SIMILAR PATTERNS OF AMINO ACIDS FOR 6C2M_B_SUEB1202

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.
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
 0.91A 6c2mB-1bxzA:
0.1		 6c2mB-1bxzA:
14.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		5 PHE L 420
GLY L 419
ARG L 425
GLY L 252
ALA L 423
 None
None
FCO  L 499 (-4.1A)
None
FCO  L 499 (-3.1A)
 1.15A 6c2mB-1cc1L:
0.0		 6c2mB-1cc1L:
11.76
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 GLN A  41
HIS A  57
VAL A 524
LYS A 136
GLY A 137
PHE A 154
 None
 1.45A 6c2mB-1cu1A:
34.9		 6c2mB-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
ARG A 123
LYS A 136
GLY A 137
PHE A 154
ALA A 156
 None
 0.73A 6c2mB-1cu1A:
34.9		 6c2mB-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
LYS A 136
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.81A 6c2mB-1cu1A:
34.9		 6c2mB-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.
1cyd CARBONYL REDUCTASE

(Mus musculus) 		PF13561
(adh_short_C2) 		5 GLY A 168
VAL A 127
ARG A 226
SER A 231
ALA A 228
 None
 1.21A 6c2mB-1cydA:
0.0		 6c2mB-1cydA:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1efp PROTEIN (ELECTRON
TRANSFER
FLAVOPROTEIN)

(Paracoccus
denitrificans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 240
HIS A 264
GLY A 242
GLY A 224
ALA A 255
 FAD  A 399 (-3.9A)
FAD  A 399 (-3.9A)
FAD  A 399 (-3.1A)
None
None
 1.15A 6c2mB-1efpA:
0.0		 6c2mB-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.
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
 1.13A 6c2mB-1efpA:
0.0		 6c2mB-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 6c2mB-1efvA:
undetectable		 6c2mB-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.
1g61 TRANSLATION
INITIATION FACTOR 6

(Methanocaldococcus
jannaschii) 		PF01912
(eIF-6) 		5 GLY A2197
VAL A2064
ILE A2005
GLY A2210
PHE A2009
 None
 1.17A 6c2mB-1g61A:
0.0		 6c2mB-1g61A:
15.79
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
 0.99A 6c2mB-1ns3A:
18.2		 6c2mB-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) 		9 GLN A  41
PHE A  43
HIS A  57
GLY A  58
VAL A  78
ARG A 123
GLY A 137
PHE A 154
ALA A 156
 None
 0.81A 6c2mB-1ns3A:
18.2		 6c2mB-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
 0.93A 6c2mB-1p9hA:
undetectable		 6c2mB-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.
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
 1.05A 6c2mB-1q6yA:
undetectable		 6c2mB-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.
1qy9 HYPOTHETICAL PROTEIN
YDDE

(Escherichia
coli) 		PF02567
(PhzC-PhzF) 		5 GLY A 256
VAL A 220
ILE A 281
GLY A 253
ALA A 228
 None
 1.21A 6c2mB-1qy9A:
undetectable		 6c2mB-1qy9A:
13.59
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.
1rhc F420-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Methanoculleus
thermophilus) 		PF00296
(Bac_luciferase) 		5 GLN A 126
GLY A 179
VAL A 203
GLY A 105
SER A 173
 F42  A 351 (-3.6A)
F42  A 351 (-3.7A)
None
F42  A 351 ( 4.0A)
F42  A 351 (-2.5A)
 0.98A 6c2mB-1rhcA:
undetectable		 6c2mB-1rhcA:
13.33
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.
1uus STAT PROTEIN

(Dictyostelium
discoideum) 		PF00017
(SH2)
PF09267
(Dict-STAT-coil) 		5 PHE A 457
ILE A 461
GLY A 458
SER A 473
ALA A 363
 None
 1.11A 6c2mB-1uusA:
undetectable		 6c2mB-1uusA:
11.66
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.
1vgq FORMYL-COENZYME A
TRANSFERASE

(Oxalobacter
formigenes) 		PF02515
(CoA_transf_3) 		5 GLY A  42
VAL A  16
GLY A 402
SER A  69
ALA A 398
 None
CAO  A 429 (-4.1A)
None
None
None
 1.11A 6c2mB-1vgqA:
undetectable		 6c2mB-1vgqA:
14.13
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.
1vgq FORMYL-COENZYME A
TRANSFERASE

(Oxalobacter
formigenes) 		PF02515
(CoA_transf_3) 		5 GLY A  42
VAL A  16
ILE A 375
SER A  69
ALA A 398
 None
CAO  A 429 (-4.1A)
None
None
None
 1.04A 6c2mB-1vgqA:
undetectable		 6c2mB-1vgqA:
14.13
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.
1wdw TRYPTOPHAN SYNTHASE
BETA CHAIN 1

(Pyrococcus
furiosus) 		PF00291
(PALP) 		5 GLN B 109
GLY B 298
ILE B 341
GLY B 372
ALA B 347
 PLP  B 400 (-3.4A)
PLP  B 400 (-3.8A)
None
PLP  B 400 (-3.4A)
None
 1.08A 6c2mB-1wdwB:
undetectable		 6c2mB-1wdwB:
10.08
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.
1xmx HYPOTHETICAL PROTEIN
VC1899

(Vibrio cholerae) 		PF09002
(DUF1887) 		5 PHE A 149
GLY A 331
VAL A 298
GLY A 150
ALA A 143
 None
 0.95A 6c2mB-1xmxA:
undetectable		 6c2mB-1xmxA:
10.65
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.
1z0v PUTATIVE PROTEASE LA
HOMOLOG TYPE

(Archaeoglobus
fulgidus) 		PF05362
(Lon_C) 		5 GLY A 431
VAL A 499
ILE A 592
GLY A 535
SER A 511
 None
 1.20A 6c2mB-1z0vA:
undetectable		 6c2mB-1z0vA:
18.04
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.
1zpu IRON TRANSPORT
MULTICOPPER OXIDASE
FET3

(Saccharomyces
cerevisiae) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLN A 511
GLY A  89
ILE A 394
GLY A 504
ALA A 474
 None
 1.21A 6c2mB-1zpuA:
undetectable		 6c2mB-1zpuA:
9.94
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.
2bjr MFP2B

(Ascaris suum) 		PF12150
(MFP2b) 		5 PHE A 255
GLY A 242
VAL A 303
GLY A 338
ALA A 335
 None
 1.10A 6c2mB-2bjrA:
undetectable		 6c2mB-2bjrA:
12.23
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.
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
 1.06A 6c2mB-2gvkA:
undetectable		 6c2mB-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.
2naf PEPTIDYL-TRNA
HYDROLASE

(Mycolicibacterium
smegmatis) 		PF01195
(Pept_tRNA_hydro) 		5 HIS A  94
GLY A 114
VAL A 137
ILE A  90
GLY A 110
 None
 1.18A 6c2mB-2nafA:
undetectable		 6c2mB-2nafA:
18.97
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.
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
 1.17A 6c2mB-2pajA:
undetectable		 6c2mB-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
 1.13A 6c2mB-2proA:
undetectable		 6c2mB-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
 1.09A 6c2mB-2qfeA:
undetectable		 6c2mB-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.
2qqp LARGE CAPSID PROTEIN

(Providence
virus) 		PF03566
(Peptidase_A21) 		6 GLY A 233
VAL A 230
ILE A 205
SER A 149
PHE A 150
ALA A 152
 None
 1.43A 6c2mB-2qqpA:
undetectable		 6c2mB-2qqpA:
13.41
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.
2rf7 CYTOCHROME C-552

(Escherichia
coli) 		PF02335
(Cytochrom_C552) 		5 GLN A  62
HIS A  94
GLY A  93
VAL A  98
ILE A 283
 HEC  A   3 (-3.8A)
HEC  A   3 (-3.3A)
HEC  A   3 (-3.9A)
None
HEC  A   2 (-4.3A)
 1.09A 6c2mB-2rf7A:
undetectable		 6c2mB-2rf7A:
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.
2uuu ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE

(Dictyostelium
discoideum) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 PHE A 104
ARG A 187
ILE A 192
PHE A  97
ALA A 160
 None
 1.13A 6c2mB-2uuuA:
undetectable		 6c2mB-2uuuA:
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.
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
 1.04A 6c2mB-2vfvA:
undetectable		 6c2mB-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.
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
 1.07A 6c2mB-2x2iA:
undetectable		 6c2mB-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.
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
 0.97A 6c2mB-2y0kA:
undetectable		 6c2mB-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.
2z0f PUTATIVE
PHOSPHOGLUCOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 GLY A  63
ILE A 157
GLY A 124
PHE A  86
ALA A  53
 None
 1.07A 6c2mB-2z0fA:
undetectable		 6c2mB-2z0fA:
7.65
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.
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
 1.27A 6c2mB-2zsgA:
undetectable		 6c2mB-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.
3bw2 2-NITROPROPANE
DIOXYGENASE

(Streptomyces
ansochromogenes) 		PF03060
(NMO) 		5 GLN A 180
GLY A 181
VAL A 132
ILE A 217
GLY A 177
 None
None
None
None
FMN  A 370 (-3.7A)
 1.17A 6c2mB-3bw2A:
undetectable		 6c2mB-3bw2A:
14.11
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.
3cpr DIHYDRODIPICOLINATE
SYNTHETASE

(Corynebacterium
glutamicum) 		PF00701
(DHDPS) 		5 GLY A  91
VAL A 101
ILE A  34
GLY A  61
SER A  63
 None
 1.19A 6c2mB-3cprA:
undetectable		 6c2mB-3cprA:
14.47
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.
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
 1.08A 6c2mB-3fplA:
undetectable		 6c2mB-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
 0.98A 6c2mB-3g4eA:
undetectable		 6c2mB-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.
3h9j MCCB PROTEIN

(Escherichia
coli) 		PF00899
(ThiF) 		5 GLN A 110
GLY A 138
VAL A 132
GLY A 311
ALA A 304
 None
 1.15A 6c2mB-3h9jA:
undetectable		 6c2mB-3h9jA:
12.22
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.
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)
 1.16A 6c2mB-3ip1A:
undetectable		 6c2mB-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.
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
 1.11A 6c2mB-3k7tA:
undetectable		 6c2mB-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.
3kkz UNCHARACTERIZED
PROTEIN Q5LES9

(Bacteroides
fragilis) 		PF13649
(Methyltransf_25) 		5 GLY A  29
ILE A  53
GLY A 122
SER A 149
ALA A 147
 None
None
SAM  A 301 (-4.8A)
None
None
 1.08A 6c2mB-3kkzA:
undetectable		 6c2mB-3kkzA:
14.73
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.
3m6m RPFF PROTEIN

(Xanthomonas
campestris) 		PF00378
(ECH_1) 		5 GLN A  56
GLY A 113
ILE A 128
SER A 145
ALA A 143
 None
 1.18A 6c2mB-3m6mA:
undetectable		 6c2mB-3m6mA:
12.79
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.
3men ACETYLPOLYAMINE
AMINOHYDROLASE

(Burkholderia
pseudomallei) 		PF00850
(Hist_deacetyl) 		5 GLY A 297
ILE A 314
GLY A 335
SER A 331
ALA A 329
 None
 1.20A 6c2mB-3menA:
undetectable		 6c2mB-3menA:
10.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.13A 6c2mB-3rkoK:
undetectable		 6c2mB-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.
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
 1.03A 6c2mB-3ubmA:
undetectable		 6c2mB-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.
3upn PENICILLIN-BINDING
PROTEIN A

(Mycobacterium
tuberculosis) 		PF00905
(Transpeptidase) 		5 GLN A 143
VAL A 318
ILE A 483
GLY A 146
ALA A 457
 None
 1.20A 6c2mB-3upnA:
undetectable		 6c2mB-3upnA:
9.96
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.
3uxj NADPH-DEPENDENT
7-CYANO-7-DEAZAGUANI
NE REDUCTASE

(Vibrio cholerae) 		PF14489
(QueF)
PF14819
(QueF_N) 		5 GLN A 251
ILE A 244
GLY A 211
SER A 182
ALA A 208
 None
None
None
None
EDO  A 292 (-4.0A)
 1.22A 6c2mB-3uxjA:
undetectable		 6c2mB-3uxjA:
15.79
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.
3wq4 BETA-PRIMEVEROSIDASE

(Camellia
sinensis) 		PF00232
(Glyco_hydro_1) 		5 PHE A 439
GLY A 418
VAL A 273
PHE A 390
ALA A 388
 None
 1.22A 6c2mB-3wq4A:
undetectable		 6c2mB-3wq4A:
10.00
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.
3zs3 THAUMATIN-LIKE
PROTEIN

(Malus domestica) 		PF00314
(Thaumatin) 		5 GLN A  25
GLY A  81
VAL A  85
ILE A   3
PHE A  31
 None
 1.14A 6c2mB-3zs3A:
undetectable		 6c2mB-3zs3A:
14.03
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.
4cvu BETA-MANNOSIDASE

(Trichoderma
harzianum) 		PF00703
(Glyco_hydro_2) 		5 PHE A 156
GLY A 210
ARG A  80
ILE A 163
GLY A 157
 None
None
None
None
NAG  A1947 (-3.2A)
 1.20A 6c2mB-4cvuA:
undetectable		 6c2mB-4cvuA:
6.26
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.
4dwq TRNA-SPLICING LIGASE
RTCB

(Pyrococcus
horikoshii) 		PF01139
(RtcB) 		5 GLN A 194
GLY A 191
ILE A 299
GLY A 135
ALA A 294
 PO4  A 506 (-3.6A)
None
None
None
None
 1.17A 6c2mB-4dwqA:
undetectable		 6c2mB-4dwqA:
11.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eb5 PROBABLE CYSTEINE
DESULFURASE 2

(Archaeoglobus
fulgidus) 		PF00266
(Aminotran_5) 		5 GLY A 189
VAL A 142
ARG A  83
GLY A  60
ALA A 215
 None
 1.21A 6c2mB-4eb5A:
undetectable		 6c2mB-4eb5A:
13.40
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.
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
 0.89A 6c2mB-4fx5A:
undetectable		 6c2mB-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.
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
 0.88A 6c2mB-4h09A:
undetectable		 6c2mB-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.
4kpu ELECTRON TRANSFER
FLAVOPROTEIN ALPHA
SUBUNIT

(Acidaminococcus
fermentans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 GLN A 266
HIS A 290
GLY A 268
GLY A 250
ALA A 281
 FAD  A 401 (-4.1A)
FAD  A 401 (-3.9A)
FAD  A 401 (-3.3A)
None
None
 1.11A 6c2mB-4kpuA:
undetectable		 6c2mB-4kpuA:
14.33
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.
4nn0 COMPLEMENT C1Q TUMOR
NECROSIS
FACTOR-RELATED
PROTEIN 5

(Homo sapiens) 		PF00386
(C1q) 		5 PHE A 153
GLY A 229
VAL A 128
GLY A 194
PHE A 166
 None
 1.20A 6c2mB-4nn0A:
undetectable		 6c2mB-4nn0A:
17.45
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
LYS A 136
GLY A 137
SER A 139
PHE A 154
ALA A 157
 None
GOL  A 310 ( 2.6A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.8A)
 1.50A 6c2mB-4nwkA:
35.5		 6c2mB-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
LYS A 136
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)
GOL  A 310 ( 2.6A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.1A)
 0.56A 6c2mB-4nwkA:
35.5		 6c2mB-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) 		7 PHE A  43
ARG A 123
ILE A 132
LYS A 136
GLY A 137
SER A 139
PHE A 154
 2R8  A 301 (-4.6A)
None
2R8  A 301 (-4.3A)
GOL  A 310 ( 2.6A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
 0.79A 6c2mB-4nwkA:
35.5		 6c2mB-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.
4o48 UNCHARACTERIZED
PROTEIN

(Cavia porcellus) 		PF01112
(Asparaginase_2) 		5 GLY A 222
VAL A 190
ILE A 267
GLY A 206
SER A 200
 ASP  A 402 (-3.3A)
None
None
None
ASP  A 402 ( 4.2A)
 1.16A 6c2mB-4o48A:
undetectable		 6c2mB-4o48A:
13.29
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.
4qax 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Staphylococcus
aureus) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 PHE A 149
VAL A 144
GLY A 184
PHE A 236
ALA A 216
 None
 1.20A 6c2mB-4qaxA:
undetectable		 6c2mB-4qaxA:
10.55
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.
4wmj GLUCOSE-6-PHOSPHATE
ISOMERASE

(Colias
eurytheme) 		PF00342
(PGI) 		5 ARG A 108
ILE A  47
GLY A  53
PHE A 488
ALA A 492
 None
 1.21A 6c2mB-4wmjA:
undetectable		 6c2mB-4wmjA:
8.79
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.
4xq6 DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Mycobacterium
tuberculosis) 		PF01180
(DHO_dh) 		5 GLY A 141
VAL A 209
ILE A 129
GLY A  72
ALA A 124
 None
 1.16A 6c2mB-4xq6A:
undetectable		 6c2mB-4xq6A:
11.92
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.
4y82 PROTEASOME SUBUNIT
BETA TYPE-7

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		5 PHE M 146
ILE M 177
GLY M 147
SER M  10
ALA M  24
 None
 1.21A 6c2mB-4y82M:
undetectable		 6c2mB-4y82M:
15.57
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.
4ydi ENVELOPE
GLYCOPROTEIN GP160

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		5 PHE G 233
GLY G 235
VAL G 101
ILE G 270
GLY G 232
 None
 1.12A 6c2mB-4ydiG:
undetectable		 6c2mB-4ydiG:
12.10
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.
4ztx COBALAMIN-INDEPENDEN
T METHIONINE
SYNTHASE

(Neurospora
crassa) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 HIS A 268
GLY A 294
ILE A 334
GLY A 298
PHE A 248
 None
 1.17A 6c2mB-4ztxA:
undetectable		 6c2mB-4ztxA:
7.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zv7 LIPASE B

(Moesziomyces
antarcticus) 		no annotation 5 GLY A 107
VAL A 190
GLY A  44
SER A  47
ALA A 281
 None
 1.22A 6c2mB-4zv7A:
undetectable		 6c2mB-4zv7A:
11.67
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.
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
 1.11A 6c2mB-5a8rA:
undetectable		 6c2mB-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
 0.97A 6c2mB-5b0sA:
undetectable		 6c2mB-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.
5b47 2-OXOACID--FERREDOXI
N OXIDOREDUCTASE
ALPHA SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01558
(POR)
PF01855
(POR_N)
PF17147
(PFOR_II) 		5 GLY A 356
ILE A 339
GLY A 317
PHE A 362
ALA A 363
 None
 1.18A 6c2mB-5b47A:
undetectable		 6c2mB-5b47A:
9.77
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.
5bra PUTATIVE PERIPLASMIC
BINDING PROTEIN WITH
SUBSTRATE RIBOSE

(Ochrobactrum
anthropi) 		PF13407
(Peripla_BP_4) 		5 GLN A 180
GLY A 173
ILE A 278
GLY A 233
ALA A 240
 None
 1.01A 6c2mB-5braA:
undetectable		 6c2mB-5braA:
13.45
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.
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
 1.20A 6c2mB-5dmxA:
undetectable		 6c2mB-5dmxA:
13.96
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) 		10 GLN A1041
PHE A1043
HIS A1057
GLY A1058
VAL A1078
ARG A1123
ILE A1132
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 (-3.2A)
5RS  A1203 (-3.3A)
5RS  A1203 (-2.9A)
 0.39A 6c2mB-5eqqA:
35.9		 6c2mB-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.
5fmg PROTEASOME SUBUNIT
ALPHA TYPE
PROTEASOME SUBUNIT
BETA TYPE
PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum;
Plasmodium
falciparum;
Plasmodium
falciparum) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N)
PF00227
(Proteasome)
PF00227
(Proteasome) 		5 GLY L  43
ARG M 128
ILE E 102
LYS L  57
GLY L  60
 None
 1.16A 6c2mB-5fmgL:
undetectable		 6c2mB-5fmgL:
15.35
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.
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
 1.04A 6c2mB-5i32A:
undetectable		 6c2mB-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
 1.07A 6c2mB-5i5dA:
undetectable		 6c2mB-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.
5ikj CRYPTIC LOCI
REGULATOR 2

(Schizosaccharomyces
pombe) 		PF10383
(Clr2)
PF16761
(Clr2_transil) 		5 PHE A 372
GLY A 234
VAL A 517
GLY A 374
ALA A 316
 None
 1.20A 6c2mB-5ikjA:
0.7		 6c2mB-5ikjA:
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.
5im2 TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL

(Rhodoferax
ferrireducens) 		PF03480
(DctP) 		5 GLY A 149
VAL A 213
ILE A 339
GLY A 234
ALA A 116
 None
BEZ  A 401 ( 3.9A)
None
None
None
 1.17A 6c2mB-5im2A:
undetectable		 6c2mB-5im2A:
12.27
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.
5iwx 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Bacillus
subtilis) 		PF02542
(YgbB) 		5 PHE A  75
GLY A 120
VAL A  85
ILE A  99
GLY A  23
 None
 1.16A 6c2mB-5iwxA:
undetectable		 6c2mB-5iwxA:
20.75
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.
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
 1.01A 6c2mB-5k0yb:
undetectable		 6c2mB-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 6c2mB-5mifA:
undetectable		 6c2mB-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
 1.12A 6c2mB-5nfhA:
undetectable		 6c2mB-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
 1.02A 6c2mB-5swuA:
undetectable		 6c2mB-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
 1.12A 6c2mB-5t5iC:
undetectable		 6c2mB-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
 1.01A 6c2mB-5t98A:
undetectable		 6c2mB-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.
5td7 ZGC:55652

(Danio rerio) 		PF00850
(Hist_deacetyl) 		5 HIS A 136
GLY A 178
VAL A 171
ILE A  27
GLY A 145
 FKS  A 711 (-4.0A)
None
None
None
FKS  A 711 (-4.5A)
 1.13A 6c2mB-5td7A:
undetectable		 6c2mB-5td7A:
10.39
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.
5vxm SINGLE-DOMAIN
ANTIBODY 20IPAD

(Vicugna pacos) 		no annotation 5 PHE B  95
GLY B 118
ILE B  51
PHE B 112
ALA B  98
 None
 1.17A 6c2mB-5vxmB:
undetectable		 6c2mB-5vxmB:
21.33
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.
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
 1.18A 6c2mB-5w3fA:
undetectable		 6c2mB-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 8 GLN A  41
HIS A  57
ARG A 123
ILE A 132
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.76A 6c2mB-5wdxA:
27.5		 6c2mB-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 9 PHE A  43
HIS A  57
GLY A  58
ARG A 123
ILE A 132
GLY A 137
SER A 139
PHE A 154
ALA A 156
 None
 0.56A 6c2mB-5wdxA:
27.5		 6c2mB-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.
5wx3 ALKYLDIKETIDE-COA
SYNTHASE

(Tetradium
ruticarpum) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 PHE A 158
GLY A 368
VAL A 268
ILE A 339
GLY A 160
 None
 1.20A 6c2mB-5wx3A:
undetectable		 6c2mB-5wx3A:
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.
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)
 1.07A 6c2mB-5xeoA:
undetectable		 6c2mB-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.
6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA

(Pectobacterium
carotovorum) 		no annotation 5 GLN A  78
ILE A 106
GLY A 102
SER A 100
ALA A  96
 None
 1.16A 6c2mB-6brmA:
undetectable		 6c2mB-6brmA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6caa ELECTROGENIC SODIUM
BICARBONATE
COTRANSPORTER 1

(Homo sapiens) 		no annotation 5 GLY A 468
VAL A 798
GLY A 844
PHE A 461
ALA A 440
 None
 1.21A 6c2mB-6caaA:
undetectable		 6c2mB-6caaA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dbr -

(-) 		no annotation 5 PHE B 206
GLY B 139
ILE B 234
GLY B 221
ALA B 209
 None
 0.93A 6c2mB-6dbrB:
undetectable		 6c2mB-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.
6f9n CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
SUBUNIT 1

(Homo sapiens) 		no annotation 5 GLY A 986
VAL A 523
ARG A1014
GLY A 939
ALA A1003
 None
 1.18A 6c2mB-6f9nA:
undetectable		 6c2mB-6f9nA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 6c2mB-1a87A:
undetectable		 6c2mB-1a87A:
10.90
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
LEU A 135
ALA A 157
VAL A 158
ASP A 168
 None
 0.34A 6c2mB-1cu1A:
34.9		 6c2mB-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.
1cvm PHYTASE

(Bacillus
amyloliquefaciens) 		PF02333
(Phytase) 		5 LEU A 262
ARG A 289
ALA A 214
SER A 162
ASP A 216
 None
 1.38A 6c2mB-1cvmA:
0.0		 6c2mB-1cvmA:
11.65
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.
1eye DIHYDROPTEROATE
SYNTHASE I

(Mycobacterium
tuberculosis) 		PF00809
(Pterin_bind) 		5 ASP A  21
LEU A 219
ARG A 212
ALA A 236
ASP A 234
 PMM  A 301 (-3.3A)
None
None
None
None
 1.38A 6c2mB-1eyeA:
undetectable		 6c2mB-1eyeA:
15.02
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.
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
 1.13A 6c2mB-1fr9A:
undetectable		 6c2mB-1fr9A:
17.44
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.
1jsw L-ASPARTATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 VAL A 350
LEU A 379
ALA A 288
VAL A 289
SER A 292
 None
 1.28A 6c2mB-1jswA:
undetectable		 6c2mB-1jswA:
11.16
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.
1l0w ASPARTYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		5 VAL A 150
HIS A 148
LEU A 535
ALA A 534
ASP A 530
 None
 0.97A 6c2mB-1l0wA:
0.0		 6c2mB-1l0wA:
8.82
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.
1l0w ASPARTYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		5 VAL A 150
HIS A 148
LEU A 535
ARG A 147
ASP A 530
 None
 1.34A 6c2mB-1l0wA:
0.0		 6c2mB-1l0wA:
8.82
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.
1m66 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Leishmania
mexicana) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		5 VAL A 255
LEU A 248
ARG A 242
ALA A 247
ASP A 243
 None
 1.37A 6c2mB-1m66A:
0.0		 6c2mB-1m66A:
10.74
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.
1m6s L-ALLO-THREONINE
ALDOLASE

(Thermotoga
maritima) 		PF01212
(Beta_elim_lyase) 		5 VAL A  76
HIS A 101
LEU A  95
ALA A  91
VAL A  89
 None
 1.22A 6c2mB-1m6sA:
undetectable		 6c2mB-1m6sA:
12.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n3s GTP CYCLOHYDROLASE I

(Escherichia
coli) 		PF01227
(GTP_cyclohydroI) 		5 VAL A 217
LEU A 106
ARG A 218
ALA A 177
VAL A 178
 None
 1.17A 6c2mB-1n3sA:
undetectable		 6c2mB-1n3sA:
18.10
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
LEU A 135
ALA A 157
ASP A 168
 None
 0.85A 6c2mB-1ns3A:
18.2		 6c2mB-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) 		5 VAL A  55
ASP A  81
LEU A 135
ALA A 157
VAL A 158
 None
 0.42A 6c2mB-1ns3A:
18.2		 6c2mB-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
 1.38A 6c2mB-1ohqA:
undetectable		 6c2mB-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.
1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE

(Leishmania
major) 		PF00581
(Rhodanese)
PF09122
(DUF1930) 		5 ASP A 103
LEU A 113
ARG A  34
ALA A  58
ASP A  32
 None
 1.15A 6c2mB-1okgA:
undetectable		 6c2mB-1okgA:
15.57
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.
1sqg SUN PROTEIN

(Escherichia
coli) 		PF01029
(NusB)
PF01189
(Methyltr_RsmB-F) 		5 VAL A 209
LEU A 191
ARG A 185
ALA A 190
ASP A 186
 None
 1.22A 6c2mB-1sqgA:
undetectable		 6c2mB-1sqgA:
10.69
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.
1xz9 AFADIN

(Homo sapiens) 		PF00595
(PDZ) 		5 ASP A  61
LEU A  17
ALA A  50
VAL A  53
ASP A  52
 None
 1.33A 6c2mB-1xz9A:
undetectable		 6c2mB-1xz9A:
22.64
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.
1z34 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Trichomonas
vaginalis) 		PF01048
(PNP_UDP_1) 		5 HIS A  99
ASP A 102
LEU A 144
ALA A 141
VAL A 138
 None
 1.35A 6c2mB-1z34A:
undetectable		 6c2mB-1z34A:
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.
2ark FLAVODOXIN

(Aquifex
aeolicus) 		PF00258
(Flavodoxin_1) 		5 VAL A 162
ASP A  51
LEU A 154
ALA A  54
VAL A  55
 None
 1.22A 6c2mB-2arkA:
undetectable		 6c2mB-2arkA:
18.75
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.
2b1p MITOGEN-ACTIVATED
PROTEIN KINASE 10

(Homo sapiens) 		PF00069
(Pkinase) 		5 VAL A 361
LEU A 335
ALA A 353
VAL A 350
SER A 349
 None
 1.32A 6c2mB-2b1pA:
0.7		 6c2mB-2b1pA:
11.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		5 VAL A1306
LEU A 946
ARG A1307
ALA A1333
ASP A1294
 None
 1.24A 6c2mB-2b39A:
undetectable		 6c2mB-2b39A:
4.40
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.
2gn4 UDP-GLCNAC C6
DEHYDRATASE

(Helicobacter
pylori) 		PF02719
(Polysacc_synt_2) 		5 VAL A  93
HIS A  92
LEU A 146
ALA A 134
ASP A 132
 UD1  A 335 ( 4.9A)
UD1  A 335 (-3.7A)
None
None
UD1  A 335 (-2.6A)
 1.36A 6c2mB-2gn4A:
undetectable		 6c2mB-2gn4A:
11.05
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.
2hb6 LEUCINE
AMINOPEPTIDASE 1

(Caenorhabditis
elegans) 		PF00883
(Peptidase_M17) 		5 VAL A 255
LEU A 283
ALA A 193
VAL A 194
ASP A 191
 None
 1.36A 6c2mB-2hb6A:
undetectable		 6c2mB-2hb6A:
10.28
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.
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
 1.38A 6c2mB-2mcpH:
undetectable		 6c2mB-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.
2nun AVIRULENCE B PROTEIN

(Pseudomonas
savastanoi) 		PF05394
(AvrB_AvrC) 		5 LEU A  91
ARG A  82
ALA A  76
SER A  72
ASP A  78
 None
 1.03A 6c2mB-2nunA:
undetectable		 6c2mB-2nunA:
11.75
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.
2odp COMPLEMENT C2

(Homo sapiens) 		PF00089
(Trypsin)
PF00092
(VWA) 		5 ASP A 707
LEU A 600
ALA A 599
VAL A 598
SER A 603
 None
None
NAG  A 807 ( 4.8A)
None
NAG  A 807 (-3.4A)
 1.38A 6c2mB-2odpA:
9.4		 6c2mB-2odpA:
9.46
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.
2qop HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ACRR

(Escherichia
coli) 		PF00440
(TetR_N)
PF08361
(TetR_C_2) 		5 LEU A  58
ARG A 105
ALA A  20
VAL A  19
ASP A  18
 None
 1.11A 6c2mB-2qopA:
undetectable		 6c2mB-2qopA:
14.42
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.
2r6r CELL DIVISION
PROTEIN FTSZ

(Aquifex
aeolicus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 VAL 1 182
ASP 1 183
LEU 1 101
ALA 1  99
VAL 1  15
 GDP  1 339 (-4.3A)
GDP  1 339 (-3.2A)
None
None
None
 1.23A 6c2mB-2r6r1:
undetectable		 6c2mB-2r6r1:
14.20
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.
2wnr PROBABLE EXOSOME
COMPLEX EXONUCLEASE
2
PROBABLE EXOSOME
COMPLEX EXONUCLEASE
1

(Methanothermobacter
thermautotrophicus;
Methanothermobacter
thermautotrophicus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 VAL A 247
LEU B 207
ARG A 244
ALA B 215
ASP B 217
 None
 1.38A 6c2mB-2wnrA:
undetectable		 6c2mB-2wnrA:
14.76
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.
2xnd ATP SYNTHASE SUBUNIT
DELTA, MITOCHONDRIAL

(Bos taurus) 		PF02823
(ATP-synt_DE_N) 		5 VAL H  36
HIS H  66
LEU H  93
ALA H  21
VAL H  26
 None
 1.14A 6c2mB-2xndH:
undetectable		 6c2mB-2xndH:
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.
2y96 DUAL SPECIFICITY
PHOSPHATASE DUPD1

(Homo sapiens) 		PF00782
(DSPc) 		5 VAL A 111
HIS A  89
LEU A 159
ARG A 153
ALA A 155
 None
None
None
SO4  A1207 (-3.8A)
None
 1.28A 6c2mB-2y96A:
undetectable		 6c2mB-2y96A:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a9l POLY-GAMMA-GLUTAMATE
HYDROLASE

(Bacillus virus
NIT1) 		PF05908
(Gamma_PGA_hydro) 		5 LEU A  93
ALA A  99
VAL A 100
SER A 101
ASP A  98
 None
 1.22A 6c2mB-3a9lA:
undetectable		 6c2mB-3a9lA:
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.
3b95 EUCHROMATIC
HISTONE-LYSINE
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF12796
(Ank_2)
PF13637
(Ank_4) 		5 HIS A 907
ASP A 909
LEU A 945
VAL A 954
SER A 952
 None
 1.27A 6c2mB-3b95A:
undetectable		 6c2mB-3b95A:
15.02
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.
3d6n DIHYDROOROTASE

(Aquifex
aeolicus) 		PF01979
(Amidohydro_1) 		5 VAL A  62
HIS A  61
ASP A  59
LEU A 392
ALA A  84
 None
ZN  A 423 (-3.5A)
None
None
None
 1.30A 6c2mB-3d6nA:
undetectable		 6c2mB-3d6nA:
13.89
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.
3fpl NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Clostridium
beijerinckii;
Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A 202
LEU A 336
ALA A 347
VAL A 348
SER A  35
 None
 1.11A 6c2mB-3fplA:
undetectable		 6c2mB-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.
3hpa AMIDOHYDROLASE

(unidentified) 		PF01979
(Amidohydro_1) 		5 VAL A 237
LEU A 256
ALA A 246
VAL A 247
ASP A 244
 None
 1.28A 6c2mB-3hpaA:
undetectable		 6c2mB-3hpaA:
9.39
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.
3i6b 3-DEOXY-D-MANNO-OCTU
LOSONATE 8-PHOSPHATE
PHOSPHATASE

(Escherichia
coli) 		PF08282
(Hydrolase_3) 		5 VAL A  36
ASP A  32
LEU A 173
ALA A 121
VAL A 120
 None
PO4  A 800 ( 4.3A)
None
None
None
 1.33A 6c2mB-3i6bA:
undetectable		 6c2mB-3i6bA:
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.
3ijm UNCHARACTERIZED
RESTRICTION
ENDONUCLEASE-LIKE
FOLD SUPERFAMILY
PROTEIN

(Spirosoma
linguale) 		no annotation 5 LEU A 121
ARG A 124
ALA A 131
VAL A 130
ASP A 127
 None
SO4  A 150 (-2.7A)
None
None
None
 1.38A 6c2mB-3ijmA:
undetectable		 6c2mB-3ijmA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3is5 CALCIUM-DEPENDENT
PROTEIN KINASE

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		5 VAL A 387
HIS A 389
LEU A 330
ALA A 366
ASP A 368
 None
 1.39A 6c2mB-3is5A:
undetectable		 6c2mB-3is5A:
13.94
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.
3kat NACHT, LRR AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00619
(CARD) 		5 VAL A1382
HIS A1380
ASP A1383
LEU A1408
ARG A1386
 None
 1.26A 6c2mB-3katA:
undetectable		 6c2mB-3katA:
19.30
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.
3mn1 PROBABLE YRBI FAMILY
PHOSPHATASE

(Pseudomonas
savastanoi) 		PF08282
(Hydrolase_3) 		5 VAL A  61
LEU A 171
ALA A 174
VAL A 177
SER A 176
 None
 1.33A 6c2mB-3mn1A:
undetectable		 6c2mB-3mn1A:
20.63
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.
3mvu TENA FAMILY
TRANSCRIPTIONAL
REGULATOR

(Ruegeria sp.
TM1040) 		PF03070
(TENA_THI-4) 		5 VAL A 141
LEU A 133
ALA A  63
VAL A  64
SER A  67
 EDO  A 237 ( 4.2A)
None
None
None
None
 1.33A 6c2mB-3mvuA:
undetectable		 6c2mB-3mvuA:
16.37
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.
3ncy ADIC

(Salmonella
enterica) 		PF13520
(AA_permease_2) 		5 VAL A 207
LEU A 201
ALA A 401
VAL A 402
SER A 405
 None
 1.35A 6c2mB-3ncyA:
undetectable		 6c2mB-3ncyA:
10.57
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.
3nyf D-ARGININE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF01266
(DAO) 		5 VAL A1177
LEU A1209
ARG A1176
ALA A1210
VAL A1212
 None
 1.36A 6c2mB-3nyfA:
undetectable		 6c2mB-3nyfA:
12.36
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.
3ppl ASPARTATE
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF12897
(Aminotran_MocR) 		5 VAL A 416
LEU A  37
ALA A 408
VAL A 407
ASP A 410
 None
 1.29A 6c2mB-3pplA:
undetectable		 6c2mB-3pplA:
12.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s6p CAPSID PROTEIN

(Helicoverpa
armigera stunt
virus) 		PF03566
(Peptidase_A21) 		5 LEU A 193
ARG A 164
VAL A 480
SER A 481
ASP A 501
 None
 1.30A 6c2mB-3s6pA:
undetectable		 6c2mB-3s6pA:
8.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u9w LEUKOTRIENE A-4
HYDROLASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		5 ASP A1578
LEU A1555
ALA A1584
VAL A1585
ASP A1582
 None
 1.17A 6c2mB-3u9wA:
undetectable		 6c2mB-3u9wA:
8.30
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.
3usz EXO-1,3/1,4-BETA-GLU
CANASE

(Pseudoalteromonas
sp. BB1) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		5 HIS A 114
LEU A 137
ALA A 392
VAL A 393
SER A 396
 None
 1.36A 6c2mB-3uszA:
undetectable		 6c2mB-3uszA:
5.72
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.
3v4o MUCOSA-ASSOCIATED
LYMPHOID TISSUE
LYMPHOMA
TRANSLOCATION
PROTEIN 1

(Homo sapiens) 		PF00656
(Peptidase_C14) 		5 VAL A 406
ASP A 342
LEU A 410
VAL A 381
SER A 382
 None
 1.34A 6c2mB-3v4oA:
undetectable		 6c2mB-3v4oA:
15.10
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.
3vth HYDROGENASE
MATURATION FACTOR

(Caldanaerobacter
subterraneus) 		PF00708
(Acylphosphatase)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		5 VAL A 594
LEU A 556
ARG A 599
ALA A 555
ASP A 602
 None
None
AP2  A 806 (-4.1A)
None
None
 1.20A 6c2mB-3vthA:
undetectable		 6c2mB-3vthA:
7.23
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.
3vu1 PUTATIVE
UNCHARACTERIZED
PROTEIN PH0242

(Pyrococcus
horikoshii) 		no annotation 5 LEU A 800
ARG A 768
VAL A 557
SER A 555
ASP A 558
 None
CL  A1002 (-3.4A)
None
None
None
 1.08A 6c2mB-3vu1A:
0.0		 6c2mB-3vu1A:
9.07
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.
3zok 3-DEHYDROQUINATE
SYNTHASE

(Actinidia
chinensis) 		PF01761
(DHQ_synthase) 		5 LEU A 349
ARG A 295
ALA A 289
VAL A 287
ASP A 291
 None
None
PO4  A1380 (-3.2A)
None
None
 1.27A 6c2mB-3zokA:
undetectable		 6c2mB-3zokA:
12.36
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.
4a3u NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE

(Zymomonas
mobilis) 		PF00724
(Oxidored_FMN) 		5 HIS A 238
ASP A 236
LEU A 204
ARG A 184
ASP A 180
 None
 1.09A 6c2mB-4a3uA:
undetectable		 6c2mB-4a3uA:
14.18
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.
4a3u NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE

(Zymomonas
mobilis) 		PF00724
(Oxidored_FMN) 		5 VAL A 242
ASP A 236
LEU A 204
ARG A 184
ASP A 180
 None
 1.00A 6c2mB-4a3uA:
undetectable		 6c2mB-4a3uA:
14.18
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.
4bmr RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT BETA

(Bacillus cereus) 		PF00268
(Ribonuc_red_sm) 		5 ASP A  12
LEU A  77
ALA A  82
VAL A  85
SER A  84
 None
 1.09A 6c2mB-4bmrA:
undetectable		 6c2mB-4bmrA:
13.92
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.
4c25 L-FUCULOSE PHOSPHATE
ALDOLASE

(Streptococcus
pneumoniae) 		PF00596
(Aldolase_II) 		5 ASP A  87
ALA A  90
VAL A  30
SER A  29
ASP A  89
 EDO  A 306 ( 3.8A)
None
None
None
None
 1.26A 6c2mB-4c25A:
undetectable		 6c2mB-4c25A:
15.89
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.
4c8q SM-LIKE PROTEIN LSM1
U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM2

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01423
(LSM)
PF01423
(LSM) 		5 VAL A 109
LEU B  40
ARG B  63
VAL B  32
SER B  31
 None
 1.10A 6c2mB-4c8qA:
undetectable		 6c2mB-4c8qA:
20.37
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.
4cpd ALCOHOL
DEHYDROGENASE

(Thermus sp.
ATN1) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A  82
LEU A 305
ARG A 136
ALA A 304
ASP A 300
 None
 1.04A 6c2mB-4cpdA:
undetectable		 6c2mB-4cpdA:
15.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dd8 DISINTEGRIN AND
METALLOPROTEINASE
DOMAIN-CONTAINING
PROTEIN 8

(Homo sapiens) 		PF01421
(Reprolysin) 		5 VAL A 222
HIS A 224
LEU A 290
ARG A 225
ASP A 320
 None
 1.30A 6c2mB-4dd8A:
undetectable		 6c2mB-4dd8A:
15.90
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.
4gp1 POLYPRENYL
SYNTHETASE

(Pyrobaculum
calidifontis) 		PF00348
(polyprenyl_synt) 		5 LEU A 290
ARG A 276
ALA A 287
VAL A 284
ASP A 283
 None
 1.30A 6c2mB-4gp1A:
undetectable		 6c2mB-4gp1A:
15.73
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.
4ia5 MYOSIN-CROSSREACTIVE
ANTIGEN

(Lactobacillus
acidophilus) 		PF06100
(MCRA) 		5 ASP A 416
LEU A 388
ARG A 425
VAL A 345
SER A 346
 None
 1.22A 6c2mB-4ia5A:
undetectable		 6c2mB-4ia5A:
9.58
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.
4ls5 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 VAL A 104
LEU A  13
ALA A  12
VAL A  20
SER A  23
 None
None
None
GOL  A 503 ( 4.8A)
None
 1.27A 6c2mB-4ls5A:
undetectable		 6c2mB-4ls5A:
12.41
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.
4nf2 ORNITHINE
CARBAMOYLTRANSFERASE

(Bacillus
anthracis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 LEU A 118
ALA A  95
VAL A  97
SER A  99
ASP A  93
 None
 1.03A 6c2mB-4nf2A:
undetectable		 6c2mB-4nf2A:
13.08
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
LEU A 135
ARG A 155
ALA A 157
VAL A 158
ASP A 168
 None
2R8  A 301 (-3.6A)
2R8  A 301 (-4.4A)
2R8  A 301 (-3.6A)
2R8  A 301 (-3.8A)
2R8  A 301 ( 4.4A)
2R8  A 301 ( 4.5A)
 0.28A 6c2mB-4nwkA:
35.5		 6c2mB-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
 1.38A 6c2mB-4od1H:
undetectable		 6c2mB-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.
4pe5 GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 VAL B 258
LEU B 249
ALA B 244
VAL B 243
SER B 246
 None
 1.26A 6c2mB-4pe5B:
undetectable		 6c2mB-4pe5B:
7.36
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.
4upl SULFATASE FAMILY
PROTEIN

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 HIS A 409
LEU A 463
ARG A 412
ALA A 443
VAL A 442
 None
 1.36A 6c2mB-4uplA:
undetectable		 6c2mB-4uplA:
10.35
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.
4wis LIPID SCRAMBLASE

([Nectria]
haematococca) 		PF04547
(Anoctamin) 		5 VAL A  92
HIS A  90
ASP A  87
ARG A  93
VAL A 111
 None
 1.28A 6c2mB-4wisA:
undetectable		 6c2mB-4wisA:
7.89
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.
4x9s PHOSPHORIBOSYL
ISOMERASE A

(Streptomyces
sp. Mg1) 		PF00977
(His_biosynth) 		5 VAL A  69
ASP A  55
ALA A  19
SER A  32
ASP A  13
 None
None
None
None
SO4  A 305 (-2.8A)
 1.32A 6c2mB-4x9sA:
undetectable		 6c2mB-4x9sA:
16.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 5

(Homo sapiens) 		PF12862
(ANAPC5) 		5 LEU O 446
ARG O 430
ALA O 469
VAL O 468
SER O 465
 None
 1.10A 6c2mB-5a31O:
undetectable		 6c2mB-5a31O:
8.08
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.
5amq RNA POLYMERASE L

(California
encephalitis
orthobunyavirus) 		PF04196
(Bunya_RdRp)
PF15518
(L_protein_N) 		5 VAL A1386
LEU A1357
VAL A1572
SER A1575
ASP A1569
 None
 1.30A 6c2mB-5amqA:
undetectable		 6c2mB-5amqA:
2.96
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.
5aza MALTOSE-BINDING
PERIPLASMIC
PROTEIN,OLIGOSACCHAR
YL TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Escherichia
coli;
Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		5 LEU A 692
ARG A 660
VAL A 453
SER A 451
ASP A 454
 None
 1.14A 6c2mB-5azaA:
undetectable		 6c2mB-5azaA:
6.64
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.
5b04 PROBABLE TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT GAMMA

(Schizosaccharomyces
pombe) 		PF00483
(NTP_transferase) 		5 VAL E 249
HIS E 247
LEU E 205
ALA E 172
VAL E 173
 None
 1.31A 6c2mB-5b04E:
undetectable		 6c2mB-5b04E:
10.76
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.
5d6o HOMOSERINE
O-ACETYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF00561
(Abhydrolase_1) 		5 LEU A  36
ARG A 127
ALA A 121
VAL A 119
ASP A 123
 None
GOL  A 408 (-4.3A)
None
None
None
 1.23A 6c2mB-5d6oA:
undetectable		 6c2mB-5d6oA:
13.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e9u GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
gordonii) 		PF00534
(Glycos_transf_1) 		5 LEU A 311
ARG A 488
ALA A 481
VAL A 480
SER A 477
 None
 1.14A 6c2mB-5e9uA:
undetectable		 6c2mB-5e9uA:
9.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e9u GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
gordonii) 		PF00534
(Glycos_transf_1) 		5 VAL A 489
LEU A 311
ARG A 488
ALA A 481
SER A 477
 None
 1.09A 6c2mB-5e9uA:
undetectable		 6c2mB-5e9uA:
9.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eks 3-DEHYDROQUINATE
SYNTHASE

(Acinetobacter
baumannii) 		PF01761
(DHQ_synthase) 		5 LEU A 333
ARG A 280
ALA A 274
VAL A 272
ASP A 276
 None
 1.16A 6c2mB-5eksA:
undetectable		 6c2mB-5eksA:
13.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eks 3-DEHYDROQUINATE
SYNTHASE

(Acinetobacter
baumannii) 		PF01761
(DHQ_synthase) 		5 LEU A 333
ARG A 280
ALA A 275
VAL A 272
ASP A 276
 None
 1.38A 6c2mB-5eksA:
undetectable		 6c2mB-5eksA:
13.32
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) 		7 VAL A1055
ASP A1081
LEU A1135
ARG A1155
ALA A1157
VAL A1158
ASP A1168
 None
5RS  A1203 (-3.5A)
5RS  A1203 (-4.2A)
5RS  A1203 (-4.8A)
5RS  A1203 (-3.5A)
5RS  A1203 ( 3.6A)
5RS  A1203 ( 4.0A)
 0.27A 6c2mB-5eqqA:
35.9		 6c2mB-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.
5f2o FATTY ACID
O-METHYLTRANSFERASE

(Mycobacterium
marinum) 		PF03492
(Methyltransf_7) 		5 ASP A  98
LEU A 139
ALA A  95
VAL A  94
ASP A  62
 SAH  A 400 (-2.8A)
None
None
None
None
 1.36A 6c2mB-5f2oA:
undetectable		 6c2mB-5f2oA:
13.86
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.
5g52 VP3

(Deformed wing
virus) 		PF00073
(Rhv) 		5 VAL C 228
LEU C 121
ARG C  66
ALA C  85
SER C 204
 None
 0.92A 6c2mB-5g52C:
undetectable		 6c2mB-5g52C:
10.73
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.
5k1s OXIDOREDUCTASE,
ZINC-BINDING
DEHYDROGENASE FAMILY

(Myxococcus
xanthus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 HIS A   0
LEU A  60
ALA A  58
VAL A  56
SER A  55
 None
 1.30A 6c2mB-5k1sA:
undetectable		 6c2mB-5k1sA:
14.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH

(Aspergillus
japonicus) 		PF05721
(PhyH) 		5 VAL A  44
LEU A 155
ALA A 200
VAL A  34
ASP A 199
 None
None
None
None
ZN  A 305 (-2.7A)
 1.37A 6c2mB-5m0tA:
undetectable		 6c2mB-5m0tA:
13.61
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.
5m6g BETA-GLUCOSIDASE

(Saccharopolyspora
erythraea) 		no annotation 5 HIS A 134
LEU A 157
ALA A 408
VAL A 409
SER A 412
 None
 1.25A 6c2mB-5m6gA:
undetectable		 6c2mB-5m6gA:
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.
5nnl INACTIVE
DIHYDROOROTASE-LIKE
DOMAIN

(Chaetomium
thermophilum) 		no annotation 5 VAL A1548
LEU A1594
ALA A1580
VAL A1579
SER A1576
 None
 1.28A 6c2mB-5nnlA:
undetectable		 6c2mB-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.
5osg RNA BINDING PROTEIN,
PUTATIVE

(Leishmania
donovani) 		no annotation 5 VAL h  80
LEU h  85
ALA h  68
VAL h  67
SER h  66
 None
 0.97A 6c2mB-5osgh:
undetectable		 6c2mB-5osgh:
16.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.21A 6c2mB-5tqiA:
undetectable		 6c2mB-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.
5u68 MPE8

(Homo sapiens) 		PF07686
(V-set) 		5 ARG E  57
ALA E 107
VAL E 141
SER E 142
ASP E 109
 None
 1.35A 6c2mB-5u68E:
undetectable		 6c2mB-5u68E:
14.19
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.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Spodoptera
frugiperda;
Homo sapiens) 		no annotation 5 ASP A1050
LEU A 227
ALA A 144
VAL A 142
ASP A 146
 None
 1.22A 6c2mB-5v54A:
undetectable		 6c2mB-5v54A:
22.62
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 6 VAL A  55
ASP A  81
LEU A 135
ALA A 157
VAL A 158
ASP A 168
 None
 0.41A 6c2mB-5wdxA:
27.5		 6c2mB-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.
5xez GLUCAGON
RECEPTOR,ENDOLYSIN,G
LUCAGON RECEPTOR

(Homo sapiens;
Escherichia
virus T4) 		PF00002
(7tm_2)
PF00959
(Phage_lysozyme)
PF02793
(HRM) 		5 VAL A 396
LEU A 153
ALA A 188
VAL A 191
SER A 190
 None
 1.36A 6c2mB-5xezA:
undetectable		 6c2mB-5xezA:
9.66
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.
5xjv DUAL SPECIFICITY
PROTEIN PHOSPHATASE
13 ISOFORM A

(Homo sapiens) 		no annotation 5 VAL A  93
HIS A  72
LEU A 141
ARG A 135
ALA A 137
 None
None
None
PO4  A 201 (-3.9A)
None
 1.30A 6c2mB-5xjvA:
undetectable		 6c2mB-5xjvA:
24.44
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.
5xog RNA POLYMERASE II
THIRD LARGEST
SUBUNIT B44, PART OF
CENTRAL CORE
SPT4/5 COMPLEX
COMPONENT

(Komagataella
phaffii;
Komagataella
phaffii) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L)
PF00467
(KOW) 		5 HIS W 783
LEU C  98
ALA C 159
SER C  95
ASP C  46
 None
 1.28A 6c2mB-5xogW:
undetectable		 6c2mB-5xogW:
17.05
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.
5y3s -

(-) 		no annotation 5 LEU A 942
ALA A 915
VAL A 917
SER A 919
ASP A 913
 None
None
None
None
PO4  A1001 (-3.9A)
 1.36A 6c2mB-5y3sA:
undetectable		 6c2mB-5y3sA:
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.
5ykn PROBABLE
LYSINE-SPECIFIC
DEMETHYLASE JMJ14

(Arabidopsis
thaliana) 		no annotation 5 VAL A 473
LEU A 442
ARG A 469
ALA A 413
VAL A 412
 None
 1.37A 6c2mB-5yknA:
undetectable		 6c2mB-5yknA:
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.
5zvs PUTATIVE CORE
PROTEIN NTPASE/VP5

(Aquareovirus C) 		no annotation 5 VAL 4 690
HIS 4 692
LEU 4 511
ALA 4 403
VAL 4 404
 None
 1.34A 6c2mB-5zvs4:
undetectable		 6c2mB-5zvs4:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c2j RNAP1
RNAP2

(Escherichia
virus N4;
Escherichia
virus N4) 		no annotation
no annotation 		5 VAL A 178
HIS A 180
ASP A 177
LEU B  39
ASP B  61
 None
 1.27A 6c2mB-6c2jA:
undetectable		 6c2mB-6c2jA:
17.07
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.
6epi ZETA_1 TOXIN

(Neisseria
gonorrhoeae) 		no annotation 5 ASP B 225
LEU B 199
ALA B 160
VAL B 161
SER B 162
 None
 1.36A 6c2mB-6epiB:
undetectable		 6c2mB-6epiB:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fyd PUTATIVE
FAD-DEPENDENT
OXYGENASE ENCM

(Streptomyces
maritimus) 		no annotation 5 HIS A  83
LEU A  47
ARG A  74
ALA A  49
ASP A  93
 FAD  A 600 ( 4.7A)
None
None
None
None
 1.28A 6c2mB-6fydA:
undetectable		 6c2mB-6fydA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6g2j NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
9, MITOCHONDRIAL

(Mus musculus) 		no annotation 5 VAL P   5
HIS P   2
LEU P  38
ALA P  21
VAL P  91
 None
 1.35A 6c2mB-6g2jP:
undetectable		 6c2mB-6g2jP:
24.39