SIMILAR PATTERNS OF AMINO ACIDS FOR 3BXO_A_SAMA238_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.
1b6u P58 KILLER CELL
INHIBITORY RECEPTOR

(Homo sapiens) 		PF00047
(ig) 		5 ALA A  62
HIS A  55
LEU A  26
PHE A  34
LEU A  49
 None
 1.26A 3bxoA-1b6uA:
undetectable		 3bxoA-1b6uA:
20.51
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.
1bu8 PROTEIN (PANCREATIC
LIPASE RELATED
PROTEIN 2)

(Rattus
norvegicus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 GLY A 174
HIS A 151
LEU A 224
MET A 307
LEU A 327
 None
 1.12A 3bxoA-1bu8A:
undetectable		 3bxoA-1bu8A:
20.31
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.
1cj2 PROTEIN
(P-HYDROXYBENZOATE
HYDROXYLASE)

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		5 ALA A  10
GLY A   9
SER A  13
MET A 110
LEU A  40
 None
FAD  A 395 (-3.4A)
FAD  A 395 (-3.0A)
None
None
 1.04A 3bxoA-1cj2A:
undetectable		 3bxoA-1cj2A:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f0k UDP-N-ACETYLGLUCOSAM
INE-N-ACETYLMURAMYL-
(PENTAPEPTIDE)
PYROPHOSPHORYL-UNDEC
APRENOL
N-ACETYLGLUCOSAMINE
TRANSFERASE

(Escherichia
coli) 		PF03033
(Glyco_transf_28)
PF04101
(Glyco_tran_28_C) 		5 ALA A  25
GLY A  23
HIS A  54
PHE A  21
LEU A 168
 None
 1.34A 3bxoA-1f0kA:
4.3		 3bxoA-1f0kA:
19.89
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.
1h79 ANAEROBIC
RIBONUCLEOTIDE-TRIPH
OSPHATE REDUCTASE
LARGE CHAIN

(Escherichia
virus T4) 		PF13597
(NRDD) 		5 GLY A 502
HIS A 497
LEU A 399
SER A 398
LEU A 319
 None
 1.13A 3bxoA-1h79A:
undetectable		 3bxoA-1h79A:
17.17
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.
1h79 ANAEROBIC
RIBONUCLEOTIDE-TRIPH
OSPHATE REDUCTASE
LARGE CHAIN

(Escherichia
virus T4) 		PF13597
(NRDD) 		5 GLY A 503
HIS A 497
LEU A 399
SER A 398
LEU A 319
 None
 0.87A 3bxoA-1h79A:
undetectable		 3bxoA-1h79A:
17.17
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.
1h79 ANAEROBIC
RIBONUCLEOTIDE-TRIPH
OSPHATE REDUCTASE
LARGE CHAIN

(Escherichia
virus T4) 		PF13597
(NRDD) 		5 GLY A 503
HIS A 497
SER A 398
SER A 475
LEU A 319
 None
 0.99A 3bxoA-1h79A:
undetectable		 3bxoA-1h79A:
17.17
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.
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
 1.09A 3bxoA-1hp1A:
undetectable		 3bxoA-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.
1hpl LIPASE

(Equus caballus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 GLY A 174
HIS A 151
LEU A 224
MET A 307
LEU A 327
 None
 1.20A 3bxoA-1hplA:
undetectable		 3bxoA-1hplA:
18.10
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.
1led WEST-CENTRAL AFRICAN
LEGUME LECTIN IV

(Griffonia
simplicifolia) 		PF00139
(Lectin_legB) 		5 GLY A 194
LEU A 189
SER A 190
SER A 170
LEU A  80
 None
 1.26A 3bxoA-1ledA:
undetectable		 3bxoA-1ledA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1udx THE GTP-BINDING
PROTEIN OBG

(Thermus
thermophilus) 		PF01018
(GTP1_OBG)
PF01926
(MMR_HSR1)
PF09269
(DUF1967) 		5 ALA A 141
GLY A  18
ARG A 363
PHE A 138
TYR A 364
 None
 1.23A 3bxoA-1udxA:
undetectable		 3bxoA-1udxA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1urj MAJOR DNA-BINDING
PROTEIN

(Human
alphaherpesvirus
1) 		PF00747
(Viral_DNA_bp) 		5 ALA A 382
GLY A 534
SER A 378
SER A 676
LEU A 671
 None
 1.36A 3bxoA-1urjA:
undetectable		 3bxoA-1urjA:
12.57
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.
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)
 0.53A 3bxoA-1ve3A:
19.9		 3bxoA-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)
 0.46A 3bxoA-1wznA:
25.1		 3bxoA-1wznA:
30.15
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) 		5 ALA A  49
GLY A  51
MET A  75
PHE A 113
LEU A 127
 SAH  A1001 (-3.4A)
SAH  A1001 (-3.1A)
SAH  A1001 (-4.4A)
None
None
 1.29A 3bxoA-1wznA:
25.1		 3bxoA-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.
1xtp LMAJ004091AAA

(Leishmania
major) 		PF05891
(Methyltransf_PK) 		5 GLY A 103
MET A 128
MET A 149
TYR A 170
LEU A 171
 SAI  A 401 (-3.2A)
SAI  A 401 ( 4.9A)
SAI  A 401 (-4.4A)
SAI  A 401 (-3.8A)
None
 0.74A 3bxoA-1xtpA:
16.4		 3bxoA-1xtpA:
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.
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
 0.50A 3bxoA-1y8cA:
26.4		 3bxoA-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.
1zb1 BRO1 PROTEIN

(Saccharomyces
cerevisiae) 		PF03097
(BRO1) 		5 GLY A  82
LEU A  88
SER A  86
PHE A  79
LEU A 362
 None
 1.35A 3bxoA-1zb1A:
undetectable		 3bxoA-1zb1A:
21.55
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.
2cul GLUCOSE-INHIBITED
DIVISION PROTEIN
A-RELATED PROTEIN,
PROBABLE
OXIDOREDUCTASE

(Thermus
thermophilus) 		PF01134
(GIDA) 		5 ALA A 120
GLY A 122
PHE A  13
SER A  14
LEU A 223
 None
FAD  A 301 (-3.2A)
FAD  A 301 (-4.8A)
FAD  A 301 (-2.7A)
None
 1.13A 3bxoA-2culA:
3.1		 3bxoA-2culA:
26.40
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.
2l3y INTERLEUKIN-6

(Mus musculus) 		PF00489
(IL6) 		5 LEU A  96
SER A  94
SER A 101
TYR A 102
LEU A 103
 None
 1.20A 3bxoA-2l3yA:
undetectable		 3bxoA-2l3yA:
17.77
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.
2n47 SLR1183 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF13649
(Methyltransf_25) 		5 ALA A  37
GLY A  39
SER A  60
PHE A 102
LEU A 109
 None
 0.88A 3bxoA-2n47A:
12.4		 3bxoA-2n47A:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nzx ALPHA1,3-FUCOSYLTRAN
SFERASE

(Helicobacter
pylori) 		PF00852
(Glyco_transf_10) 		5 ALA A  29
LEU A  59
PHE A  66
SER A  67
LEU A  26
 None
 1.28A 3bxoA-2nzxA:
undetectable		 3bxoA-2nzxA:
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.
2o2k METHIONINE SYNTHASE

(Homo sapiens) 		PF02965
(Met_synt_B12) 		5 ALA A1101
GLY A1030
MET A1189
TYR A1219
LEU A1218
 None
 1.14A 3bxoA-2o2kA:
undetectable		 3bxoA-2o2kA:
20.73
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.
2o5v DNA REPLICATION AND
REPAIR PROTEIN RECF

(Deinococcus
radiodurans) 		PF02463
(SMC_N) 		5 LEU A 150
SER A 151
ARG A 190
SER A 137
LEU A 135
 None
 1.31A 3bxoA-2o5vA:
undetectable		 3bxoA-2o5vA:
22.28
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.
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
 1.21A 3bxoA-2odfA:
undetectable		 3bxoA-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.
2p0u STILBENECARBOXYLATE
SYNTHASE 2

(Marchantia
polymorpha) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ALA A 237
GLY A 236
LEU A 361
SER A 359
MET A 355
 None
 1.33A 3bxoA-2p0uA:
undetectable		 3bxoA-2p0uA:
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.
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
 1.06A 3bxoA-2pb7A:
undetectable		 3bxoA-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
 1.26A 3bxoA-2pb7A:
undetectable		 3bxoA-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.
2qv6 GTP CYCLOHYDROLASE
III

(Methanocaldococcus
jannaschii) 		PF05165
(GCH_III) 		5 ALA A 135
GLY A 217
SER A 226
SER A 189
LEU A 177
 None
 1.23A 3bxoA-2qv6A:
undetectable		 3bxoA-2qv6A:
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.
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
 1.25A 3bxoA-2zkgA:
undetectable		 3bxoA-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.
3awk CHALCONE
SYNTHASE-LIKE
POLYKETIDE SYNTHASE

(Huperzia
serrata) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ALA A 229
GLY A 228
LEU A 353
SER A 351
MET A 347
 None
 1.35A 3bxoA-3awkA:
undetectable		 3bxoA-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
PHE A 106
SER A 108
TYR A 111
LEU A 112
 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)
UPP  A 239 ( 3.6A)
SAM  A 238 (-3.2A)
SAM  A 238 ( 4.7A)
None
 0.00A 3bxoA-3bxoA:
43.9		 3bxoA-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) 		9 GLY A  42
LEU A  61
SER A  62
MET A  65
MET A  87
ARG A  88
SER A 105
TYR A 108
LEU A 109
 None
 0.81A 3bxoA-3d2lA:
26.4		 3bxoA-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.
3dm5 SIGNAL RECOGNITION
54 KDA PROTEIN

(Pyrococcus
furiosus) 		PF00448
(SRP54)
PF02881
(SRP54_N)
PF02978
(SRP_SPB) 		5 GLY A 297
LEU A  14
SER A 291
TYR A  80
LEU A  83
 None
 1.36A 3bxoA-3dm5A:
3.7		 3bxoA-3dm5A:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.27A 3bxoA-3dwhA:
undetectable		 3bxoA-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.
3eiq PROGRAMMED CELL
DEATH PROTEIN 4

(Mus musculus) 		PF02847
(MA3) 		5 ALA C 268
GLY C 272
LEU C 223
SER C 224
LEU C 243
 None
 1.37A 3bxoA-3eiqC:
undetectable		 3bxoA-3eiqC:
21.49
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.
3eu8 PUTATIVE
GLUCOAMYLASE

(Bacteroides
fragilis) 		PF10091
(Glycoamylase)
PF11329
(DUF3131) 		5 ALA A 234
GLY A 240
LEU A 232
TYR A 230
LEU A 227
 None
 1.31A 3bxoA-3eu8A:
undetectable		 3bxoA-3eu8A:
18.71
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.
3g2p PCZA361.24

(Amycolatopsis
orientalis) 		PF13649
(Methyltransf_25) 		7 ALA A  71
GLY A  73
LEU A  93
SER A  94
MET A 123
SER A 141
LEU A 145
 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)
None
 0.67A 3bxoA-3g2pA:
19.0		 3bxoA-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 3bxoA-3g5lA:
16.4		 3bxoA-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.
3gv0 TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Agrobacterium
fabrum) 		PF13377
(Peripla_BP_3) 		5 ALA A  70
GLY A 127
LEU A 101
PHE A 150
LEU A  73
 None
 1.33A 3bxoA-3gv0A:
3.9		 3bxoA-3gv0A:
24.10
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.
3hl0 MALEYLACETATE
REDUCTASE

(Agrobacterium
fabrum) 		PF00465
(Fe-ADH) 		5 GLY A 288
HIS A 263
MET A 172
PHE A 292
LEU A 203
 None
 1.23A 3bxoA-3hl0A:
2.7		 3bxoA-3hl0A:
23.12
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.
3i6b 3-DEOXY-D-MANNO-OCTU
LOSONATE 8-PHOSPHATE
PHOSPHATASE

(Escherichia
coli) 		PF08282
(Hydrolase_3) 		5 ALA A 165
GLY A 161
LEU A  37
SER A  38
LEU A  29
 None
 1.31A 3bxoA-3i6bA:
3.1		 3bxoA-3i6bA:
21.85
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.
3ikf 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Burkholderia
pseudomallei) 		PF02542
(YgbB) 		5 ALA A 154
GLY A   6
ARG A 128
PHE A  51
LEU A 124
 None
 1.25A 3bxoA-3ikfA:
undetectable		 3bxoA-3ikfA:
23.55
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.
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
 1.35A 3bxoA-3jb9B:
undetectable		 3bxoA-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.
3jv7 ADH-A

(Rhodococcus
ruber) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 201
GLY A 179
SER A 223
PHE A 244
LEU A 234
 None
NAD  A 503 ( 3.8A)
NAD  A 503 (-2.7A)
None
None
 1.35A 3bxoA-3jv7A:
6.9		 3bxoA-3jv7A:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		5 GLY A 265
LEU A 188
SER A 189
PHE A 285
LEU A 250
 None
 1.24A 3bxoA-3k30A:
undetectable		 3bxoA-3k30A:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mvd REGULATOR OF
CHROMOSOME
CONDENSATION

(Drosophila
melanogaster) 		PF00415
(RCC1) 		5 ALA K 411
GLY K  48
LEU K  45
SER K  68
LEU K 366
 None
 1.38A 3bxoA-3mvdK:
undetectable		 3bxoA-3mvdK:
20.80
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.
3o3o ALPHA-SUBUNIT
2-HYDROXYISOCAPROYL-
COA DEHYDRATASE

(Clostridioides
difficile) 		PF06050
(HGD-D) 		5 GLY A 211
SER A 207
MET A 209
SER A 288
LEU A 330
 None
 1.35A 3bxoA-3o3oA:
undetectable		 3bxoA-3o3oA:
20.58
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.
3pkm CAS6 PROTEIN

(Pyrococcus
furiosus) 		PF01881
(Cas_Cas6) 		5 GLY A 229
LEU A 139
SER A 140
SER A  90
LEU A 125
 None
 1.34A 3bxoA-3pkmA:
undetectable		 3bxoA-3pkmA:
24.01
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
PHE A 118
SER A 120
LEU A 124
 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)
T3Q  A 301 ( 3.2A)
SAH  A 263 (-3.3A)
None
 0.41A 3bxoA-3px2A:
37.0		 3bxoA-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.
3qde CELLOBIOSE
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 GLY A 559
SER A 575
SER A 609
TYR A 613
LEU A 614
 None
 0.85A 3bxoA-3qdeA:
2.0		 3bxoA-3qdeA:
14.81
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.
3qyq DEOXYRIBOSE-PHOSPHAT
E ALDOLASE, PUTATIVE

(Toxoplasma
gondii) 		no annotation 5 ALA A  22
GLY A 260
LEU A 178
ARG A  52
SER A  50
 None
 1.32A 3bxoA-3qyqA:
undetectable		 3bxoA-3qyqA:
23.47
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.
3sqg METHYL COENZYME M
REDUCTASE, ALPHA
SUBUNIT

(uncultured
archaeon) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 ALA A 512
GLY A 298
LEU A 510
SER A 321
LEU A 319
 None
 1.30A 3bxoA-3sqgA:
undetectable		 3bxoA-3sqgA:
18.49
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.
3tzw POLYKETIDE SYNTHASE
PKS13

(Mycobacterium
tuberculosis) 		PF00698
(Acyl_transf_1) 		5 ALA A 907
GLY A 879
MET A 913
PHE A 902
LEU A 963
 None
 1.18A 3bxoA-3tzwA:
undetectable		 3bxoA-3tzwA:
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.
3ufc PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF01881
(Cas_Cas6) 		5 GLY X 223
LEU X 129
SER X 130
SER X  80
LEU X 115
 None
 1.37A 3bxoA-3ufcX:
undetectable		 3bxoA-3ufcX:
18.73
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.
4c8g 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Burkholderia
cenocepacia) 		PF02542
(YgbB) 		5 ALA A 154
GLY A   6
ARG A 128
PHE A  51
LEU A 124
 None
 1.28A 3bxoA-4c8gA:
undetectable		 3bxoA-4c8gA:
25.00
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.
4ecg PUTATIVE
IRON-REGULATED
PROTEIN A

(Parabacteroides
distasonis) 		PF09375
(Peptidase_M75) 		5 ALA A 320
GLY A 324
LEU A 337
SER A 336
LEU A 394
 None
 1.35A 3bxoA-4ecgA:
undetectable		 3bxoA-4ecgA:
21.52
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.
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
 1.36A 3bxoA-4f85A:
17.2		 3bxoA-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) 		6 GLY A 115
LEU A 136
SER A 137
MET A 164
SER A 182
TYR A 185
 None
 0.97A 3bxoA-4f85A:
17.2		 3bxoA-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
 1.30A 3bxoA-4gyoA:
undetectable		 3bxoA-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.
4i4q BEL-BETA TREFOIL

(Boletus edulis) 		no annotation 5 ALA A  17
GLY A  21
LEU A 140
ARG A 108
SER A 120
 None
 1.07A 3bxoA-4i4qA:
undetectable		 3bxoA-4i4qA:
19.83
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.
4i4s BEL BETA-TREFOIL

(Boletus edulis) 		no annotation 5 ALA A  17
GLY A  21
LEU A 140
ARG A 108
SER A 120
 None
 1.05A 3bxoA-4i4sA:
undetectable		 3bxoA-4i4sA:
18.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mn8 LRR RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE FLS2

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 ALA A 463
HIS A 417
SER A 512
TYR A 509
LEU A 484
 SO4  A 919 ( 4.7A)
None
SO4  A 916 (-2.3A)
None
None
 0.88A 3bxoA-4mn8A:
undetectable		 3bxoA-4mn8A:
13.70
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.
4mna LRR RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE FLS2

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 ALA A 463
HIS A 417
SER A 512
TYR A 509
LEU A 484
 None
 0.86A 3bxoA-4mnaA:
undetectable		 3bxoA-4mnaA:
16.21
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.
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
PHE A 194
SER A 247
LEU A 270
 None
 1.12A 3bxoA-4n03A:
4.9		 3bxoA-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.
4n03 ABC-TYPE
BRANCHED-CHAIN AMINO
ACID TRANSPORT
SYSTEMS PERIPLASMIC
COMPONENT-LIKE
PROTEIN

(Thermomonospora
curvata) 		PF13458
(Peripla_BP_6) 		5 ALA A 202
MET A 170
PHE A 194
SER A 247
LEU A 270
 None
 1.23A 3bxoA-4n03A:
4.9		 3bxoA-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.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		5 ALA A 150
HIS A  86
LEU A 152
MET A 154
LEU A 143
 None
ZN  A 401 ( 3.0A)
None
None
None
 1.38A 3bxoA-4okoA:
undetectable		 3bxoA-4okoA:
20.25
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.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		5 ALA A 150
LEU A 152
MET A 154
SER A 145
LEU A 143
 None
 1.26A 3bxoA-4okoA:
undetectable		 3bxoA-4okoA:
20.25
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.
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
 1.28A 3bxoA-4pw5A:
undetectable		 3bxoA-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.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23

(Saccharomyces
cerevisiae) 		PF08241
(Methyltransf_11) 		5 GLY B  57
SER B  79
MET B  82
MET B 100
LEU B 123
 SAM  B 301 (-3.3A)
EDO  B 310 ( 3.0A)
SAM  B 301 (-4.4A)
SAM  B 301 (-4.2A)
CSO  B 124 ( 4.4A)
 0.48A 3bxoA-4qtuB:
17.8		 3bxoA-4qtuB:
22.01
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.
4uph SULFATASE (SULFURIC
ESTER HYDROLASE)
PROTEIN

(Agrobacterium
tumefaciens) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 HIS A 498
LEU A  71
PHE A 415
SER A 373
LEU A 353
 None
 1.37A 3bxoA-4uphA:
undetectable		 3bxoA-4uphA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uz1 NOTUM

(Homo sapiens) 		PF03283
(PAE) 		5 ALA A 229
GLY A 261
LEU A 122
PHE A 333
LEU A 162
 None
 1.35A 3bxoA-4uz1A:
undetectable		 3bxoA-4uz1A:
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.
4wbh PROTEIN NOTUM
HOMOLOG

(Homo sapiens) 		PF03283
(PAE) 		5 ALA A 229
GLY A 261
LEU A 122
PHE A 333
LEU A 162
 None
 1.37A 3bxoA-4wbhA:
undetectable		 3bxoA-4wbhA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 0.96A 3bxoA-4z3nA:
undetectable		 3bxoA-4z3nA:
20.12
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)
 0.64A 3bxoA-5bszA:
30.6		 3bxoA-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) 		8 ALA A  53
GLY A  55
HIS A  59
LEU A  75
SER A  76
MET A  79
SER A 115
TYR A 118
 SAH  A 301 (-3.3A)
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 (-3.5A)
SAH  A 301 (-3.7A)
 0.76A 3bxoA-5bszA:
30.6		 3bxoA-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
 1.31A 3bxoA-5cayG:
undetectable		 3bxoA-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.
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
 1.30A 3bxoA-5e66A:
undetectable		 3bxoA-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.
5ey9 LONG-CHAIN-FATTY-ACI
D--AMP LIGASE FADD32

(Mycobacterium
marinum) 		PF00501
(AMP-binding) 		5 GLY A 233
LEU A 310
PHE A 249
SER A 224
LEU A 266
 None
5SV  A 701 (-3.9A)
None
None
None
 1.38A 3bxoA-5ey9A:
undetectable		 3bxoA-5ey9A:
19.17
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.
5gri ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT ALPHA,
MITOCHONDRIAL

(Homo sapiens) 		PF00180
(Iso_dh) 		5 ALA A 279
GLY A 244
LEU A 281
SER A 261
LEU A  68
 None
 1.31A 3bxoA-5griA:
undetectable		 3bxoA-5griA:
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.
5gzh ENDO-BETA-1,2-GLUCAN
ASE

(Chitinophaga
pinensis) 		PF10091
(Glycoamylase) 		5 ALA A 220
GLY A 226
LEU A 218
TYR A 216
LEU A 213
 None
 1.26A 3bxoA-5gzhA:
undetectable		 3bxoA-5gzhA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		6 ALA A  67
GLY A  69
SER A  90
MET A  93
SER A 135
LEU A 139
 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)
None
 0.79A 3bxoA-5h02A:
20.7		 3bxoA-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
LEU A 139
 SAH  A 301 (-3.3A)
SAH  A 301 ( 4.9A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.2A)
None
 0.58A 3bxoA-5h02A:
20.7		 3bxoA-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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		6 ALA A 749
LEU A 745
SER A 746
SER A 814
TYR A 818
LEU A 819
 None
 1.31A 3bxoA-5h42A:
undetectable		 3bxoA-5h42A:
11.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
 0.63A 3bxoA-5je3A:
19.7		 3bxoA-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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		5 ALA A 633
LEU A 680
MET A 526
ARG A 673
SER A 675
 None
 1.22A 3bxoA-5l46A:
2.5		 3bxoA-5l46A:
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.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo) 		no annotation 5 ALA A  44
GLY A 213
LEU A  49
SER A  50
LEU A 177
 None
 1.30A 3bxoA-5m41A:
undetectable		 3bxoA-5m41A:
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.
5m58 C-METHYLTRANSFERASE
COUO

(Streptomyces
rishiriensis) 		PF13649
(Methyltransf_25) 		5 GLY A  49
LEU A  71
SER A  72
MET A  75
LEU A 122
 SAH  A 301 (-3.3A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.1A)
SAH  A 301 (-4.5A)
 0.71A 3bxoA-5m58A:
17.5		 3bxoA-5m58A:
25.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ovo ADP-RIBOSYL-(DINITRO
GEN REDUCTASE)
HYDROLASE

(Azospirillum
brasilense) 		no annotation 5 ALA A  13
GLY A 256
LEU A  11
SER A   8
LEU A 287
 None
 1.26A 3bxoA-5ovoA:
undetectable		 3bxoA-5ovoA:
21.94
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.
5tos SERINE/THREONINE-PRO
TEIN KINASE BIK1

(Arabidopsis
thaliana) 		no annotation 5 ALA A 278
GLY A 244
LEU A 268
SER A 264
LEU A 162
 None
 1.36A 3bxoA-5tosA:
undetectable		 3bxoA-5tosA:
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.
5vy3 PROTEASOME SUBUNIT
ALPHA

(Thermoplasma
acidophilum) 		no annotation 5 ALA A 117
GLY A 155
LEU A 136
SER A 135
LEU A 112
 None
 1.37A 3bxoA-5vy3A:
undetectable		 3bxoA-5vy3A:
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.
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
 1.30A 3bxoA-5wx3A:
undetectable		 3bxoA-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 GLY A 717
LEU A 720
SER A 719
SER A 937
LEU A 935
 None
 1.27A 3bxoA-5xblA:
undetectable		 3bxoA-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.
5ypt STILBENECARBOXYLATE
SYNTHASE 1

(Marchantia
polymorpha) 		no annotation 5 ALA A 221
GLY A 220
LEU A 345
SER A 343
MET A 339
 None
 1.33A 3bxoA-5yptA:
undetectable		 3bxoA-5yptA:
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.
6c6k INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 1

(Homo sapiens) 		no annotation 5 ALA A 407
HIS A 385
LEU A 405
SER A 420
LEU A 451
 None
 1.34A 3bxoA-6c6kA:
undetectable		 3bxoA-6c6kA:
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.
6c6k INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 1

(Homo sapiens) 		no annotation 5 GLY A 387
HIS A 385
LEU A 405
SER A 420
LEU A 451
 None
 1.16A 3bxoA-6c6kA:
undetectable		 3bxoA-6c6kA:
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.
6dbr -

(-) 		no annotation 5 ALA B  76
GLY B 139
HIS B 207
LEU B  72
LEU B 106
 None
 1.16A 3bxoA-6dbrB:
undetectable		 3bxoA-6dbrB:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dll P-HYDROXYBENZOATE
HYDROXYLASE

(Pseudomonas
putida) 		no annotation 5 ALA A  10
GLY A   9
SER A  13
MET A 110
LEU A  40
 None
FAD  A 401 (-3.4A)
FAD  A 401 (-2.6A)
None
None
 1.00A 3bxoA-6dllA:
2.2		 3bxoA-6dllA:
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.
6f74 ALCOHOL OXIDASE

(Thermothelomyces
thermophila) 		no annotation 5 ALA A 209
LEU A 298
SER A 299
SER A 156
LEU A 173
 None
None
None
FAD  A 601 (-2.6A)
None
 1.34A 3bxoA-6f74A:
undetectable		 3bxoA-6f74A:
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.
6g3u -

(-) 		no annotation 5 ALA A  31
GLY A  35
HIS A 683
SER A   5
LEU A  24
 None
 1.32A 3bxoA-6g3uA:
undetectable		 3bxoA-6g3uA:
undetectable