS  A1203 (-3.5A)
5RS  A1203 (-4.8A)
5RS  A1203 (-3.5A)
5RS  A1203 ( 3.6A)
5RS  A1203 ( 4.0A)
 0.25A 6c2mA-5eqqA:
35.6		 6c2mA-5eqqA:
98.63
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.
5gs2 ANTI-MBP

(Homo sapiens) 		PF07686
(V-set) 		5 ARG H  38
ALA H  88
VAL H 125
SER H 126
ASP H  90
 None
 1.48A 6c2mA-5gs2H:
undetectable		 6c2mA-5gs2H:
16.17
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.
5nnl INACTIVE
DIHYDROOROTASE-LIKE
DOMAIN

(Chaetomium
thermophilum) 		no annotation 5 VAL A1588
ARG A1586
ALA A1580
VAL A1579
SER A1576
 None
 1.45A 6c2mA-5nnlA:
undetectable		 6c2mA-5nnlA:
11.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5sy5 ARYL HYDROCARBON
RECEPTOR NUCLEAR
TRANSLOCATOR

(Mus musculus) 		PF00010
(HLH)
PF00989
(PAS)
PF14598
(PAS_11) 		5 VAL A 304
HIS A 302
ARG A 266
VAL A 218
ASP A 217
 None
 1.37A 6c2mA-5sy5A:
undetectable		 6c2mA-5sy5A:
13.84
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.
5tqi PYRIDOXAL KINASE
PDXY

(Burkholderia
multivorans) 		PF08543
(Phos_pyr_kin) 		5 VAL A 248
HIS A 249
ALA A 240
VAL A 237
SER A 236
 None
 1.23A 6c2mA-5tqiA:
undetectable		 6c2mA-5tqiA:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vrv PROTEIN REGULATED BY
ACID PH

(Agrobacterium
fabrum) 		PF09924
(DUF2156) 		5 VAL A 839
ARG A 616
ALA A 852
VAL A 854
ASP A 851
 None
 1.24A 6c2mA-5vrvA:
undetectable		 6c2mA-5vrvA:
12.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 5 VAL A  55
ASP A  81
ALA A 157
VAL A 158
ASP A 168
 None
 0.42A 6c2mA-5wdxA:
27.2		 6c2mA-5wdxA:
37.01
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.
5whm ICLR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Brucella
abortus) 		PF01614
(IclR)
PF09339
(HTH_IclR) 		5 VAL A 247
HIS A 242
ALA A 237
VAL A 236
SER A 235
 None
None
None
None
ACY  A 301 (-3.4A)
 1.41A 6c2mA-5whmA:
undetectable		 6c2mA-5whmA:
14.79