SIMILAR PATTERNS OF AMINO ACIDS FOR 1ONI_A_BEZA502_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.
1bl5 ISOCITRATE
DEHYDROGENASE

(Escherichia
coli) 		PF00180
(Iso_dh) 		4 PHE A 393
ASN A 352
ILE A 320
GLY A 321
 None
None
None
NAP  A   2 ( 3.9A)
 1.00A 1oniA-1bl5A:
0.5
1oniB-1bl5A:
0.5		 1oniA-1bl5A:
17.75
1oniB-1bl5A:
17.75
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.
1e9y UREASE SUBUNIT ALPHA
UREASE SUBUNIT BETA

(Helicobacter
pylori;
Helicobacter
pylori) 		PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		4 ASN A 121
ARG A 165
ILE B  38
GLY B  40
 None
 1.07A 1oniA-1e9yA:
0.0
1oniB-1e9yA:
undetectable		 1oniA-1e9yA:
20.19
1oniB-1e9yA:
20.19
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.
1f6y 5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE

(Moorella
thermoacetica) 		PF00809
(Pterin_bind) 		5 PHE A 139
ASN A  99
ASN A 125
ILE A 129
GLY A 128
 None
 1.43A 1oniA-1f6yA:
0.1
1oniB-1f6yA:
0.0		 1oniA-1f6yA:
21.43
1oniB-1f6yA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gqr ACETYLCHOLINESTERASE

(Tetronarce
californica) 		PF00135
(COesterase) 		4 PHE A 423
ASN A 324
ILE A 444
GLY A 441
 None
None
None
SAF  A1998 ( 4.6A)
 0.95A 1oniA-1gqrA:
0.0
1oniB-1gqrA:
0.4		 1oniA-1gqrA:
14.53
1oniB-1gqrA:
14.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum) 		PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ) 		4 PHE A  86
ARG A  52
ILE A  48
GLY A  50
 None
 1.10A 1oniA-1k32A:
0.3
1oniB-1k32A:
0.5		 1oniA-1k32A:
11.00
1oniB-1k32A:
11.00
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.
1kpl PUTATIVE CLC FAMILY,
CHLORINE TRANSPORT
PROTEIN

(Salmonella
enterica) 		PF00654
(Voltage_CLC) 		4 PHE A 317
ASN A 318
ARG A 147
GLY A 315
 None
 0.93A 1oniA-1kplA:
0.0
1oniB-1kplA:
0.0		 1oniA-1kplA:
13.71
1oniB-1kplA:
13.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lba T7 LYSOZYME

(Escherichia
virus T7) 		PF01510
(Amidase_2) 		4 ASN A  94
ARG A  52
ILE A  85
GLY A  84
 None
 1.08A 1oniA-1lbaA:
undetectable
1oniB-1lbaA:
undetectable		 1oniA-1lbaA:
21.82
1oniB-1lbaA:
21.82
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.
1mt5 FATTY-ACID AMIDE
HYDROLASE

(Rattus
norvegicus) 		PF01425
(Amidase) 		4 ASN A 498
ARG A 243
ILE A 491
GLY A 239
 None
None
MAY  A 600 (-4.0A)
MAY  A 600 (-3.6A)
 0.99A 1oniA-1mt5A:
0.0
1oniB-1mt5A:
0.0		 1oniA-1mt5A:
13.04
1oniB-1mt5A:
13.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1oni 14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN

(Homo sapiens) 		PF01042
(Ribonuc_L-PSP) 		4 PHE A  89
ASN A  90
ASN A  93
ARG A 107
 BEZ  A 502 ( 3.6A)
None
BEZ  A 502 (-3.1A)
BEZ  A 501 ( 3.6A)
 0.97A 1oniA-1oniA:
29.1
1oniB-1oniA:
26.7		 1oniA-1oniA:
100.00
1oniB-1oniA:
100.00
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.
1pp1 P40 NUCLEOPROTEIN

(Borna disease
virus) 		PF06407
(BDV_P40) 		4 ASN X 198
ARG X 287
ILE X 149
GLY X 150
 None
 0.88A 1oniA-1pp1X:
undetectable
1oniB-1pp1X:
undetectable		 1oniA-1pp1X:
16.98
1oniB-1pp1X:
16.98
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.
1pvd PYRUVATE
DECARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 ASN A 470
ASN A 471
ILE A 490
GLY A 473
 None
MG  A 558 (-2.6A)
None
MG  A 558 (-4.3A)
 1.05A 1oniA-1pvdA:
undetectable
1oniB-1pvdA:
undetectable		 1oniA-1pvdA:
14.73
1oniB-1pvdA:
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.
1raj GENOME POLYPROTEIN

(Enterovirus C) 		PF00680
(RdRP_1) 		4 ASN A 301
ASN A 302
ILE A 324
GLY A 207
 None
 0.96A 1oniA-1rajA:
undetectable
1oniB-1rajA:
undetectable		 1oniA-1rajA:
20.62
1oniB-1rajA:
20.62
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.
1rdr POLIOVIRUS 3D
POLYMERASE

(Enterovirus C) 		PF00680
(RdRP_1) 		4 ASN A 301
ASN A 302
ILE A 324
GLY A 207
 None
 0.94A 1oniA-1rdrA:
undetectable
1oniB-1rdrA:
undetectable		 1oniA-1rdrA:
14.10
1oniB-1rdrA:
14.10
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.
1sg3 ALLANTOICASE

(Saccharomyces
cerevisiae) 		PF03561
(Allantoicase) 		4 PHE A 269
ASN A 272
ILE A 329
GLY A 333
 None
 1.06A 1oniA-1sg3A:
undetectable
1oniB-1sg3A:
undetectable		 1oniA-1sg3A:
17.48
1oniB-1sg3A:
17.48
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.
1t5j HYPOTHETICAL PROTEIN
MJ1187

(Methanocaldococcus
jannaschii) 		PF03747
(ADP_ribosyl_GH) 		4 PHE A 135
ASN A 137
ILE A 133
GLY A 132
 None
 0.99A 1oniA-1t5jA:
undetectable
1oniB-1t5jA:
undetectable		 1oniA-1t5jA:
17.20
1oniB-1t5jA:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tp7 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		4 ASN A 300
ASN A 301
ILE A 323
GLY A 207
 None
 0.98A 1oniA-1tp7A:
undetectable
1oniB-1tp7A:
undetectable		 1oniA-1tp7A:
16.43
1oniB-1tp7A:
16.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u2x ADP-SPECIFIC
PHOSPHOFRUCTOKINASE

(Pyrococcus
horikoshii) 		PF04587
(ADP_PFK_GK) 		4 ASN A  35
ASN A  37
ILE A 122
GLY A 117
 SO4  A1003 (-3.8A)
SO4  A1003 ( 4.6A)
None
None
 1.08A 1oniA-1u2xA:
undetectable
1oniB-1u2xA:
undetectable		 1oniA-1u2xA:
16.56
1oniB-1u2xA:
16.56
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.
1ua4 ADP-DEPENDENT
GLUCOKINASE

(Pyrococcus
furiosus) 		PF04587
(ADP_PFK_GK) 		4 ASN A  30
ASN A  32
ILE A 116
GLY A 111
 GLC  A1457 (-4.2A)
GLC  A1457 ( 3.5A)
None
GLC  A1457 ( 3.5A)
 0.96A 1oniA-1ua4A:
undetectable
1oniB-1ua4A:
undetectable		 1oniA-1ua4A:
17.55
1oniB-1ua4A:
17.55
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.
1uhw PLECKSTRIN

(Mus musculus) 		PF00610
(DEP) 		4 PHE A  91
ASN A  89
ILE A  62
GLY A  59
 None
 0.90A 1oniA-1uhwA:
undetectable
1oniB-1uhwA:
undetectable		 1oniA-1uhwA:
22.15
1oniB-1uhwA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xr6 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		4 ASN A 300
ASN A 301
ILE A 323
GLY A 207
 None
 0.95A 1oniA-1xr6A:
undetectable
1oniB-1xr6A:
undetectable		 1oniA-1xr6A:
17.31
1oniB-1xr6A:
17.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y4h CYSTEINE PROTEASE
INHIBITOR

(Staphylococcus
aureus) 		PF09023
(Staphostatin_B) 		4 ASN C  25
ARG C 107
ILE C  42
GLY C  29
 SO4  C 462 (-4.0A)
None
None
None
 0.94A 1oniA-1y4hC:
undetectable
1oniB-1y4hC:
undetectable		 1oniA-1y4hC:
18.88
1oniB-1y4hC:
18.88
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.
1zzh CYTOCHROME C
PEROXIDASE

(Rhodobacter
capsulatus) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		4 ASN A  92
ASN A 212
ILE A 207
GLY A 206
 HEC  A 802 (-3.9A)
None
None
None
 1.10A 1oniA-1zzhA:
undetectable
1oniB-1zzhA:
undetectable		 1oniA-1zzhA:
17.99
1oniB-1zzhA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2aqw PUTATIVE
OROTIDINE-MONOPHOSPH
ATE-DECARBOXYLASE

(Plasmodium
yoelii) 		PF00215
(OMPdecase) 		4 ASN A  95
ASN A  51
ILE A  55
GLY A  54
 None
 1.00A 1oniA-2aqwA:
undetectable
1oniB-2aqwA:
undetectable		 1oniA-2aqwA:
17.15
1oniB-2aqwA:
17.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		5 PHE A 407
ASN A 386
ASN A 401
ILE A 416
GLY A 404
 None
 1.49A 1oniA-2bf6A:
undetectable
1oniB-2bf6A:
undetectable		 1oniA-2bf6A:
15.18
1oniB-2bf6A:
15.18
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.
2bl5 MGC83862 PROTEIN

(Xenopus laevis) 		PF00013
(KH_1) 		4 PHE A  16
ASN A  17
ILE A  22
GLY A  20
 None
 1.09A 1oniA-2bl5A:
undetectable
1oniB-2bl5A:
undetectable		 1oniA-2bl5A:
22.88
1oniB-2bl5A:
22.88
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.
2cso PLECKSTRIN

(Homo sapiens) 		PF00610
(DEP) 		4 PHE A 101
ASN A  99
ILE A  72
GLY A  69
 None
 0.94A 1oniA-2csoA:
undetectable
1oniB-2csoA:
undetectable		 1oniA-2csoA:
21.38
1oniB-2csoA:
21.38
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.
2d7s RNA-DEPENDENT RNA
POLYMERASE

(Foot-and-mouth
disease virus) 		PF00680
(RdRP_1) 		4 ASN A 311
ASN A 312
ILE A 334
GLY A 212
 None
 0.97A 1oniA-2d7sA:
undetectable
1oniB-2d7sA:
undetectable		 1oniA-2d7sA:
14.98
1oniB-2d7sA:
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.
2e3i RESTIN

(Homo sapiens) 		PF01302
(CAP_GLY) 		4 PHE A 118
ASN A  99
ILE A  90
GLY A 116
 None
 1.08A 1oniA-2e3iA:
undetectable
1oniB-2e3iA:
undetectable		 1oniA-2e3iA:
23.74
1oniB-2e3iA:
23.74
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.
2e7p GLUTAREDOXIN

(Populus tremula
x Populus
tremuloides) 		PF00462
(Glutaredoxin) 		4 PHE A  78
ASN A  76
ILE A  84
GLY A  85
 None
 1.03A 1oniA-2e7pA:
undetectable
1oniB-2e7pA:
undetectable		 1oniA-2e7pA:
22.38
1oniB-2e7pA:
22.38
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.
2efe SIMILARITY TO
VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN VPS9
SMALL GTP-BINDING
PROTEIN-LIKE

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		PF02204
(VPS9)
PF00071
(Ras) 		4 ASN A 168
ASN A 167
ILE B  43
GLY B  44
 None
 1.06A 1oniA-2efeA:
undetectable
1oniB-2efeA:
undetectable		 1oniA-2efeA:
20.66
1oniB-2efeA:
20.66
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.
2ehq 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE

(Thermus
thermophilus) 		PF00171
(Aldedh) 		4 PHE A 471
ASN A 472
ILE A 296
GLY A 448
 None
 0.85A 1oniA-2ehqA:
undetectable
1oniB-2ehqA:
undetectable		 1oniA-2ehqA:
14.51
1oniB-2ehqA:
14.51
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.
2ghi TRANSPORT PROTEIN

(Plasmodium
yoelii) 		PF00005
(ABC_tran) 		4 PHE A 105
ASN A 106
ARG A 168
ILE A 103
 None
 1.04A 1oniA-2ghiA:
1.1
1oniB-2ghiA:
1.1		 1oniA-2ghiA:
19.92
1oniB-2ghiA:
19.92
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.
2hcm DUAL SPECIFICITY
PROTEIN PHOSPHATASE

(Mus musculus) 		PF00782
(DSPc) 		4 ASN A  97
ASN A  22
ILE A  20
GLY A  21
 None
 1.08A 1oniA-2hcmA:
undetectable
1oniB-2hcmA:
undetectable		 1oniA-2hcmA:
21.56
1oniB-2hcmA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hor ALLIIN LYASE 1

(Allium sativum) 		PF04863
(EGF_alliinase)
PF04864
(Alliinase_C) 		4 PHE A 164
ASN A 207
ARG A 169
GLY A 392
 None
SO4  A 600 (-3.9A)
None
None
 1.02A 1oniA-2horA:
undetectable
1oniB-2horA:
undetectable		 1oniA-2horA:
15.33
1oniB-2horA:
15.33
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.
2ijd PICORNAIN 3C,
RNA-DIRECTED RNA
POLYMERASE

(Enterovirus C) 		PF00548
(Peptidase_C3)
PF00680
(RdRP_1) 		4 ASN 1 484
ASN 1 485
ILE 1 507
GLY 1 390
 None
 0.97A 1oniA-2ijd1:
undetectable
1oniB-2ijd1:
undetectable		 1oniA-2ijd1:
11.49
1oniB-2ijd1:
11.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ixo SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
ACTIVATOR 1

(Saccharomyces
cerevisiae) 		PF03095
(PTPA) 		4 PHE A 208
ARG A 185
ILE A 255
GLY A 251
 None
 0.97A 1oniA-2ixoA:
undetectable
1oniB-2ixoA:
undetectable		 1oniA-2ixoA:
17.63
1oniB-2ixoA:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2k22 PUTATIVE
UNCHARACTERIZED
PROTEIN TA0895

(Thermoplasma
acidophilum) 		PF02597
(ThiS) 		4 PHE A  21
ASN A  22
ILE A  24
GLY A  23
 None
 1.07A 1oniA-2k22A:
undetectable
1oniB-2k22A:
undetectable		 1oniA-2k22A:
19.01
1oniB-2k22A:
19.01
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.
2pcr INOSITOL-1-MONOPHOSP
HATASE

(Aquifex
aeolicus) 		PF00459
(Inositol_P) 		4 PHE A  98
ASN A  96
ASN A  93
GLY A 188
 None
 1.08A 1oniA-2pcrA:
undetectable
1oniB-2pcrA:
undetectable		 1oniA-2pcrA:
21.01
1oniB-2pcrA:
21.01
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.
2qkw PROTEIN KINASE

(Solanum
pimpinellifolium) 		PF07714
(Pkinase_Tyr) 		4 ASN B 169
ARG B  71
ILE B 185
GLY B 184
 None
 0.99A 1oniA-2qkwB:
undetectable
1oniB-2qkwB:
undetectable		 1oniA-2qkwB:
21.17
1oniB-2qkwB:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wd5 STRUCTURAL
MAINTENANCE OF
CHROMOSOMES PROTEIN
1A
STRUCTURAL
MAINTENANCE OF
CHROMOSOMES PROTEIN
3

(Mus musculus;
Mus musculus) 		PF06470
(SMC_hinge)
PF06470
(SMC_hinge) 		4 ASN B 590
ARG A 635
ILE A 652
GLY A 650
 None
 1.06A 1oniA-2wd5B:
undetectable
1oniB-2wd5B:
undetectable		 1oniA-2wd5B:
20.37
1oniB-2wd5B:
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.
3chx PMOB

(Methylosinus
trichosporium) 		PF04744
(Monooxygenase_B) 		4 PHE A  95
ASN A 150
ASN A  97
ARG A 107
 None
 0.90A 1oniA-3chxA:
undetectable
1oniB-3chxA:
undetectable		 1oniA-3chxA:
16.97
1oniB-3chxA:
16.97
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.
3fet ELECTRON TRANSFER
FLAVOPROTEIN SUBUNIT
ALPHA RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF01012
(ETF) 		4 PHE A  12
ASN A  11
ILE A 136
GLY A 134
 None
 1.01A 1oniA-3fetA:
undetectable
1oniB-3fetA:
undetectable		 1oniA-3fetA:
23.84
1oniB-3fetA:
23.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gdn R-OXYNITRILE LYASE
ISOENZYME 1

(Prunus dulcis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 PHE A 302
ASN A 304
ILE A 434
GLY A 433
 None
 0.77A 1oniA-3gdnA:
undetectable
1oniB-3gdnA:
undetectable		 1oniA-3gdnA:
16.91
1oniB-3gdnA:
16.91
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.
3gve YFKN PROTEIN

(Bacillus
subtilis) 		PF00149
(Metallophos) 		4 ASN A 138
ASN A 128
ILE A 165
GLY A 166
 None
 1.08A 1oniA-3gveA:
undetectable
1oniB-3gveA:
undetectable		 1oniA-3gveA:
18.18
1oniB-3gveA:
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.
3gw7 UNCHARACTERIZED
PROTEIN YEDJ

(Escherichia
coli) 		PF01966
(HD) 		4 PHE A 200
ASN A 197
ILE A 135
GLY A 136
 None
 1.04A 1oniA-3gw7A:
undetectable
1oniB-3gw7A:
undetectable		 1oniA-3gw7A:
19.23
1oniB-3gw7A:
19.23
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.
3hjr EXTRACELLULAR SERINE
PROTEASE

(Aeromonas
sobria) 		PF00082
(Peptidase_S8)
PF01483
(P_proprotein) 		4 ASN A 250
ASN A 245
ILE A 277
GLY A 274
 None
 1.09A 1oniA-3hjrA:
undetectable
1oniB-3hjrA:
undetectable		 1oniA-3hjrA:
12.59
1oniB-3hjrA:
12.59
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.
3i5g MYOSIN HEAVY CHAIN
ISOFORM A
MYOSIN CATALYTIC
LIGHT CHAIN LC-1,
MANTLE MUSCLE

(Doryteuthis
pealeii;
Todarodes
pacificus) 		PF00063
(Myosin_head)
PF00612
(IQ)
PF02736
(Myosin_N)
PF13405
(EF-hand_6) 		4 ASN C  43
ARG A 797
ILE A 791
GLY A 793
 None
 1.07A 1oniA-3i5gC:
undetectable
1oniB-3i5gC:
undetectable		 1oniA-3i5gC:
22.09
1oniB-3i5gC:
22.09
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.
3isl PURINE CATABOLISM
PROTEIN PUCG

(Bacillus
subtilis) 		PF00266
(Aminotran_5) 		4 ASN A  49
ARG A 264
ILE A  47
GLY A  46
 None
 1.09A 1oniA-3islA:
undetectable
1oniB-3islA:
undetectable		 1oniA-3islA:
16.59
1oniB-3islA:
16.59
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.
3j9d OUTER CAPSID PROTEIN
VP2

(Bluetongue
virus) 		PF00898
(Orbi_VP2) 		4 ASN A 751
ARG A 695
ILE A 176
GLY A 749
 None
 1.10A 1oniA-3j9dA:
undetectable
1oniB-3j9dA:
undetectable		 1oniA-3j9dA:
9.15
1oniB-3j9dA:
9.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ki8 BETA
UREIDOPROPIONASE
(BETA-ALANINE
SYNTHASE)

(Pyrococcus
abyssi) 		PF00795
(CN_hydrolase) 		4 PHE A 206
ASN A  10
ILE A  13
GLY A  47
 None
 0.85A 1oniA-3ki8A:
undetectable
1oniB-3ki8A:
undetectable		 1oniA-3ki8A:
21.83
1oniB-3ki8A:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l4k DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		4 PHE A 752
ASN A 751
ILE A 746
GLY A 747
 None
 1.02A 1oniA-3l4kA:
undetectable
1oniB-3l4kA:
undetectable		 1oniA-3l4kA:
10.82
1oniB-3l4kA:
10.82
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.
3ouh EGL NINE HOMOLOG 1

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		4 PHE A 360
ASN A 331
ILE A 222
GLY A 223
 None
 0.87A 1oniA-3ouhA:
undetectable
1oniB-3ouhA:
undetectable		 1oniA-3ouhA:
20.00
1oniB-3ouhA:
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.
3oui EGL NINE HOMOLOG 1

(Homo sapiens) 		PF13640
(2OG-FeII_Oxy_3) 		4 PHE A 360
ASN A 331
ILE A 222
GLY A 223
 None
 0.95A 1oniA-3ouiA:
undetectable
1oniB-3ouiA:
undetectable		 1oniA-3ouiA:
21.23
1oniB-3ouiA:
21.23
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.
3p9n POSSIBLE
METHYLTRANSFERASE
(METHYLASE)

(Mycobacterium
tuberculosis) 		PF03602
(Cons_hypoth95) 		4 PHE A  33
ASN A  34
ILE A   5
GLY A   6
 None
 1.08A 1oniA-3p9nA:
undetectable
1oniB-3p9nA:
undetectable		 1oniA-3p9nA:
25.26
1oniB-3p9nA:
25.26
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.
3rdv CAP-GLY
DOMAIN-CONTAINING
LINKER PROTEIN 1

(Homo sapiens) 		PF01302
(CAP_GLY) 		4 PHE A 118
ASN A  99
ILE A  90
GLY A 116
 None
 1.06A 1oniA-3rdvA:
undetectable
1oniB-3rdvA:
undetectable		 1oniA-3rdvA:
21.32
1oniB-3rdvA:
21.32
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.
3red HYDROXYNITRILE LYASE

(Prunus mume) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 PHE A 303
ASN A 305
ILE A 435
GLY A 434
 None
 0.75A 1oniA-3redA:
undetectable
1oniB-3redA:
undetectable		 1oniA-3redA:
14.68
1oniB-3redA:
14.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s25 HYPOTHETICAL
7-BLADED
BETA-PROPELLER-LIKE
PROTEIN

([Eubacterium]
rectale) 		PF16472
(DUF5050) 		4 PHE A  49
ASN A 298
ILE A  88
GLY A  47
 None
 0.99A 1oniA-3s25A:
undetectable
1oniB-3s25A:
undetectable		 1oniA-3s25A:
19.27
1oniB-3s25A:
19.27
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.
3sl1 ARGINASE

(Plasmodium
falciparum) 		PF00491
(Arginase) 		4 ASN A  68
ARG A  48
ILE A  66
GLY A  67
 None
 1.10A 1oniA-3sl1A:
undetectable
1oniB-3sl1A:
undetectable		 1oniA-3sl1A:
14.32
1oniB-3sl1A:
14.32
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.
4a69 HISTONE DEACETYLASE
3,

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		4 ASN A 119
ARG A  60
ILE A 154
GLY A 153
 GOL  A 506 (-3.5A)
None
None
None
 0.99A 1oniA-4a69A:
undetectable
1oniB-4a69A:
undetectable		 1oniA-4a69A:
16.30
1oniB-4a69A:
16.30
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.
4amf PHOX

(Pseudomonas
fluorescens) 		PF05787
(DUF839) 		4 ASN A  67
ASN A  68
ILE A 549
GLY A 548
 None
 1.01A 1oniA-4amfA:
undetectable
1oniB-4amfA:
undetectable		 1oniA-4amfA:
14.38
1oniB-4amfA:
14.38
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.
4b8s ADP-DEPENDENT
GLUCOKINASE

(Thermococcus
litoralis) 		PF04587
(ADP_PFK_GK) 		4 ASN A  38
ASN A  40
ILE A 124
GLY A 119
 GLC  A 468 (-4.6A)
GLC  A 468 ( 4.1A)
None
GLC  A 468 (-3.5A)
 0.97A 1oniA-4b8sA:
undetectable
1oniB-4b8sA:
undetectable		 1oniA-4b8sA:
12.97
1oniB-4b8sA:
12.97
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.
4c0d CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 ASN A2216
ASN A2272
ARG A2311
ILE A2121
 None
 1.02A 1oniA-4c0dA:
undetectable
1oniB-4c0dA:
2.0		 1oniA-4c0dA:
10.80
1oniB-4c0dA:
10.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cdb LISTERIOLYSIN O

(Listeria
monocytogenes) 		PF01289
(Thiol_cytolysin)
PF17440
(Thiol_cytolys_C) 		4 ASN A 179
ARG A 149
ILE A 293
GLY A 128
 NA  A1535 (-2.7A)
NA  A1538 ( 4.3A)
None
None
 1.09A 1oniA-4cdbA:
undetectable
1oniB-4cdbA:
undetectable		 1oniA-4cdbA:
15.70
1oniB-4cdbA:
15.70
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.
4crm TRANSLATION
INITIATION FACTOR
RLI1

(Saccharomyces
cerevisiae) 		PF00005
(ABC_tran)
PF00037
(Fer4)
PF04068
(RLI) 		4 ASN P   5
ASN P  74
ILE P  56
GLY P  57
 None
None
None
SF4  P1610 ( 4.9A)
 0.95A 1oniA-4crmP:
undetectable
1oniB-4crmP:
undetectable		 1oniA-4crmP:
14.11
1oniB-4crmP:
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.
4e1l ACETOACETYL-COA
THIOLASE 2

(Clostridioides
difficile) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 ASN A  85
ASN A  55
ILE A 351
GLY A 352
 None
 1.05A 1oniA-4e1lA:
1.2
1oniB-4e1lA:
1.5		 1oniA-4e1lA:
16.46
1oniB-4e1lA:
16.46
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.
4fmz INTERNALIN

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13855
(LRR_8) 		4 ASN A 175
ASN A 151
ILE A 128
GLY A 129
 None
 1.10A 1oniA-4fmzA:
undetectable
1oniB-4fmzA:
undetectable		 1oniA-4fmzA:
17.54
1oniB-4fmzA:
17.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jmo CYTOHESIN-2

(Homo sapiens) 		PF01369
(Sec7) 		4 PHE A  99
ARG A  69
ILE A 111
GLY A 103
 None
 1.10A 1oniA-4jmoA:
undetectable
1oniB-4jmoA:
undetectable		 1oniA-4jmoA:
21.26
1oniB-4jmoA:
21.26
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.
4jqt PUTATIVE GLYCOSYL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF06439
(DUF1080) 		4 ASN A 442
ASN A 230
ILE A 272
GLY A 271
 EDO  A 506 (-3.5A)
None
None
None
 1.07A 1oniA-4jqtA:
undetectable
1oniB-4jqtA:
undetectable		 1oniA-4jqtA:
14.49
1oniB-4jqtA:
14.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		4 PHE A 305
ASN A 163
ILE A 352
GLY A 317
 None
 1.11A 1oniA-4lglA:
undetectable
1oniB-4lglA:
undetectable		 1oniA-4lglA:
9.91
1oniB-4lglA:
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.
4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		4 ASN A 359
ASN A 360
ILE A 381
GLY A 364
 None
 0.90A 1oniA-4nk6A:
undetectable
1oniB-4nk6A:
undetectable		 1oniA-4nk6A:
14.52
1oniB-4nk6A:
14.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pmd ENDO-1,4-BETA-XYLANA
SE

(Caldicellulosiruptor
bescii) 		PF00331
(Glyco_hydro_10) 		4 ASN A 182
ARG A  85
ILE A 214
GLY A 213
 None
 0.99A 1oniA-4pmdA:
undetectable
1oniB-4pmdA:
0.8		 1oniA-4pmdA:
18.08
1oniB-4pmdA:
18.08
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.
4rep GAMMA-CAROTENE
DESATURASE

(Nonlabens
dokdonensis) 		PF01593
(Amino_oxidase) 		4 ASN A 167
ASN A 168
ILE A 203
GLY A 202
 None
 0.82A 1oniA-4repA:
undetectable
1oniB-4repA:
undetectable		 1oniA-4repA:
15.43
1oniB-4repA:
15.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rgb CARVEOL
DEHYDROGENASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		4 ASN A 212
ASN A 163
ARG A  21
GLY A 162
 None
 1.09A 1oniA-4rgbA:
undetectable
1oniB-4rgbA:
undetectable		 1oniA-4rgbA:
21.83
1oniB-4rgbA:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rul DNA TOPOISOMERASE 1

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01396
(zf-C4_Topoisom)
PF01751
(Toprim)
PF08272
(Topo_Zn_Ribbon) 		4 ASN A 548
ARG A 168
ILE A 491
GLY A 492
 None
 1.03A 1oniA-4rulA:
undetectable
1oniB-4rulA:
undetectable		 1oniA-4rulA:
10.45
1oniB-4rulA:
10.45
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.
4xii CHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		4 PHE A 421
ASN A 322
ILE A 442
GLY A 439
 None
None
None
40V  A1001 ( 3.9A)
 1.01A 1oniA-4xiiA:
1.9
1oniB-4xiiA:
undetectable		 1oniA-4xiiA:
16.48
1oniB-4xiiA:
16.48
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.
4xp8 ETGA PROTEIN

(Escherichia
coli) 		PF01464
(SLT) 		4 ASN A  86
ASN A  47
ILE A  61
GLY A  62
 None
 1.07A 1oniA-4xp8A:
undetectable
1oniB-4xp8A:
undetectable		 1oniA-4xp8A:
18.57
1oniB-4xp8A:
18.57
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.
4y18 BREAST CANCER TYPE 1
SUSCEPTIBILITY
PROTEIN

(Homo sapiens) 		PF00533
(BRCT) 		4 ASN A1742
ARG A1751
ILE A1707
GLY A1748
 None
 1.10A 1oniA-4y18A:
undetectable
1oniB-4y18A:
undetectable		 1oniA-4y18A:
18.39
1oniB-4y18A:
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.
4zpd RNA-DIRECTED RNA
POLYMERASE

(Enterovirus B) 		PF00680
(RdRP_1) 		4 ASN A 302
ASN A 303
ILE A 325
GLY A 207
 None
 0.95A 1oniA-4zpdA:
undetectable
1oniB-4zpdA:
undetectable		 1oniA-4zpdA:
15.58
1oniB-4zpdA:
15.58
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.
4zrx F5/8 TYPE C DOMAIN
PROTEIN

(Bacteroides
ovatus) 		PF00754
(F5_F8_type_C)
PF01120
(Alpha_L_fucos) 		4 ASN A 493
ASN A 492
ARG A 496
GLY A 600
 None
 1.02A 1oniA-4zrxA:
undetectable
1oniB-4zrxA:
undetectable		 1oniA-4zrxA:
12.98
1oniB-4zrxA:
12.98
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.
5dqr 7-HYDROXYMETHYL
CHLOROPHYLL A
REDUCTASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF04422
(FrhB_FdhB_N)
PF04432
(FrhB_FdhB_C) 		4 ASN A 307
ASN A 234
ILE A 314
GLY A 315
 None
FAD  A 503 (-4.6A)
FAD  A 503 (-4.7A)
FAD  A 503 (-3.5A)
 1.02A 1oniA-5dqrA:
undetectable
1oniB-5dqrA:
undetectable		 1oniA-5dqrA:
17.95
1oniB-5dqrA:
17.95
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.
5egw CYSTEINE PROTEASE

(Ambrosia
artemisiifolia) 		PF00112
(Peptidase_C1)
PF08246
(Inhibitor_I29) 		4 ASN A 190
ARG A 108
ILE A 101
GLY A 196
 None
 0.96A 1oniA-5egwA:
undetectable
1oniB-5egwA:
undetectable		 1oniA-5egwA:
16.53
1oniB-5egwA:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fu7 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		4 ASN A2216
ASN A2272
ARG A2311
ILE A2121
 None
 1.02A 1oniA-5fu7A:
0.4
1oniB-5fu7A:
undetectable		 1oniA-5fu7A:
14.64
1oniB-5fu7A:
14.64
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.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		4 PHE A 430
ASN A 333
ILE A 453
GLY A 450
 None
 1.01A 1oniA-5fv4A:
1.3
1oniB-5fv4A:
1.1		 1oniA-5fv4A:
14.88
1oniB-5fv4A:
14.88
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.
5gtx BUCKWHEAT
GLUTAREDOXIN

(Polygonaceae) 		PF00462
(Glutaredoxin) 		4 PHE A  87
ASN A  85
ILE A  93
GLY A  94
 None
 1.00A 1oniA-5gtxA:
undetectable
1oniB-5gtxA:
undetectable		 1oniA-5gtxA:
21.92
1oniB-5gtxA:
21.92
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.
5hj5 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Vibrio cholerae) 		PF01182
(Glucosamine_iso) 		4 ASN A 147
ARG A 158
ILE A 188
GLY A 189
 None
 1.00A 1oniA-5hj5A:
undetectable
1oniB-5hj5A:
undetectable		 1oniA-5hj5A:
22.92
1oniB-5hj5A:
22.92
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.
5jxk ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Porphyromonas
endodontalis) 		PF10459
(Peptidase_S46) 		4 ASN A 295
ARG A 670
ILE A 679
GLY A 676
 None
 1.02A 1oniA-5jxkA:
undetectable
1oniB-5jxkA:
undetectable		 1oniA-5jxkA:
12.52
1oniB-5jxkA:
12.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kkg ANCMT E72A

(synthetic
construct) 		PF04587
(ADP_PFK_GK) 		4 ASN A  14
ASN A  16
ILE A 101
GLY A  96
 None
 0.93A 1oniA-5kkgA:
undetectable
1oniB-5kkgA:
undetectable		 1oniA-5kkgA:
15.85
1oniB-5kkgA:
15.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lpc VANADIUM-DEPENDENT
BROMOPEROXIDASE

(Acaryochloris
marina) 		no annotation 4 ASN A 277
ASN A 276
ILE A 274
GLY A 275
 None
 1.05A 1oniA-5lpcA:
undetectable
1oniB-5lpcA:
undetectable		 1oniA-5lpcA:
12.79
1oniB-5lpcA:
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.
5npu ANC27

(synthetic
construct) 		no annotation 4 ASN A 467
ASN A 468
ILE A 485
GLY A 470
 None
MG  A 601 ( 1.7A)
None
None
 0.87A 1oniA-5npuA:
undetectable
1oniB-5npuA:
undetectable		 1oniA-5npuA:
undetectable
1oniB-5npuA:
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.
5o0j ADP-DEPENDENT
GLUCOKINASE

(Pyrococcus
horikoshii) 		no annotation 4 ASN A  33
ASN A  35
ILE A 119
GLY A 114
 GLC  A 503 (-4.3A)
GLC  A 503 (-3.4A)
None
GLC  A 503 (-3.5A)
 0.84A 1oniA-5o0jA:
undetectable
1oniB-5o0jA:
0.3		 1oniA-5o0jA:
undetectable
1oniB-5o0jA:
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.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE

(Methanocaldococcus
jannaschii) 		no annotation 4 ASN A  24
ASN A  26
ILE A 111
GLY A 106
 None
GLC  A 501 (-3.8A)
None
GLC  A 501 (-3.2A)
 1.08A 1oniA-5od2A:
undetectable
1oniB-5od2A:
undetectable		 1oniA-5od2A:
undetectable
1oniB-5od2A:
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.
5w3w ARYLDIALKYLPHOSPHATA
SE

(Sulfolobus
solfataricus) 		no annotation 4 ASN A 176
ASN A 175
ILE A 145
GLY A 144
 None
 0.80A 1oniA-5w3wA:
undetectable
1oniB-5w3wA:
undetectable		 1oniA-5w3wA:
undetectable
1oniB-5w3wA:
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 4 ASN A 665
ARG A 893
ILE A 891
GLY A 889
 None
 1.09A 1oniA-5wlhA:
undetectable
1oniB-5wlhA:
undetectable		 1oniA-5wlhA:
7.59
1oniB-5wlhA:
7.59
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.
5x49 PROBABLE XAA-PRO
AMINOPEPTIDASE 3

(Homo sapiens) 		PF00557
(Peptidase_M24)
PF05195
(AMP_N) 		4 PHE A 411
ASN A 408
ILE A 392
GLY A 393
 None
 0.82A 1oniA-5x49A:
undetectable
1oniB-5x49A:
undetectable		 1oniA-5x49A:
16.01
1oniB-5x49A:
16.01
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.
5xe0 GENOME POLYPROTEIN

(Enterovirus D) 		PF00680
(RdRP_1) 		4 ASN A 297
ASN A 298
ILE A 320
GLY A 203
 None
 0.98A 1oniA-5xe0A:
undetectable
1oniB-5xe0A:
undetectable		 1oniA-5xe0A:
14.92
1oniB-5xe0A:
14.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zji PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IV A
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT III

(Zea mays;
Zea mays) 		no annotation
no annotation 		4 PHE E 114
ASN E 115
ILE F 222
GLY E  93
 None
 0.92A 1oniA-5zjiE:
undetectable
1oniB-5zjiE:
undetectable		 1oniA-5zjiE:
undetectable
1oniB-5zjiE:
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.
6c8z ADP-DEPENDENT
PHOSPHOFRUCTOKINASE

(Methanosarcinales) 		no annotation 4 ASN A  32
ASN A  34
ILE A 119
GLY A 114
 None
 1.07A 1oniA-6c8zA:
undetectable
1oniB-6c8zA:
undetectable		 1oniA-6c8zA:
undetectable
1oniB-6c8zA:
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.
6f42 DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC2

(Saccharomyces
cerevisiae) 		no annotation 4 ASN B 434
ASN B 188
ILE B 186
GLY B 189
 None
 1.10A 1oniA-6f42B:
undetectable
1oniB-6f42B:
undetectable		 1oniA-6f42B:
undetectable
1oniB-6f42B:
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.
6fos PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2

(Cyanidioschyzon
merolae) 		no annotation 4 PHE B 607
ASN B 608
ILE B 510
GLY B 511
 None
 1.02A 1oniA-6fosB:
undetectable
1oniB-6fosB:
undetectable		 1oniA-6fosB:
undetectable
1oniB-6fosB:
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.
6g43 PUTATIVE MAJOR
CAPSID PROTEIN

(Cafeteriavirus-dependent
mavirus) 		no annotation 4 PHE A 260
ASN A  49
ILE A  52
GLY A  53
 None
 0.95A 1oniA-6g43A:
undetectable
1oniB-6g43A:
undetectable		 1oniA-6g43A:
undetectable
1oniB-6g43A:
undetectable