SIMILAR PATTERNS OF AMINO ACIDS FOR 3BXO_B_SAMB238

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.
1hp1 5'-NUCLEOTIDASE

(Escherichia
coli) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 GLY A 115
HIS A  43
LEU A 138
SER A 139
SER A  81
 None
ZN  A 600 (-3.3A)
None
None
None
 1.12A 3bxoB-1hp1A:
undetectable		 3bxoB-1hp1A:
20.08
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.
1u6g TIP120 PROTEIN

(Homo sapiens) 		PF08623
(TIP120) 		5 ALA C 754
GLY C 750
HIS C 707
LEU C 756
MET C 711
 None
 1.47A 3bxoB-1u6gC:
undetectable		 3bxoB-1u6gC:
10.77
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		6 ALA A  46
GLY A  48
SER A  69
MET A  72
ARG A  95
SER A 112
 SAM  A 302 (-3.4A)
SAM  A 302 (-3.6A)
SAM  A 302 (-4.7A)
SAM  A 302 (-3.9A)
None
SAM  A 302 (-3.3A)
 0.76A 3bxoB-1ve3A:
19.4		 3bxoB-1ve3A:
25.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1wzn SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		6 ALA A  49
GLY A  51
LEU A  71
MET A  75
PHE A 113
TYR A 118
 SAH  A1001 (-3.4A)
SAH  A1001 (-3.1A)
SAH  A1001 (-3.9A)
SAH  A1001 (-4.4A)
None
SAH  A1001 ( 4.6A)
 0.53A 3bxoB-1wznA:
25.0		 3bxoB-1wznA:
30.15
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.
1y8c S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF13649
(Methyltransf_25) 		7 ALA A  46
GLY A  48
LEU A  68
SER A  69
MET A  72
SER A 112
TYR A 115
 None
 0.55A 3bxoB-1y8cA:
26.2		 3bxoB-1y8cA:
23.31
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.
2dgd 223AA LONG
HYPOTHETICAL
ARYLMALONATE
DECARBOXYLASE

(Sulfurisphaera
tokodaii) 		no annotation 5 ALA A 204
LEU A 102
SER A  98
SER A 201
TYR A 176
 None
 1.44A 3bxoB-2dgdA:
2.0		 3bxoB-2dgdA:
21.27
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.
2fqx MEMBRANE LIPOPROTEIN
TMPC

(Treponema
pallidum) 		PF02608
(Bmp) 		5 GLY A 123
LEU A 130
SER A 128
ARG A 311
PHE A 286
 None
 1.27A 3bxoB-2fqxA:
3.2		 3bxoB-2fqxA:
24.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2odf HYPOTHETICAL PROTEIN
ATU2144

(Agrobacterium
fabrum) 		PF05013
(FGase) 		5 ALA A  56
LEU A  52
SER A  53
SER A 103
TYR A 106
 None
 1.17A 3bxoB-2odfA:
undetectable		 3bxoB-2odfA:
26.28
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.
2pb7 E3 UBIQUITIN-PROTEIN
LIGASE UHRF1

(Homo sapiens) 		PF02182
(SAD_SRA) 		5 ALA A 457
GLY A 451
HIS A 442
LEU A 510
SER A 453
 None
 1.13A 3bxoB-2pb7A:
undetectable		 3bxoB-2pb7A:
23.44
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.
2pb7 E3 UBIQUITIN-PROTEIN
LIGASE UHRF1

(Homo sapiens) 		PF02182
(SAD_SRA) 		5 ALA A 457
GLY A 451
HIS A 442
LEU A 510
TYR A 578
 None
 1.35A 3bxoB-2pb7A:
undetectable		 3bxoB-2pb7A:
23.44
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.
2v7g UROCANATE HYDRATASE

(Pseudomonas
putida) 		PF01175
(Urocanase)
PF17391
(Urocanase_N)
PF17392
(Urocanase_C) 		5 GLY A 493
HIS A 490
ARG A 351
PHE A 498
SER A 452
 NAD  A3001 (-3.1A)
None
None
None
None
 1.48A 3bxoB-2v7gA:
8.3		 3bxoB-2v7gA:
18.95
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.
2zkg E3 UBIQUITIN-PROTEIN
LIGASE UHRF1

(Mus musculus) 		PF02182
(SAD_SRA) 		5 ALA A 462
GLY A 456
HIS A 447
LEU A 515
TYR A 582
 None
 1.32A 3bxoB-2zkgA:
undetectable		 3bxoB-2zkgA:
20.70
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.
3acz METHIONINE
GAMMA-LYASE

(Entamoeba
histolytica) 		PF01053
(Cys_Met_Meta_PP) 		5 ALA A  79
GLY A 216
HIS A 201
LEU A 239
SER A 238
 None
 1.41A 3bxoB-3aczA:
undetectable		 3bxoB-3aczA:
22.74
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.
3awk CHALCONE
SYNTHASE-LIKE
POLYKETIDE SYNTHASE

(Huperzia
serrata) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ALA A 229
LEU A 353
SER A 351
MET A 347
SER A  35
 None
 1.47A 3bxoB-3awkA:
undetectable		 3bxoB-3awkA:
22.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bxo N,N-DIMETHYLTRANSFER
ASE

(Streptomyces
venezuelae) 		PF13649
(Methyltransf_25) 		12 ALA A  46
GLY A  48
HIS A  52
LEU A  68
SER A  69
MET A  72
MET A  90
ARG A  91
MET A 105
PHE A 106
SER A 108
TYR A 111
 SAM  A 238 (-3.2A)
SAM  A 238 ( 3.7A)
SAM  A 238 (-4.1A)
SAM  A 238 (-3.9A)
SAM  A 238 (-4.6A)
SAM  A 238 (-4.2A)
SAM  A 238 (-4.4A)
SAM  A 238 (-4.1A)
None
UPP  A 239 ( 3.6A)
SAM  A 238 (-3.2A)
SAM  A 238 ( 4.7A)
 0.31A 3bxoB-3bxoA:
42.0		 3bxoB-3bxoA:
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13649
(Methyltransf_25) 		7 GLY A  42
LEU A  61
SER A  62
MET A  65
MET A  87
ARG A  88
SER A 105
 None
 0.78A 3bxoB-3d2lA:
26.3		 3bxoB-3d2lA:
26.74
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13649
(Methyltransf_25) 		6 GLY A  42
LEU A  61
SER A  62
MET A  87
SER A 105
TYR A 108
 None
 0.68A 3bxoB-3d2lA:
26.3		 3bxoB-3d2lA:
26.74
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.
3dwh E3 UBIQUITIN-PROTEIN
LIGASE UHRF1

(Homo sapiens) 		PF02182
(SAD_SRA) 		5 ALA A 457
GLY A 451
HIS A 442
LEU A 510
TYR A 578
 None
 1.35A 3bxoB-3dwhA:
undetectable		 3bxoB-3dwhA:
22.44
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.
3fpz THIAZOLE
BIOSYNTHETIC ENZYME

(Saccharomyces
cerevisiae) 		PF01946
(Thi4) 		5 ALA A  80
GLY A 313
HIS A 315
LEU A  78
SER A  75
 None
None
None
None
AHZ  A1100 (-3.6A)
 1.41A 3bxoB-3fpzA:
2.3		 3bxoB-3fpzA:
22.52
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.
3g2p PCZA361.24

(Amycolatopsis
orientalis) 		PF13649
(Methyltransf_25) 		6 ALA A  71
GLY A  73
LEU A  93
SER A  94
MET A 123
SER A 141
 SAH  A 500 (-3.1A)
SAH  A 500 (-3.2A)
SAH  A 500 (-3.6A)
SAH  A 500 ( 4.9A)
SAH  A 500 (-4.3A)
SAH  A 500 (-3.0A)
 0.59A 3bxoB-3g2pA:
18.9		 3bxoB-3g2pA:
29.17
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.
3g5l PUTATIVE
S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Listeria
monocytogenes) 		PF13649
(Methyltransf_25) 		6 GLY A  52
HIS A  56
LEU A  73
SER A  74
MET A  77
TYR A 118
 None
 0.73A 3bxoB-3g5lA:
15.4		 3bxoB-3g5lA:
23.79
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.
3h1l MITOCHONDRIAL
UBIQUINOL-CYTOCHROME
-C REDUCTASE COMPLEX
CORE PROTEIN I

(Gallus gallus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 ALA A 254
GLY A 321
LEU A 422
ARG A 242
PHE A 307
 None
 1.48A 3bxoB-3h1lA:
undetectable		 3bxoB-3h1lA:
19.46
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.
3htv D-ALLOSE KINASE

(Escherichia
coli) 		PF00480
(ROK) 		5 ALA A 293
GLY A  10
HIS A  31
LEU A 295
PHE A 286
 None
 1.42A 3bxoB-3htvA:
undetectable		 3bxoB-3htvA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF10
SMALL NUCLEAR
RIBONUCLEOPROTEIN SM
D3

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF16004
(EFTUD2)
PF01423
(LSM) 		5 ALA B 433
GLY B 327
LEU B 430
ARG D  96
PHE B 438
 None
 1.36A 3bxoB-3jb9B:
undetectable		 3bxoB-3jb9B:
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.
3krc GERANYL DIPHOSPHATE
SYNTHASE LARGE
SUBUNIT

(Mentha x
piperita) 		PF00348
(polyprenyl_synt) 		5 ALA A 109
GLY A 105
MET A  81
SER A  34
TYR A  37
 None
 1.43A 3bxoB-3krcA:
undetectable		 3bxoB-3krcA:
22.03
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.
3mso STEROID
DELTA-ISOMERASE

(Pseudomonas
aeruginosa) 		PF12680
(SnoaL_2) 		5 ALA A 124
GLY A 126
MET A 129
ARG A  89
MET A 119
 None
 1.46A 3bxoB-3msoA:
2.3		 3bxoB-3msoA:
22.13
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.
3pic CIP2

(Trichoderma
reesei) 		no annotation 5 ALA A 304
GLY A 305
LEU A 376
SER A 302
SER A 313
 None
 1.41A 3bxoB-3picA:
undetectable		 3bxoB-3picA:
20.86
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.
3pv2 DEGQ

(Legionella
fallonii) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 ALA A 283
HIS A 344
LEU A 334
SER A 335
ARG A 327
 None
 1.32A 3bxoB-3pv2A:
undetectable		 3bxoB-3pv2A:
20.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		11 ALA A  58
GLY A  60
HIS A  64
LEU A  80
SER A  81
MET A  84
MET A 102
ARG A 103
MET A 117
PHE A 118
SER A 120
 SAH  A 263 (-3.5A)
SAH  A 263 (-3.3A)
SAH  A 263 (-4.3A)
SAH  A 263 (-3.8A)
SAH  A 263 (-4.7A)
SAH  A 263 (-4.5A)
SAH  A 263 (-4.5A)
SAH  A 263 ( 4.7A)
None
T3Q  A 301 ( 3.2A)
SAH  A 263 (-3.3A)
 0.55A 3bxoB-3px2A:
36.9		 3bxoB-3px2A:
59.92
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 5 ALA L 385
GLY L 395
LEU L 389
PHE L 340
SER L 464
 None
None
None
LFA  L 616 (-4.4A)
None
 1.33A 3bxoB-3rkoL:
undetectable		 3bxoB-3rkoL:
16.11
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.
3slc ACETATE KINASE

(Salmonella
enterica) 		PF00871
(Acetate_kinase) 		5 GLY A 180
HIS A 182
ARG A 221
SER A 218
TYR A 317
 None
 1.26A 3bxoB-3slcA:
undetectable		 3bxoB-3slcA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vc1 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
coelicolor) 		PF08241
(Methyltransf_11) 		5 GLY A 107
HIS A  50
LEU A 128
SER A 129
TYR A  28
 SAH  A 302 (-3.3A)
SAH  A 302 ( 3.8A)
SAH  A 302 (-4.1A)
None
None
 1.45A 3bxoB-3vc1A:
15.7		 3bxoB-3vc1A:
22.08
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.
3vn4 A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 13

(Homo sapiens) 		PF00090
(TSP_1) 		5 GLY A 479
LEU A 521
SER A 520
ARG A 398
MET A 486
 None
None
None
BGC  A 904 (-4.1A)
None
 1.04A 3bxoB-3vn4A:
undetectable		 3bxoB-3vn4A:
22.30
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.
3wo6 MEMBRANE PROTEIN
INSERTASE YIDC 2

(Bacillus
halodurans) 		PF02096
(60KD_IMP) 		5 ALA A  53
GLY A  58
LEU A  55
PHE A 164
SER A  63
 None
 1.47A 3bxoB-3wo6A:
undetectable		 3bxoB-3wo6A:
19.47
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.
4f85 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
lasaliensis) 		PF02353
(CMAS) 		5 GLY A 115
HIS A  58
LEU A 136
SER A 137
MET A 164
 None
 1.39A 3bxoB-4f85A:
16.3		 3bxoB-4f85A:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f85 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
lasaliensis) 		PF02353
(CMAS) 		5 GLY A 115
LEU A 136
MET A 164
SER A 182
TYR A 185
 None
 0.91A 3bxoB-4f85A:
16.3		 3bxoB-4f85A:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f85 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
lasaliensis) 		PF02353
(CMAS) 		5 GLY A 115
LEU A 136
SER A 137
MET A 164
TYR A 185
 None
 0.83A 3bxoB-4f85A:
16.3		 3bxoB-4f85A:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gyo RESPONSE REGULATOR
ASPARTATE
PHOSPHATASE J

(Bacillus
subtilis) 		PF13424
(TPR_12) 		5 HIS A 151
LEU A 166
SER A 163
MET A 159
ARG A 179
 None
 1.48A 3bxoB-4gyoA:
undetectable		 3bxoB-4gyoA:
18.30
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.
4kvx N-TERMINAL
ACETYLTRANSFERASE A
COMPLEX CATALYTIC
SUBUNIT ARD1

(Schizosaccharomyces
pombe) 		PF00583
(Acetyltransf_1) 		5 ALA A  58
GLY A  71
LEU A 110
SER A 109
SER A  95
 None
None
ACO  A 201 ( 3.8A)
None
None
 1.32A 3bxoB-4kvxA:
2.3		 3bxoB-4kvxA:
20.44
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.
4lz6 BH2163 PROTEIN

(Bacillus
halodurans) 		PF01554
(MatE) 		5 ALA A  93
SER A  82
ARG A  88
PHE A 217
SER A 225
 None
 1.45A 3bxoB-4lz6A:
undetectable		 3bxoB-4lz6A:
19.64
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.
4n03 ABC-TYPE
BRANCHED-CHAIN AMINO
ACID TRANSPORT
SYSTEMS PERIPLASMIC
COMPONENT-LIKE
PROTEIN

(Thermomonospora
curvata) 		PF13458
(Peripla_BP_6) 		5 ALA A 202
GLY A 200
MET A 170
PHE A 194
SER A 247
 None
 1.20A 3bxoB-4n03A:
5.2		 3bxoB-4n03A:
20.88
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.
4ono BETA-2-MICROGLOBULIN
/T-CELL SURFACE
GLYCOPROTEIN
CD1C/T-CELL SURFACE
GLYCOPROTEIN CD1B
CHIMERIC PROTEIN

(Homo sapiens) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		5 GLY A 145
LEU A  54
SER A  55
ARG A 140
PHE A 185
 PMK  A 401 (-3.1A)
None
None
None
PMK  A 401 (-3.7A)
 1.24A 3bxoB-4onoA:
undetectable		 3bxoB-4onoA:
21.86
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.
4pw5 E3 UBIQUITIN-PROTEIN
LIGASE UHRF2

(Homo sapiens) 		PF02182
(SAD_SRA) 		5 ALA A 486
GLY A 480
HIS A 471
LEU A 539
TYR A 608
 None
 1.37A 3bxoB-4pw5A:
undetectable		 3bxoB-4pw5A:
20.08
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.
4s17 GLUTAMINE SYNTHETASE

(Bifidobacterium
adolescentis) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		5 ALA A 116
GLY A 114
LEU A 120
PHE A 378
SER A 382
 None
 0.93A 3bxoB-4s17A:
undetectable		 3bxoB-4s17A:
19.18
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.
4w1w ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00202
(Aminotran_3) 		5 ALA A 226
GLY A 227
HIS A 158
ARG A 400
TYR A  25
 3G8  A 502 ( 4.3A)
None
None
3G8  A 502 (-3.7A)
3G8  A 502 (-3.5A)
 1.47A 3bxoB-4w1wA:
2.1		 3bxoB-4w1wA:
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.
4z3n PUTATIVE DRUG/SODIUM
ANTIPORTER

(Escherichia
coli) 		PF01554
(MatE) 		5 ALA A 446
GLY A 442
HIS A 413
LEU A 448
SER A 389
 None
None
OLC  A 501 (-4.2A)
OLC  A 505 ( 4.7A)
None
 1.03A 3bxoB-4z3nA:
undetectable		 3bxoB-4z3nA:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zrw MINCLE PROTEIN

(Bos taurus) 		PF00059
(Lectin_C) 		5 ALA A 102
LEU A 104
PHE A 197
SER A  99
TYR A 137
 None
 1.44A 3bxoB-4zrwA:
undetectable		 3bxoB-4zrwA:
20.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5bsz N-METHYLTRANSFERASE

(Streptoalloteichus
sp. ATCC 53650) 		PF13649
(Methyltransf_25) 		8 ALA A  53
GLY A  55
HIS A  59
LEU A  75
SER A  76
MET A  79
MET A  97
SER A 115
 SAH  A 301 (-3.3A)
SAH  A 301 ( 3.7A)
SAH  A 301 (-4.2A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.6A)
SAH  A 301 ( 4.4A)
SAH  A 301 (-3.8A)
SAH  A 301 (-3.5A)
 0.59A 3bxoB-5bszA:
30.6		 3bxoB-5bszA:
50.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5bsz N-METHYLTRANSFERASE

(Streptoalloteichus
sp. ATCC 53650) 		PF13649
(Methyltransf_25) 		7 GLY A  55
HIS A  59
LEU A  75
SER A  76
MET A  79
SER A 115
TYR A 118
 SAH  A 301 ( 3.7A)
SAH  A 301 (-4.2A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.6A)
SAH  A 301 ( 4.4A)
SAH  A 301 (-3.5A)
SAH  A 301 (-3.7A)
 0.81A 3bxoB-5bszA:
30.6		 3bxoB-5bszA:
50.20
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.
5cay ENVELOPE
GLYCOPROTEIN GP120
CORE FROM ST STRAIN
OF HIV-2

(Human
immunodeficiency
virus 2) 		PF00516
(GP120) 		5 ALA G 282
GLY G 279
LEU G 301
SER G 465
TYR G 287
 None
 1.38A 3bxoB-5cayG:
undetectable		 3bxoB-5cayG:
19.35
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.
5dl7 PORIN

(Acinetobacter
baumannii) 		PF03573
(OprD) 		5 ALA A 199
GLY A 187
HIS A 201
LEU A 197
SER A 189
 None
 1.50A 3bxoB-5dl7A:
undetectable		 3bxoB-5dl7A:
19.24
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.
5dny DNA DOUBLE-STRAND
BREAK REPAIR PROTEIN
MRE11

(Methanocaldococcus
jannaschii) 		PF00149
(Metallophos) 		5 ALA A   7
GLY A 185
HIS A 188
LEU A  45
TYR A 225
 None
None
MG  A 401 (-3.4A)
None
None
 1.38A 3bxoB-5dnyA:
undetectable		 3bxoB-5dnyA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e66 HEMAGGLUTININ-ESTERA
SE

(Influenza D
virus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		5 ALA A  43
GLY A  42
SER A 369
PHE A 344
TYR A 113
 None
 1.33A 3bxoB-5e66A:
undetectable		 3bxoB-5e66A:
20.98
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.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		5 ALA A  67
GLY A  69
SER A  90
MET A  93
SER A 135
 SAH  A 301 (-3.9A)
SAH  A 301 (-3.3A)
SAH  A 301 ( 4.9A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.1A)
 0.56A 3bxoB-5h02A:
22.9		 3bxoB-5h02A:
23.26
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.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		5 GLY A  69
SER A  90
MET A  93
ARG A 116
SER A 135
 SAH  A 301 (-3.3A)
SAH  A 301 ( 4.9A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.2A)
SAH  A 301 (-3.1A)
 0.63A 3bxoB-5h02A:
22.9		 3bxoB-5h02A:
23.26
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.
5je3 METHYL TRANSFERASE

(Burkholderia
glumae) 		PF13847
(Methyltransf_31) 		5 ALA A  47
GLY A  49
SER A  71
MET A  74
TYR A 116
 SAH  A 301 (-3.2A)
SAH  A 301 (-3.6A)
SAH  A 301 ( 4.8A)
SAH  A 301 ( 4.5A)
SAH  A 301 (-4.0A)
 0.68A 3bxoB-5je3A:
18.9		 3bxoB-5je3A:
24.54
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.
5wx3 ALKYLDIKETIDE-COA
SYNTHASE

(Tetradium
ruticarpum) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ALA A 213
GLY A 212
LEU A 337
SER A 335
MET A 331
 None
 1.28A 3bxoB-5wx3A:
undetectable		 3bxoB-5wx3A:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xbl CRISPR-ASSOCIATED
ENDONUCLEASE
CAS9/CSN1

(Streptococcus
pyogenes) 		PF13395
(HNH_4)
PF16592
(Cas9_REC)
PF16593
(Cas9-BH)
PF16595
(Cas9_PI) 		5 HIS A1262
LEU A1087
SER A1088
ARG A 967
PHE A1235
 None
 1.49A 3bxoB-5xblA:
undetectable		 3bxoB-5xblA:
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.
6d6k POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Acinetobacter
baumannii) 		no annotation 5 GLY A 465
SER A 439
MET A 442
ARG A 317
MET A 533
 None
 1.41A 3bxoB-6d6kA:
undetectable		 3bxoB-6d6kA:
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.
6ei3 PROTON-DEPENDENT
OLIGOPEPTIDE
TRANSPORTER FAMILY
PROTEIN

(Xanthomonas
campestris) 		no annotation 5 ALA A 186
GLY A 188
HIS A 105
LEU A 181
MET A  36
 None
78M  A 603 ( 4.4A)
None
78M  A 611 ( 4.7A)
None
 1.18A 3bxoB-6ei3A:
undetectable		 3bxoB-6ei3A:
19.44
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.
6fb3 TENEURIN-2

(Gallus gallus) 		no annotation 5 GLY A1905
LEU A1634
SER A1635
SER A1659
TYR A1643
 None
 1.41A 3bxoB-6fb3A:
undetectable		 3bxoB-6fb3A:
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.
1eak 72 KDA TYPE IV
COLLAGENASE

(Homo sapiens) 		PF00040
(fn2)
PF00413
(Peptidase_M10)
PF01471
(PG_binding_1) 		3 TYR A 445
GLU A 412
ASP A 106
 None
 0.85A 3bxoB-1eakA:
undetectable		 3bxoB-1eakA:
19.10
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.
1ikp EXOTOXIN A

(Pseudomonas
aeruginosa) 		PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target) 		3 TYR A  87
GLU A 136
ASP A 139
 None
 0.86A 3bxoB-1ikpA:
2.6		 3bxoB-1ikpA:
18.92
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.
1iyx ENOLASE

(Enterococcus
hirae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 TYR A   7
GLU A  10
ASP A  54
 GOL  A2002 (-3.5A)
None
None
 0.82A 3bxoB-1iyxA:
undetectable		 3bxoB-1iyxA:
20.97
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.
1j0a 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
DEAMINASE

(Pyrococcus
horikoshii) 		PF00291
(PALP) 		3 TYR A 251
GLU A 247
ASP A 208
 None
 0.74A 3bxoB-1j0aA:
3.4		 3bxoB-1j0aA:
22.99
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.
1k72 ENDOGLUCANASE 9G

([Clostridium]
cellulolyticum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		3 TYR A 341
GLU A 266
ASP A 212
 None
None
CA  A 779 (-2.3A)
 0.87A 3bxoB-1k72A:
undetectable		 3bxoB-1k72A:
17.40
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 TYR A  76
GLU A  45
ASP A  83
 None
 0.87A 3bxoB-1kqfA:
undetectable		 3bxoB-1kqfA:
13.15
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.
1nhc POLYGALACTURONASE I

(Aspergillus
niger) 		PF00295
(Glyco_hydro_28) 		3 TYR A 267
GLU A 360
ASP A 357
 None
 0.89A 3bxoB-1nhcA:
undetectable		 3bxoB-1nhcA:
21.97
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.
1pd1 PROTEIN TRANSPORT
PROTEIN SEC24

(Saccharomyces
cerevisiae) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 TYR A 872
GLU A 543
ASP A 591
 None
 0.88A 3bxoB-1pd1A:
undetectable		 3bxoB-1pd1A:
15.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		3 TYR A 180
GLU A 237
ASP A 482
 None
I40  A 997 (-4.2A)
None
 0.66A 3bxoB-1qonA:
undetectable		 3bxoB-1qonA:
18.82
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.
1qzz ACLACINOMYCIN-10-HYD
ROXYLASE

(Streptomyces
purpurascens) 		PF00891
(Methyltransf_2) 		3 TYR A 171
GLU A 213
ASP A 240
 ACT  A 421 ( 4.2A)
SAM  A 635 (-2.9A)
SAM  A 635 (-3.7A)
 0.40A 3bxoB-1qzzA:
17.6		 3bxoB-1qzzA:
24.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s1d APYRASE

(Homo sapiens) 		PF06079
(Apyrase) 		3 TYR A 237
GLU A 145
ASP A 111
 GP2  A4001 (-4.2A)
GP2  A4001 ( 2.7A)
None
 0.82A 3bxoB-1s1dA:
undetectable		 3bxoB-1s1dA:
25.30
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.
1sr4 CYTOLETHAL
DISTENDING TOXIN
PROTEIN B

([Haemophilus]
ducreyi) 		PF03372
(Exo_endo_phos) 		3 TYR B 108
GLU B  66
ASP B 273
 None
 0.87A 3bxoB-1sr4B:
undetectable		 3bxoB-1sr4B:
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.
1u4q SPECTRIN ALPHA
CHAIN, BRAIN

(Gallus gallus) 		PF00435
(Spectrin) 		3 TYR A1877
GLU A1888
ASP A1965
 None
 0.60A 3bxoB-1u4qA:
undetectable		 3bxoB-1u4qA:
23.38
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.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis) 		PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C) 		3 TYR A 326
GLU A 431
ASP A 510
 ACR  A3000 (-3.9A)
ACR  A3000 (-3.5A)
None
 0.65A 3bxoB-1ulvA:
2.9		 3bxoB-1ulvA:
14.65
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.
1zy9 ALPHA-GALACTOSIDASE

(Thermotoga
maritima) 		PF02065
(Melibiase) 		3 TYR A 448
GLU A 459
ASP A 462
 None
 0.75A 3bxoB-1zy9A:
2.3		 3bxoB-1zy9A:
18.94
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.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 TYR A 670
GLU A 205
ASP A 739
 None
008  A1767 (-3.9A)
None
 0.75A 3bxoB-2bucA:
3.7		 3bxoB-2bucA:
15.14
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.
2cya TYROSYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		3 TYR A  39
GLU A  43
ASP A  82
 None
 0.78A 3bxoB-2cyaA:
3.4		 3bxoB-2cyaA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cyc TYROSYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00579
(tRNA-synt_1b) 		3 TYR A  37
GLU A  41
ASP A  81
 TYR  A 701 (-4.6A)
TYR  A 701 ( 4.3A)
None
 0.82A 3bxoB-2cycA:
undetectable		 3bxoB-2cycA:
21.96
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.
2f42 STIP1 HOMOLOGY AND
U-BOX CONTAINING
PROTEIN 1

(Danio rerio) 		PF04564
(U-box) 		3 TYR A 149
GLU A 157
ASP A 164
 None
 0.58A 3bxoB-2f42A:
undetectable		 3bxoB-2f42A:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 TYR A 670
GLU A 205
ASP A 739
 None
ACF  A 800 (-3.6A)
None
 0.81A 3bxoB-2g5tA:
undetectable		 3bxoB-2g5tA:
15.49
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.
2i15 HYPOTHETICAL PROTEIN
MG296 HOMOLOG

(Mycoplasma
pneumoniae) 		PF09644
(Mg296) 		3 TYR A  94
GLU A  43
ASP A  45
 None
 0.89A 3bxoB-2i15A:
undetectable		 3bxoB-2i15A:
17.62
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.
2j04 HYPOTHETICAL PROTEIN
YPL007C

(Saccharomyces
cerevisiae) 		PF12660
(zf-TFIIIC) 		3 TYR A 169
GLU A 141
ASP A 193
 None
 0.89A 3bxoB-2j04A:
undetectable		 3bxoB-2j04A:
16.35
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.
2j5c 1,8-CINEOLE SYNTHASE

(Salvia
fruticosa) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 TYR A 315
GLU A 330
ASP A 400
 None
 0.61A 3bxoB-2j5cA:
undetectable		 3bxoB-2j5cA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nx9 OXALOACETATE
DECARBOXYLASE 2,
SUBUNIT ALPHA

(Vibrio cholerae) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		3 TYR A 241
GLU A 309
ASP A 322
 None
 0.77A 3bxoB-2nx9A:
undetectable		 3bxoB-2nx9A:
19.96
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.
2o4v PORIN P

(Pseudomonas
aeruginosa) 		PF07396
(Porin_O_P) 		3 TYR A 207
GLU A 286
ASP A 288
 None
 0.81A 3bxoB-2o4vA:
undetectable		 3bxoB-2o4vA:
21.14
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.
2rjb UNCHARACTERIZED
PROTEIN

(Shigella
flexneri) 		PF07063
(DUF1338) 		3 TYR A  29
GLU A 292
ASP A 387
 None
 0.86A 3bxoB-2rjbA:
undetectable		 3bxoB-2rjbA:
19.56
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.
2uvj ABC TYPE PERIPLASMIC
SUGAR-BINDING
PROTEIN

(Yersinia
enterocolitica) 		PF13416
(SBP_bac_8) 		3 TYR A 229
GLU A 187
ASP A  68
 None
ADA  A1431 (-3.2A)
None
 0.66A 3bxoB-2uvjA:
undetectable		 3bxoB-2uvjA:
19.35
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 TYR A 614
GLU A 493
ASP A 498
 None
 0.83A 3bxoB-2wanA:
undetectable		 3bxoB-2wanA:
14.22
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.
2wqs AGGLUTININ RECEPTOR

(Streptococcus
gordonii) 		PF16364
(Antigen_C) 		3 TYR A1104
GLU A1301
ASP A1364
 None
 0.82A 3bxoB-2wqsA:
undetectable		 3bxoB-2wqsA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xd3 MALTOSE/MALTODEXTRIN
-BINDING PROTEIN

(Streptococcus
pneumoniae) 		PF13416
(SBP_bac_8) 		3 TYR A 152
GLU A 147
ASP A 102
 None
GLC  A1418 (-2.9A)
GLC  A1419 (-2.8A)
 0.80A 3bxoB-2xd3A:
undetectable		 3bxoB-2xd3A:
19.13
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.
2xy4 ZINC ABC
TRANSPORTER,
PERIPLASMIC
ZINC-BINDING PROTEIN

(Salmonella
enterica) 		PF01297
(ZnuA) 		3 TYR A 207
GLU A 260
ASP A  55
 None
 0.82A 3bxoB-2xy4A:
undetectable		 3bxoB-2xy4A:
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.
2y7c TYPE-1 RESTRICTION
ENZYME ECOKI
SPECIFICITY PROTEIN
GENE 0.3 PROTEIN

(Escherichia
coli;
Escherichia
virus T7) 		PF01420
(Methylase_S)
PF08684
(ocr) 		3 TYR A  27
GLU D  62
ASP D  58
 None
 0.78A 3bxoB-2y7cA:
undetectable		 3bxoB-2y7cA:
20.43
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.
2z65 TOLL-LIKE RECEPTOR
4, VARIABLE
LYMPHOCYTE RECEPTOR
B
LYMPHOCYTE ANTIGEN
96

(Eptatretus
burgeri;
Homo sapiens;
Homo sapiens) 		PF11921
(DUF3439)
PF13306
(LRR_5)
PF13855
(LRR_8)
PF02221
(E1_DerP2_DerF2) 		3 TYR C  36
GLU A  42
ASP A  60
 None
 0.78A 3bxoB-2z65C:
undetectable		 3bxoB-2z65C:
16.67
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.
2zxh TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME MNMG

(Aquifex
aeolicus) 		PF01134
(GIDA)
PF13932
(GIDA_assoc) 		3 TYR A 433
GLU A  63
ASP A 449
 None
 0.81A 3bxoB-2zxhA:
undetectable		 3bxoB-2zxhA:
17.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bxo N,N-DIMETHYLTRANSFER
ASE

(Streptomyces
venezuelae) 		PF13649
(Methyltransf_25) 		3 TYR A  21
GLU A  67
ASP A  89
 SAM  A 238 (-4.9A)
SAM  A 238 (-2.7A)
SAM  A 238 (-3.0A)
 0.19A 3bxoB-3bxoA:
42.0		 3bxoB-3bxoA:
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.
3deg GTP-BINDING PROTEIN
LEPA

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF06421
(LepA_C) 		3 TYR C 414
GLU C 109
ASP C  14
 None
 0.69A 3bxoB-3degC:
undetectable		 3bxoB-3degC:
20.26
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.
3e79 HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
hyorhinis) 		PF06646
(Mycoplasma_p37) 		3 TYR A 381
GLU A 308
ASP A 294
 None
TPP  A 551 ( 4.9A)
None
 0.82A 3bxoB-3e79A:
undetectable		 3bxoB-3e79A:
19.35
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.
3emq ENDO-1,4-BETA-XYLANA
SE

(Paenibacillus
barcinonensis) 		PF00331
(Glyco_hydro_10) 		3 TYR A 297
GLU A 241
ASP A 178
 None
HAH  A1000 (-3.0A)
None
 0.79A 3bxoB-3emqA:
undetectable		 3bxoB-3emqA:
21.11
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.
3hlz UNCHARACTERIZED
PROTEIN BT_1490

(Bacteroides
thetaiotaomicron) 		PF12712
(DUF3805)
PF12713
(DUF3806) 		3 TYR A  54
GLU A  62
ASP A  67
 None
 0.78A 3bxoB-3hlzA:
3.7		 3bxoB-3hlzA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ib7 ICC PROTEIN

(Mycobacterium
tuberculosis) 		PF00149
(Metallophos) 		3 TYR A 210
GLU A 184
ASP A 187
 None
 0.81A 3bxoB-3ib7A:
undetectable		 3bxoB-3ib7A:
25.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ipw HYDROLASE TATD
FAMILY PROTEIN

(Entamoeba
histolytica) 		PF01026
(TatD_DNase) 		3 TYR A  66
GLU A 263
ASP A 244
 None
 0.87A 3bxoB-3ipwA:
undetectable		 3bxoB-3ipwA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jd5 28S RIBOSOMAL
PROTEIN S27,
MITOCHONDRIAL

(Bos taurus) 		PF00333
(Ribosomal_S5)
PF03719
(Ribosomal_S5_C) 		3 TYR e 184
GLU e 200
ASP e 195
 None
 0.81A 3bxoB-3jd5e:
undetectable		 3bxoB-3jd5e:
21.96
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.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		3 TYR A1170
GLU A1220
ASP A1467
 None
WW2  A 193 ( 4.2A)
None
 0.84A 3bxoB-3k9bA:
undetectable		 3bxoB-3k9bA:
19.74
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.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		3 TYR A1170
GLU A1220
ASP A1470
 None
WW2  A 193 ( 4.2A)
None
 0.78A 3bxoB-3k9bA:
undetectable		 3bxoB-3k9bA:
19.74
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.
3kzw CYTOSOL
AMINOPEPTIDASE

(Staphylococcus
aureus) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		3 TYR A 358
GLU A 221
ASP A 216
 CL  A 496 ( 4.3A)
None
None
 0.79A 3bxoB-3kzwA:
undetectable		 3bxoB-3kzwA:
19.84
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.
3pqs TRANSFERRIN-BINDING
PROTEIN

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		3 TYR A  51
GLU A  40
ASP A  30
 None
 0.85A 3bxoB-3pqsA:
2.3		 3bxoB-3pqsA:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		3 TYR A  33
GLU A  79
ASP A 101
 SAH  A 263 (-4.6A)
SAH  A 263 (-2.7A)
SAH  A 263 (-3.5A)
 0.34A 3bxoB-3px2A:
36.9		 3bxoB-3px2A:
59.92
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.
3qom 6-PHOSPHO-BETA-GLUCO
SIDASE

(Lactobacillus
plantarum) 		PF00232
(Glyco_hydro_1) 		3 TYR A 168
GLU A  24
ASP A  68
 None
 0.83A 3bxoB-3qomA:
undetectable		 3bxoB-3qomA:
19.04
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.
3snh DYNAMIN-1

(Homo sapiens) 		PF00169
(PH)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		3 TYR A 600
GLU A 562
ASP A 555
 None
 0.76A 3bxoB-3snhA:
undetectable		 3bxoB-3snhA:
15.46
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.
3u4t TPR
REPEAT-CONTAINING
PROTEIN

(Cytophaga
hutchinsonii) 		PF07719
(TPR_2) 		3 TYR A 244
GLU A 303
ASP A 329
 None
 0.87A 3bxoB-3u4tA:
undetectable		 3bxoB-3u4tA:
21.20
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.
3uw2 PHOSPHOGLUCOMUTASE/P
HOSPHOMANNOMUTASE
FAMILY PROTEIN

(Burkholderia
thailandensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 TYR A  84
GLU A 326
ASP A 408
 None
 0.71A 3bxoB-3uw2A:
undetectable		 3bxoB-3uw2A:
21.70
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.
3zk4 DIPHOSPHONUCLEOTIDE
PHOSPHATASE 1

(Lupinus luteus) 		PF00149
(Metallophos)
PF14008
(Metallophos_C)
PF16656
(Pur_ac_phosph_N) 		3 TYR A 387
GLU A 348
ASP A 362
 None
 0.79A 3bxoB-3zk4A:
undetectable		 3bxoB-3zk4A:
16.94
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.
4a0l CULLIN-4B

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		3 TYR E 235
GLU E 225
ASP E 266
 None
 0.86A 3bxoB-4a0lE:
undetectable		 3bxoB-4a0lE:
15.32
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.
4a3r ENOLASE

(Bacillus
subtilis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 TYR A   8
GLU A  11
ASP A  55
 None
 0.78A 3bxoB-4a3rA:
undetectable		 3bxoB-4a3rA:
20.14
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.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		3 TYR W1001
GLU W 922
ASP W 984
 None
 0.83A 3bxoB-4f5xW:
undetectable		 3bxoB-4f5xW:
11.62
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.
4f8x ENDO-1,4-BETA-XYLANA
SE

(Penicillium
canescens) 		PF00331
(Glyco_hydro_10) 		3 TYR A 203
GLU A 270
ASP A  46
 None
 0.88A 3bxoB-4f8xA:
undetectable		 3bxoB-4f8xA:
24.63
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.
4fnm E3 ALPHA-ESTERASE-7
CARBOXYLESTERASE

(Lucilia cuprina) 		PF00135
(COesterase) 		3 TYR A 165
GLU A 217
ASP A 473
 None
DPF  A 601 ( 4.2A)
None
 0.79A 3bxoB-4fnmA:
undetectable		 3bxoB-4fnmA:
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.
4gpn 6-PHOSPHO-BETA-D-GLU
COSIDASE

(Streptococcus
mutans) 		PF00232
(Glyco_hydro_1) 		3 TYR A 164
GLU A  20
ASP A  64
 None
 0.83A 3bxoB-4gpnA:
undetectable		 3bxoB-4gpnA:
19.91
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.
4gqb PROTEIN ARGININE
N-METHYLTRANSFERASE
5

(Homo sapiens) 		PF05185
(PRMT5)
PF17285
(PRMT5_TIM)
PF17286
(PRMT5_C) 		3 TYR A 334
GLU A 392
ASP A 419
 0XU  A 701 (-4.6A)
0XU  A 701 (-2.9A)
0XU  A 701 (-2.9A)
 0.82A 3bxoB-4gqbA:
8.9		 3bxoB-4gqbA:
15.62
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.
4ipn 6-PHOSPHO-BETA-GLUCO
SIDASE

(Streptococcus
pneumoniae) 		PF00232
(Glyco_hydro_1) 		3 TYR B 159
GLU B  20
ASP B  59
 None
 0.85A 3bxoB-4ipnB:
undetectable		 3bxoB-4ipnB:
20.98
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.
4jeu SYNTAXIN-BINDING
PROTEIN 1

(Rattus
norvegicus) 		PF00995
(Sec1) 		3 TYR A 473
GLU A 302
ASP A 309
 None
 0.81A 3bxoB-4jeuA:
3.9		 3bxoB-4jeuA:
18.13
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.
4k0e HEAVY METAL CATION
TRICOMPONENT EFFLUX
PUMP ZNEA(CZCA-LIKE)

(Cupriavidus
metallidurans) 		PF00873
(ACR_tran) 		3 TYR A 140
GLU A 136
ASP A 658
 None
 0.77A 3bxoB-4k0eA:
undetectable		 3bxoB-4k0eA:
13.74
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.
4n8g TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		3 TYR A 252
GLU A 135
ASP A 129
 None
 0.84A 3bxoB-4n8gA:
undetectable		 3bxoB-4n8gA:
21.16
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.
4nk5 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Candidatus
Liberibacter
asiaticus) 		PF13561
(adh_short_C2) 		3 TYR A 177
GLU A 126
ASP A  68
 None
 0.61A 3bxoB-4nk5A:
5.3		 3bxoB-4nk5A:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oal CYTOKININ
DEHYDROGENASE 4

(Zea mays) 		PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind) 		3 TYR A 200
GLU A 244
ASP A 331
 None
 0.88A 3bxoB-4oalA:
undetectable		 3bxoB-4oalA:
21.46
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.
4ot1 ENVELOPE
GLYCOPROTEIN B

(Human
betaherpesvirus
5) 		PF17417
(Glycoprot_B_PH2) 		3 TYR A 415
GLU A 359
ASP A 362
 None
 0.78A 3bxoB-4ot1A:
undetectable		 3bxoB-4ot1A:
17.70
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.
4ox9 16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE

(Escherichia
coli) 		PF02390
(Methyltransf_4) 		3 TYR Y  51
GLU Y 136
ASP Y 181
 None
 0.78A 3bxoB-4ox9Y:
10.1		 3bxoB-4ox9Y:
21.13
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.
4pj6 LEUCYL-CYSTINYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		3 TYR A 495
GLU A 818
ASP A 810
 None
 0.81A 3bxoB-4pj6A:
undetectable		 3bxoB-4pj6A:
15.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4psp ALPHA-FUCOSIDASE
GH29

(Fusarium
graminearum) 		PF01120
(Alpha_L_fucos)
PF16757
(Fucosidase_C) 		3 TYR A   7
GLU A 266
ASP A  26
 None
 0.87A 3bxoB-4pspA:
undetectable		 3bxoB-4pspA:
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.
4r0g UNCHARACTERIZED
PROTEIN

(Legionella
pneumophila) 		no annotation 3 TYR A 206
GLU A 212
ASP A  14
 None
 0.88A 3bxoB-4r0gA:
undetectable		 3bxoB-4r0gA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rzm EPOXIDE HYDROLASE
LASB

(Streptomyces
lasaliensis) 		PF12680
(SnoaL_2) 		3 TYR A 269
GLU A 116
ASP A  33
 None
 0.86A 3bxoB-4rzmA:
2.0		 3bxoB-4rzmA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4url DNA TOPOISOMERASE
IV, B SUBUNIT

(Staphylococcus
aureus) 		PF00204
(DNA_gyraseB)
PF02518
(HATPase_c) 		3 TYR A 233
GLU A 219
ASP A 210
 None
 0.88A 3bxoB-4urlA:
undetectable		 3bxoB-4urlA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4urn DNA TOPOISOMERASE
IV, B SUBUNIT

(Staphylococcus
aureus) 		PF02518
(HATPase_c) 		3 TYR A 223
GLU A 219
ASP A 210
 None
 0.72A 3bxoB-4urnA:
undetectable		 3bxoB-4urnA:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wss HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		3 TYR A 307
GLU A 425
ASP A  17
 None
 0.80A 3bxoB-4wssA:
undetectable		 3bxoB-4wssA:
17.28
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.
4yt9 PEPTIDYLARGININE
DEIMINASE

(Porphyromonas
gingivalis) 		PF04371
(PAD_porph) 		3 TYR A 367
GLU A  62
ASP A 358
 None
 0.86A 3bxoB-4yt9A:
2.0		 3bxoB-4yt9A:
19.64
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.
5aor DOSAGE COMPENSATION
REGULATOR

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		3 TYR A1009
GLU A1025
ASP A 257
 None
 0.81A 3bxoB-5aorA:
4.3		 3bxoB-5aorA:
11.14
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.
5cqf L-LYSINE
6-MONOOXYGENASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13434
(K_oxygenase) 		3 TYR A 349
GLU A 215
ASP A 285
 None
 0.89A 3bxoB-5cqfA:
2.3		 3bxoB-5cqfA:
20.32
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.
5fei DISTAL TUBE PROTEIN

(Bacillus virus
phi29) 		PF16838
(Caud_tail_N) 		3 TYR A 330
GLU A 336
ASP A 339
 None
 0.85A 3bxoB-5feiA:
undetectable		 3bxoB-5feiA:
16.83
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.
5gol CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		no annotation 3 TYR A 121
GLU A 109
ASP A  24
 None
 0.72A 3bxoB-5golA:
undetectable		 3bxoB-5golA:
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.
5jbe INACTIVE
GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF02324
(Glyco_hydro_70) 		3 TYR A1182
GLU A1386
ASP A1015
 None
 0.88A 3bxoB-5jbeA:
2.3		 3bxoB-5jbeA:
14.59
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.
5k9h 0940_GH29

(unidentified) 		PF00754
(F5_F8_type_C)
PF01120
(Alpha_L_fucos) 		3 TYR A 286
GLU A 360
ASP A 362
 SCN  A 624 ( 4.7A)
None
None
 0.87A 3bxoB-5k9hA:
undetectable		 3bxoB-5k9hA:
14.45
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.
5koh NITROGENASE FEMO
BETA SUBUNIT PROTEIN
NIFK

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro)
PF11844
(DUF3364) 		3 TYR B 365
GLU B 447
ASP B 495
 None
 0.81A 3bxoB-5kohB:
3.5		 3bxoB-5kohB:
18.96
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.
5kov CAPSID POLYPROTEIN
VP90

(Mamastrovirus 1) 		PF12226
(Astro_capsid_p) 		3 TYR A 557
GLU A 561
ASP A 564
 None
 0.78A 3bxoB-5kovA:
undetectable		 3bxoB-5kovA:
21.58
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.
5lew DNA POLYMERASE III
SUBUNIT ALPHA

(Mycobacterium
tuberculosis) 		no annotation 3 TYR A 800
GLU A 808
ASP A 856
 None
 0.80A 3bxoB-5lewA:
undetectable		 3bxoB-5lewA:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m99 ALPHA-AMYLASE

(Thermotoga
petrophila) 		PF00128
(Alpha-amylase) 		3 TYR B 336
GLU B  34
ASP B 213
 None
None
EDO  B 616 ( 2.8A)
 0.70A 3bxoB-5m99B:
undetectable		 3bxoB-5m99B:
18.29
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.
5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC

(Pseudomonas
protegens) 		no annotation 3 TYR C 386
GLU C 309
ASP C 321
 None
 0.80A 3bxoB-5mg5C:
undetectable		 3bxoB-5mg5C:
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.
5mm2 CAPSID PROTEIN VP4B

(Nora virus) 		no annotation 3 TYR B 241
GLU B 232
ASP B 227
 None
 0.89A 3bxoB-5mm2B:
undetectable		 3bxoB-5mm2B:
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN2

(Saccharomyces
cerevisiae) 		PF01851
(PC_rep)
PF13646
(HEAT_2) 		3 TYR N 857
GLU N 669
ASP N 310
 None
 0.77A 3bxoB-5mpdN:
undetectable		 3bxoB-5mpdN:
14.45
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN5
26S PROTEASOME
REGULATORY SUBUNIT
RPN6

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01399
(PCI)
PF01399
(PCI) 		3 TYR Q 255
GLU Q 289
ASP P 154
 None
 0.60A 3bxoB-5mpdQ:
undetectable		 3bxoB-5mpdQ:
21.97
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.
5mz9 -

(-) 		no annotation 3 TYR A 510
GLU A 224
ASP A 723
 None
 0.78A 3bxoB-5mz9A:
undetectable		 3bxoB-5mz9A:
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 3 TYR B 638
GLU B 323
ASP B 374
 None
 0.81A 3bxoB-5swiB:
3.6		 3bxoB-5swiB:
16.29
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.
5szj MICAL
C-TERMINAL-LIKE
PROTEIN

(Homo sapiens) 		PF12130
(DUF3585) 		3 TYR B 603
GLU B 613
ASP B 661
 None
 0.88A 3bxoB-5szjB:
undetectable		 3bxoB-5szjB:
18.67
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.
5t03 MALTOSE BINDING
PROTEIN - HEPARAN
SULFATE
6-O-SULFOTRANSFERASE
ISOFORM 3 FUSION
PROTEIN

(Escherichia
coli;
Danio rerio) 		PF03567
(Sulfotransfer_2)
PF13416
(SBP_bac_8) 		3 TYR A1231
GLU A1200
ASP A1350
 None
 0.86A 3bxoB-5t03A:
undetectable		 3bxoB-5t03A:
16.62
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.
5tu0 LMO2125 PROTEIN

(Listeria
monocytogenes) 		PF13416
(SBP_bac_8) 		3 TYR A 148
GLU A 143
ASP A  99
 None
MAL  A 501 ( 4.2A)
MAL  A 501 (-3.8A)
 0.89A 3bxoB-5tu0A:
undetectable		 3bxoB-5tu0A:
20.57
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.
5tw1 DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Mycolicibacterium
smegmatis) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF10385
(RNA_pol_Rpb2_45) 		3 TYR C 569
GLU C 504
ASP C  50
 None
 0.85A 3bxoB-5tw1C:
undetectable		 3bxoB-5tw1C:
12.39
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.
5u4q DTDP-GLUCOSE
4,6-DEHYDRATASE

(Klebsiella
pneumoniae) 		PF16363
(GDP_Man_Dehyd) 		3 TYR A 219
GLU A 225
ASP A 232
 None
 0.89A 3bxoB-5u4qA:
6.7		 3bxoB-5u4qA:
22.59
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.
5uuu BETA-ADRENERGIC
RECEPTOR KINASE 1

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		3 TYR A 506
GLU A 239
ASP A 317
 None
QRW  A 601 (-3.9A)
None
 0.87A 3bxoB-5uuuA:
undetectable		 3bxoB-5uuuA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v7v ERAD-ASSOCIATED E3
UBIQUITIN-PROTEIN
LIGASE COMPONENT
HRD3

(Saccharomyces
cerevisiae) 		PF08238
(Sel1) 		3 TYR A 198
GLU A 552
ASP A 597
 None
 0.71A 3bxoB-5v7vA:
undetectable		 3bxoB-5v7vA:
15.08
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.
5v7v ERAD-ASSOCIATED E3
UBIQUITIN-PROTEIN
LIGASE COMPONENT
HRD3

(Saccharomyces
cerevisiae) 		PF08238
(Sel1) 		3 TYR A 507
GLU A 552
ASP A 597
 None
 0.85A 3bxoB-5v7vA:
undetectable		 3bxoB-5v7vA:
15.08
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 3 TYR A 933
GLU A 492
ASP A 602
 None
 0.51A 3bxoB-5wlhA:
undetectable		 3bxoB-5wlhA:
9.91