SIMILAR PATTERNS OF AMINO ACIDS FOR 6C2M_B_SUEB1202_0

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