SIMILAR PATTERNS OF AMINO ACIDS FOR 3GWS_X_T3X500_1

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.
1ej6 LAMBDA1

(Reovirus sp.) 		no annotation 5 ILE B 743
ALA B 594
LEU B 595
LEU B 886
ILE B 882
 None
 0.81A 3gwsX-1ej6B:
1.4		 3gwsX-1ej6B:
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.
1f82 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		5 ILE A  44
ILE A  45
ALA A  35
ALA A 155
ILE A 189
 None
 0.94A 3gwsX-1f82A:
0.0		 3gwsX-1f82A:
20.84
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.
1hp1 5'-NUCLEOTIDASE

(Escherichia
coli) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 ILE A 200
ILE A 168
ALA A 196
ALA A 237
ILE A 285
 None
 1.05A 3gwsX-1hp1A:
0.0		 3gwsX-1hp1A:
18.98
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.
1kpl PUTATIVE CLC FAMILY,
CHLORINE TRANSPORT
PROTEIN

(Salmonella
enterica) 		PF00654
(Voltage_CLC) 		5 ILE A 197
ILE A 200
ALA A 183
ALA A  39
ILE A  35
 None
 0.94A 3gwsX-1kplA:
0.7		 3gwsX-1kplA:
20.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 ALA A 225
ARG A 228
ALA A 263
LEU A 276
LEU A 292
ILE A 299
PHE A 405
 IH5  A 600 (-3.5A)
IH5  A 600 (-4.2A)
IH5  A 600 ( 3.8A)
IH5  A 600 (-4.0A)
IH5  A 600 (-4.7A)
IH5  A 600 (-4.7A)
None
 1.49A 3gwsX-1navA:
37.2		 3gwsX-1navA:
83.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 ILE A 221
ILE A 222
ALA A 225
ARG A 228
MET A 256
MET A 259
ALA A 263
LEU A 276
LEU A 292
ILE A 299
HIS A 381
PHE A 401
 None
IH5  A 600 (-4.3A)
IH5  A 600 (-3.5A)
IH5  A 600 (-4.2A)
IH5  A 600 (-3.6A)
IH5  A 600 (-4.7A)
IH5  A 600 ( 3.8A)
IH5  A 600 (-4.0A)
IH5  A 600 (-4.7A)
IH5  A 600 (-4.7A)
IH5  A 600 (-3.7A)
IH5  A 600 (-4.4A)
 0.66A 3gwsX-1navA:
37.2		 3gwsX-1navA:
83.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 ILE A 222
ALA A 225
MET A 259
LEU A 292
ILE A 377
PHE A 401
 IH5  A 600 (-4.3A)
IH5  A 600 (-3.5A)
IH5  A 600 (-4.7A)
IH5  A 600 (-4.7A)
None
IH5  A 600 (-4.4A)
 1.31A 3gwsX-1navA:
37.2		 3gwsX-1navA:
83.01
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.
1ort ORNITHINE
TRANSCARBAMOYLASE

(Pseudomonas
aeruginosa) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ILE A 324
ILE A 327
ALA A 326
ILE A 175
HIS A  15
 None
 0.99A 3gwsX-1ortA:
0.0		 3gwsX-1ortA:
20.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1q4x THYROID HORMONE
RECEPTOR BETA-1

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 ILE A 275
ILE A 276
ALA A 279
ARG A 282
MET A 310
MET A 313
ALA A 317
LEU A 330
LEU A 346
ILE A 353
HIS A 435
PHE A 455
 None
G24  A 462 ( 4.3A)
G24  A 462 (-3.5A)
G24  A 462 ( 3.9A)
G24  A 462 ( 3.8A)
G24  A 462 ( 4.6A)
G24  A 462 ( 4.1A)
G24  A 462 ( 3.9A)
G24  A 462 (-4.0A)
None
G24  A 462 (-3.9A)
G24  A 462 (-3.8A)
 0.49A 3gwsX-1q4xA:
37.5		 3gwsX-1q4xA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1q4x THYROID HORMONE
RECEPTOR BETA-1

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 ILE A 275
ILE A 276
ALA A 279
ARG A 282
MET A 313
ALA A 317
LEU A 341
ILE A 353
 None
G24  A 462 ( 4.3A)
G24  A 462 (-3.5A)
G24  A 462 ( 3.9A)
G24  A 462 ( 4.6A)
G24  A 462 ( 4.1A)
None
None
 1.30A 3gwsX-1q4xA:
37.5		 3gwsX-1q4xA:
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.
1q6w MONOAMINE OXIDASE
REGULATORY PROTEIN,
PUTATIVE

(Archaeoglobus
fulgidus) 		PF01575
(MaoC_dehydratas) 		5 ILE A 113
ALA A 115
ALA A 149
LEU A 147
ILE A  98
 None
 1.05A 3gwsX-1q6wA:
0.0		 3gwsX-1q6wA:
24.51
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.
1rj6 CARBONIC ANHYDRASE
XIV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		5 ILE A 146
ILE A 148
ALA A 216
ALA A 156
LEU A 184
 None
 0.96A 3gwsX-1rj6A:
0.0		 3gwsX-1rj6A:
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.
1t3i PROBABLE CYSTEINE
DESULFURASE

(Synechocystis
sp.) 		PF00266
(Aminotran_5) 		5 ILE A  85
ALA A 210
ALA A  99
LEU A 203
ILE A 103
 None
None
PLP  A 600 (-3.9A)
None
None
 1.03A 3gwsX-1t3iA:
undetectable		 3gwsX-1t3iA:
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.
1ty4 APOPTOSIS REGULATOR
CED-9
EGG LAYING DEFECTIVE
EGL-1, PROGRAMMED
CELL DEATH ACTIVATOR

(Caenorhabditis
elegans) 		PF00452
(Bcl-2)
PF02180
(BH4)
PF11430
(EGL-1) 		5 ILE A 172
ARG A 219
MET A 231
MET C  69
ALA C  67
 None
 1.08A 3gwsX-1ty4A:
undetectable		 3gwsX-1ty4A:
22.47
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.
1tzb GLUCOSE-6-PHOSPHATE
ISOMERASE,
CONJECTURAL

(Pyrobaculum
aerophilum) 		PF10432
(bact-PGI_C) 		5 ILE A 155
ALA A 150
ALA A 145
LEU A 146
ILE A  42
 None
 1.08A 3gwsX-1tzbA:
undetectable		 3gwsX-1tzbA:
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.
1upx HYDROXYLAMINE
REDUCTASE

(Desulfovibrio
desulfuricans) 		PF03063
(Prismane) 		5 ILE A 440
ILE A 443
ALA A 384
LEU A 423
ILE A 479
 None
 0.94A 3gwsX-1upxA:
undetectable		 3gwsX-1upxA:
16.73
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.
1vqz LIPOATE-PROTEIN
LIGASE, PUTATIVE

(Streptococcus
pneumoniae) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		5 ILE A 270
ALA A 263
ALA A 326
LEU A 306
ILE A 323
 None
 1.04A 3gwsX-1vqzA:
undetectable		 3gwsX-1vqzA:
19.77
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.
1yp4 GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
SMALL SUBUNIT

(Solanum
tuberosum) 		PF00483
(NTP_transferase) 		5 ILE A 415
ILE A 414
ALA A 359
LEU A 366
ILE A 355
 None
 1.04A 3gwsX-1yp4A:
undetectable		 3gwsX-1yp4A:
20.22
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.
2a7s PROBABLE
PROPIONYL-COA
CARBOXYLASE BETA
CHAIN 5

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 ILE A 181
ILE A 140
ALA A 177
LEU A 146
ILE A 132
 None
 1.04A 3gwsX-2a7sA:
undetectable		 3gwsX-2a7sA:
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.
2aua HYPOTHETICAL PROTEIN

(Bacillus cereus) 		PF10386
(DUF2441) 		5 ILE A  11
ALA A 116
ALA A   8
ILE A 182
PHE A 123
 None
 1.09A 3gwsX-2auaA:
undetectable		 3gwsX-2auaA:
21.93
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.
2azq CATECHOL
1,2-DIOXYGENASE

(Pseudomonas
putida) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 ILE A 179
ILE A 178
ALA A 116
MET A 122
ALA A 113
 None
 1.05A 3gwsX-2azqA:
undetectable		 3gwsX-2azqA:
21.89
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.
2d57 AQUAPORIN-4

(Rattus
norvegicus) 		PF00230
(MIP) 		5 ILE A  81
ALA A  82
ILE A 199
HIS A 201
PHE A  48
 None
 1.05A 3gwsX-2d57A:
undetectable		 3gwsX-2d57A:
23.10
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.
2dit HIV TAT SPECIFIC
FACTOR 1 VARIANT

(Homo sapiens) 		PF00076
(RRM_1) 		5 ILE A  19
ILE A  20
ALA A  96
ALA A  77
PHE A  89
 None
 1.08A 3gwsX-2ditA:
undetectable		 3gwsX-2ditA:
14.86
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.
2ehh DIHYDRODIPICOLINATE
SYNTHASE

(Aquifex
aeolicus) 		PF00701
(DHDPS) 		5 ILE A  59
ALA A  96
ALA A  66
LEU A  23
ILE A  27
 None
 1.02A 3gwsX-2ehhA:
undetectable		 3gwsX-2ehhA:
22.95
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.
2ekm HYPOTHETICAL PROTEIN
ST1511

(Sulfurisphaera
tokodaii) 		PF04008
(Adenosine_kin) 		5 ILE A  68
ILE A  47
ALA A  71
LEU A  67
LEU A  43
 None
 1.08A 3gwsX-2ekmA:
undetectable		 3gwsX-2ekmA:
23.63
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.
2g9h EXTRACELLULAR
ENTEROTOXIN TYPE I

(Staphylococcus
aureus) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		5 ILE D 139
LEU D 129
LEU D  99
ILE D 108
PHE D 161
 None
 1.06A 3gwsX-2g9hD:
undetectable		 3gwsX-2g9hD:
20.90
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.
2gbz OLIGORIBONUCLEASE

(Xanthomonas
campestris) 		PF00929
(RNase_T) 		5 ILE A  29
ILE A  51
ARG A  77
LEU A 119
ILE A  14
 None
 0.94A 3gwsX-2gbzA:
undetectable		 3gwsX-2gbzA:
21.63
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.
2h4t CARNITINE
O-PALMITOYLTRANSFERA
SE II, MITOCHONDRIAL

(Rattus
norvegicus) 		PF00755
(Carn_acyltransf) 		5 ALA A 367
MET A 342
LEU A 599
ILE A 443
HIS A 337
 None
None
D12  A1703 (-4.2A)
None
None
 1.06A 3gwsX-2h4tA:
undetectable		 3gwsX-2h4tA:
18.05
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.
2j6i FORMATE
DEHYDROGENASE

([Candida]
boidinii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 ILE A  42
ILE A   3
ALA A  72
LEU A  85
ILE A  74
 None
 0.99A 3gwsX-2j6iA:
undetectable		 3gwsX-2j6iA:
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.
2ji4 PHOSPHORIBOSYL
PYROPHOSPHATE
SYNTHETASE-ASSOCIATE
D PROTEIN 2

(Homo sapiens) 		PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth) 		5 ILE A 173
ARG A 202
ALA A 165
LEU A 169
ILE A 341
 None
None
CL  A1369 (-4.0A)
None
None
 0.95A 3gwsX-2ji4A:
undetectable		 3gwsX-2ji4A:
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.
2jrb ORF 1 PROTEIN

(Mus musculus) 		PF17490
(Tnp_22_dsRBD) 		5 ILE A 352
ALA A 348
LEU A 343
LEU A 307
ILE A 324
 None
 0.99A 3gwsX-2jrbA:
undetectable		 3gwsX-2jrbA:
18.86
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.
2l1n UNCHARACTERIZED
PROTEIN

(Synechococcus
elongatus) 		PF08853
(DUF1823) 		5 ILE A   5
ILE A   3
ALA A  30
ALA A  25
LEU A  26
 None
 1.06A 3gwsX-2l1nA:
undetectable		 3gwsX-2l1nA:
18.87
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.
2lao LYSINE, ARGININE,
ORNITHINE-BINDING
PROTEIN

(Salmonella
enterica) 		PF00497
(SBP_bac_3) 		6 ALA A 209
MET A  37
ALA A  66
LEU A 199
LEU A  87
ILE A  68
 None
 1.39A 3gwsX-2laoA:
undetectable		 3gwsX-2laoA:
23.02
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.
2lc0 PUTATIVE
UNCHARACTERIZED
PROTEIN TB39.8

(Mycobacterium
tuberculosis) 		PF12401
(DUF3662) 		5 ILE A  63
ILE A  64
ALA A 121
ARG A 120
ALA A  44
 None
 1.04A 3gwsX-2lc0A:
undetectable		 3gwsX-2lc0A:
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.
2np0 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		5 ILE A  44
ILE A  45
ALA A  35
ALA A 155
ILE A 189
 None
 0.87A 3gwsX-2np0A:
undetectable		 3gwsX-2np0A:
12.04
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.
2oga TRANSAMINASE

(Streptomyces
venezuelae) 		PF01041
(DegT_DnrJ_EryC1) 		5 ILE A 277
ALA A 373
ALA A 368
LEU A 351
ILE A 312
 None
 0.99A 3gwsX-2ogaA:
undetectable		 3gwsX-2ogaA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oi2 MEVALONATE KINASE

(Streptococcus
pneumoniae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 ILE A  97
ILE A 100
ALA A  99
ILE A 126
PHE A 104
 None
 1.08A 3gwsX-2oi2A:
undetectable		 3gwsX-2oi2A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qk4 TRIFUNCTIONAL PURINE
BIOSYNTHETIC PROTEIN
ADENOSINE-3

(Homo sapiens) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 ILE A   7
ILE A   8
ALA A  33
LEU A  86
HIS A  55
 None
 0.95A 3gwsX-2qk4A:
undetectable		 3gwsX-2qk4A:
20.50
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.
2r09 CYTOHESIN-3

(Mus musculus) 		PF00169
(PH)
PF01369
(Sec7) 		5 ILE A 197
ILE A 198
MET A 169
ALA A 173
PHE A 262
 None
 1.09A 3gwsX-2r09A:
undetectable		 3gwsX-2r09A:
20.18
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.
2rhd SMALL GTP BINDING
PROTEIN RAB1A

(Cryptosporidium
parvum) 		PF00071
(Ras) 		5 ILE A  86
ALA A 162
ALA A 153
LEU A  25
PHE A 148
 None
None
GDP  A3800 (-3.7A)
None
None
 1.05A 3gwsX-2rhdA:
undetectable		 3gwsX-2rhdA:
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.
2vwk DNA POLYMERASE

(Thermococcus
gorgonarius) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 ILE A  96
ILE A  54
ALA A  68
LEU A  85
LEU A  42
 None
 0.98A 3gwsX-2vwkA:
undetectable		 3gwsX-2vwkA:
18.83
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.
2w8q SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00171
(Aldedh) 		5 ALA A  98
ALA A 199
LEU A 292
ILE A 280
HIS A 295
 None
 1.07A 3gwsX-2w8qA:
undetectable		 3gwsX-2w8qA:
20.79
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.
3b2r CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		5 ILE A 715
ALA A 719
MET A 760
LEU A 756
LEU A 629
 None
 1.04A 3gwsX-3b2rA:
undetectable		 3gwsX-3b2rA:
21.30
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.
3cgg SAM-DEPENDENT
METHYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF13649
(Methyltransf_25) 		5 ILE A 144
ALA A 142
ALA A 135
LEU A  97
ILE A 102
 NHE  A 195 ( 4.5A)
None
None
NHE  A 195 (-3.8A)
EDO  A 200 (-4.4A)
 1.04A 3gwsX-3cggA:
undetectable		 3gwsX-3cggA:
21.80
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.
3fi1 NA(+)/H(+)
ANTIPORTER NHAA

(Escherichia
coli) 		PF06965
(Na_H_antiport_1) 		5 ILE A 169
ILE A 168
ALA A 167
MET A 341
ILE A 134
 None
 1.04A 3gwsX-3fi1A:
undetectable		 3gwsX-3fi1A:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hve GIGAXONIN

(Homo sapiens) 		PF00651
(BTB)
PF07707
(BACK) 		5 ILE A  90
ALA A  51
LEU A 112
LEU A  34
ILE A  73
 None
 1.05A 3gwsX-3hveA:
undetectable		 3gwsX-3hveA:
24.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iz3 STRUCTURAL PROTEIN
VP1

(Cypovirus 1) 		no annotation 5 ILE B 979
ILE B 820
ALA B 982
LEU B 967
PHE B 819
 None
 0.89A 3gwsX-3iz3B:
undetectable		 3gwsX-3iz3B:
11.57
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.
3iz3 STRUCTURAL PROTEIN
VP1

(Cypovirus 1) 		no annotation 5 ILE B 979
ILE B 820
ALA B 982
LEU B 974
PHE B 819
 None
 1.06A 3gwsX-3iz3B:
undetectable		 3gwsX-3iz3B:
11.57
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.
3n11 CHITINASE A

(Bacillus cereus) 		PF00704
(Glyco_hydro_18) 		5 ILE A 307
LEU A 303
LEU A 281
ILE A 294
HIS A 226
 None
 1.02A 3gwsX-3n11A:
undetectable		 3gwsX-3n11A:
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.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		5 ILE A 260
ILE A 259
ALA A 225
ALA A 216
LEU A 296
 None
 0.98A 3gwsX-3o8lA:
undetectable		 3gwsX-3o8lA:
17.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oec CARVEOL
DEHYDROGENASE
(MYTHA.01326.C,
A0R518 HOMOLOG)

(Mycolicibacterium
thermoresistibile) 		PF13561
(adh_short_C2) 		5 ILE A 169
ALA A 273
ALA A  49
ILE A  51
HIS A  40
 None
 1.07A 3gwsX-3oecA:
undetectable		 3gwsX-3oecA:
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.
3pei CYTOSOL
AMINOPEPTIDASE

(Francisella
tularensis) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 ILE A 397
ALA A 389
LEU A 386
LEU A 247
ILE A 245
 None
EDO  A 510 (-4.0A)
None
None
None
 1.00A 3gwsX-3peiA:
undetectable		 3gwsX-3peiA:
20.04
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.
3sgg HYPOTHETICAL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF14323
(GxGYxYP_C)
PF16216
(GxGYxYP_N) 		6 ILE A 231
ALA A 292
LEU A 227
LEU A 287
ILE A 335
HIS A  61
 None
 1.36A 3gwsX-3sggA:
undetectable		 3gwsX-3sggA:
18.54
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.
3u24 PUTATIVE LIPOPROTEIN

(Shewanella
oneidensis) 		PF05960
(DUF885) 		5 ILE A 229
ALA A 233
ALA A 171
ILE A  75
PHE A 202
 None
None
EDO  A 610 (-3.4A)
CA  A 607 ( 4.8A)
None
 1.07A 3gwsX-3u24A:
undetectable		 3gwsX-3u24A:
18.51
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.
3u24 PUTATIVE LIPOPROTEIN

(Shewanella
oneidensis) 		PF05960
(DUF885) 		5 ILE A 229
ALA A 233
LEU A  73
ILE A  75
PHE A 202
 None
None
EDO  A 600 (-4.8A)
CA  A 607 ( 4.8A)
None
 1.02A 3gwsX-3u24A:
undetectable		 3gwsX-3u24A:
18.51
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.
3zlp THIOREDOXIN
PEROXIDASE

(Schistosoma
mansoni) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		5 ILE A  18
ALA A  16
ALA A  71
LEU A  93
ILE A  52
 None
 1.05A 3gwsX-3zlpA:
undetectable		 3gwsX-3zlpA:
21.88
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.
3zuq BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07952
(Toxin_trans) 		5 ILE A  45
ILE A  46
ALA A  36
ALA A 156
ILE A 190
 None
 0.87A 3gwsX-3zuqA:
undetectable		 3gwsX-3zuqA:
14.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a3s 6-PHOSPHOFRUCTOKINAS
E

(Bacillus
subtilis) 		PF00365
(PFK) 		5 ILE A 218
ILE A 217
ALA A 186
ALA A 177
LEU A 247
 None
 0.92A 3gwsX-4a3sA:
undetectable		 3gwsX-4a3sA:
24.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4axn CHITINASE C1

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18) 		5 ILE A 101
MET A  18
ALA A  98
LEU A 100
ILE A  21
 None
 1.08A 3gwsX-4axnA:
undetectable		 3gwsX-4axnA:
19.34
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.
4bn2 KINESIN-LIKE PROTEIN
KIF15

(Homo sapiens) 		PF00225
(Kinesin) 		5 ILE A 323
ALA A 321
ALA A 346
LEU A 281
ILE A 285
 None
 1.08A 3gwsX-4bn2A:
undetectable		 3gwsX-4bn2A:
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.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE

(Staphylococcus
aureus) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 ILE A 402
ILE A 439
ALA A 446
LEU A 347
ILE A 345
 None
 1.05A 3gwsX-4c13A:
undetectable		 3gwsX-4c13A:
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.
4f4c MULTIDRUG RESISTANCE
PROTEIN PGP-1

(Caenorhabditis
elegans) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 ILE A 870
ALA A 869
ALA A1047
LEU A 829
ILE A1051
 None
 1.04A 3gwsX-4f4cA:
undetectable		 3gwsX-4f4cA:
12.45
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.
4g2n D-ISOMER SPECIFIC
2-HYDROXYACID
DEHYDROGENASE,
NAD-BINDING

(Polaromonas sp.
JS666) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 ILE A 178
MET A 160
ALA A 213
LEU A 211
ILE A 163
 None
 0.98A 3gwsX-4g2nA:
undetectable		 3gwsX-4g2nA:
23.28
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.
4h2x AMINO
ACID--[ACYL-CARRIER-
PROTEIN] LIGASE 1

(Agrobacterium
fabrum;
Bradyrhizobium
diazoefficiens) 		no annotation 5 ILE B 200
ALA B 290
LEU B 287
LEU B 238
ILE B 240
 None
 1.07A 3gwsX-4h2xB:
undetectable		 3gwsX-4h2xB:
22.80
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.
4jpd PROTEIN CYAY

(Burkholderia
cenocepacia) 		PF01491
(Frataxin_Cyay) 		5 ILE A  51
ILE A  63
ALA A  65
LEU A  42
ILE A 104
 None
 1.03A 3gwsX-4jpdA:
undetectable		 3gwsX-4jpdA:
17.58
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.
4kpg MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 ILE A 363
ALA A 388
ALA A  77
LEU A 346
ILE A  74
 None
 1.03A 3gwsX-4kpgA:
undetectable		 3gwsX-4kpgA:
20.54
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.
4m1z MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 ILE A 363
ALA A 388
ALA A  77
LEU A 346
ILE A  74
 None
 1.06A 3gwsX-4m1zA:
undetectable		 3gwsX-4m1zA:
19.69
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.
4non FERROUS IRON UPTAKE
TRANSPORTER PROTEIN
B

(Streptococcus
thermophilus) 		PF02421
(FeoB_N) 		5 ILE A 106
ALA A   5
ALA A  70
LEU A  97
ILE A  57
 ILE  A 106 ( 0.6A)
ALA  A   5 ( 0.0A)
ALA  A  70 ( 0.0A)
LEU  A  97 ( 0.6A)
ILE  A  57 ( 0.7A)
 1.02A 3gwsX-4nonA:
undetectable		 3gwsX-4nonA:
22.14
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.
4ofl EXTRACYTOPLASMIC
NICKEL-BINDING
PROTEIN YPYNTA

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		5 ILE A 450
ALA A 457
ALA A 265
LEU A 311
ILE A 358
 None
 1.09A 3gwsX-4oflA:
undetectable		 3gwsX-4oflA:
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.
4qmg STAPHYLOCOCCAL
NUCLEASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00565
(SNase) 		5 ILE A 180
ALA A 210
LEU A 265
ILE A 263
HIS A 190
 None
 1.08A 3gwsX-4qmgA:
undetectable		 3gwsX-4qmgA:
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.
4ras OXIDOREDUCTASE,
NAD-BINDING/IRON-SUL
FUR CLUSTER-BINDING
PROTEIN

(Nitratireductor
pacificus) 		PF12838
(Fer4_7)
PF13486
(Dehalogenase) 		5 ILE A 432
ALA A 365
ALA A 358
LEU A  46
ILE A 137
 None
 1.09A 3gwsX-4rasA:
undetectable		 3gwsX-4rasA:
17.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tq2 PUTATIVE
PHYCOERYTHRIN LYASE

(Guillardia
theta) 		PF09367
(CpeS) 		5 ILE A 151
ILE A 152
ALA A  24
LEU A 161
HIS A 156
 None
 0.92A 3gwsX-4tq2A:
undetectable		 3gwsX-4tq2A:
22.73
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE

(Homo sapiens) 		PF00365
(PFK) 		5 ILE A 269
ILE A 268
ALA A 234
ALA A 225
LEU A 305
 None
 1.00A 3gwsX-4u1rA:
undetectable		 3gwsX-4u1rA:
17.27
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.
4w8p TALIN-1

(Mus musculus) 		no annotation 5 ILE A1644
ALA A1406
LEU A1403
LEU A1613
ILE A1410
 None
 1.06A 3gwsX-4w8pA:
undetectable		 3gwsX-4w8pA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wuv 2-HYDROXYCYCLOHEXANE
CARBOXYL-COA
DEHYDROGENASE

(Haemophilus
influenzae) 		PF00106
(adh_short) 		5 ILE A  95
ILE A  97
ALA A  36
LEU A  44
ILE A  59
 None
 1.04A 3gwsX-4wuvA:
undetectable		 3gwsX-4wuvA:
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.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 ILE A 164
ILE A 168
ALA A 167
ALA A 240
ILE A 244
 None
 0.88A 3gwsX-5a3yA:
undetectable		 3gwsX-5a3yA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bn7 MALTODEXTRIN
GLUCOSIDASE

(Escherichia
coli) 		PF00128
(Alpha-amylase) 		5 ILE A 319
ILE A 312
LEU A 335
ILE A 370
HIS A 353
 None
 1.03A 3gwsX-5bn7A:
undetectable		 3gwsX-5bn7A:
17.87
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.
5c9i PROTEIN RELATED TO
PENICILLIN ACYLASE

(Acidovorax sp.
MR-S7) 		PF01804
(Penicil_amidase) 		5 ILE A 389
ILE A 409
ALA A 387
ARG A 362
ILE A 498
 None
 1.08A 3gwsX-5c9iA:
undetectable		 3gwsX-5c9iA:
14.36
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.
5cy4 OLIGORIBONUCLEASE

(Acinetobacter
baumannii) 		PF00929
(RNase_T) 		5 ILE A  27
ILE A  49
ARG A  75
LEU A 117
ILE A  12
 None
 0.94A 3gwsX-5cy4A:
undetectable		 3gwsX-5cy4A:
20.52
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.
5ege ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 6

(Mus musculus) 		PF01663
(Phosphodiest) 		5 ILE A 187
ALA A 173
MET A 220
LEU A 237
PHE A 166
 None
 0.94A 3gwsX-5egeA:
undetectable		 3gwsX-5egeA:
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.
5f3y UNCONVENTIONAL
MYOSIN-VIIB

(Mus musculus) 		PF00784
(MyTH4) 		5 ALA A 977
ALA A 985
LEU A 998
ILE A 990
PHE A1133
 None
 1.05A 3gwsX-5f3yA:
undetectable		 3gwsX-5f3yA:
17.79
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.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 ILE A 164
ILE A 168
ALA A 167
ALA A 240
ILE A 244
 None
 0.87A 3gwsX-5fxnA:
undetectable		 3gwsX-5fxnA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h5v FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 2

(Escherichia
coli) 		PF02465
(FliD_N)
PF07195
(FliD_C) 		5 ILE A 168
ALA A 166
ALA A 156
LEU A 201
ILE A 143
 None
 1.04A 3gwsX-5h5vA:
undetectable		 3gwsX-5h5vA:
20.67
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.
5h5w FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 2

(Escherichia
coli) 		PF07195
(FliD_C)
PF07196
(Flagellin_IN) 		5 ILE A 168
ALA A 166
ALA A 156
LEU A 201
ILE A 143
 None
 0.94A 3gwsX-5h5wA:
undetectable		 3gwsX-5h5wA:
21.40
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.
5i35 ATYPICAL KINASE
ADCK3, MITOCHONDRIAL

(Homo sapiens) 		PF03109
(ABC1) 		5 ILE A 525
ILE A 526
ALA A 529
ALA A 562
ILE A 587
 None
 0.88A 3gwsX-5i35A:
undetectable		 3gwsX-5i35A:
21.79
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.
5id4 DSBA-LIKE PROTEIN

(Proteus
mirabilis) 		PF13462
(Thioredoxin_4) 		5 ILE A 108
ILE A 107
ALA A 194
LEU A 183
ILE A 189
 None
 0.99A 3gwsX-5id4A:
undetectable		 3gwsX-5id4A:
21.15
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.
5itw DIHYDROANTICAPSIN
7-DEHYDROGENASE

(Bacillus
subtilis) 		PF13561
(adh_short_C2) 		5 ALA A  72
MET A 120
ALA A 124
LEU A  83
ILE A 136
 None
 1.08A 3gwsX-5itwA:
undetectable		 3gwsX-5itwA:
22.65
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.
5jen ANTI-SIGMA-V FACTOR
RSIV
LYSOZYME C

(Bacillus
subtilis;
Gallus gallus) 		PF00062
(Lys)
PF11738
(DUF3298)
PF13739
(DUF4163) 		5 ILE B  58
ALA A 167
ALA B  31
LEU B  56
LEU B  17
 None
 1.02A 3gwsX-5jenB:
undetectable		 3gwsX-5jenB:
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.
5kc8 GLUTAMATE RECEPTOR
IONOTROPIC, DELTA-2

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 ILE A 204
ILE A 208
LEU A 227
ILE A 169
PHE A 212
 None
 1.08A 3gwsX-5kc8A:
undetectable		 3gwsX-5kc8A:
19.77
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.
5kca CEREBELLIN-1,CEREBEL
LIN-1,CEREBELLIN-1,G
LUTAMATE RECEPTOR
IONOTROPIC, DELTA-2

(Homo sapiens) 		PF00386
(C1q)
PF01094
(ANF_receptor) 		5 ILE A 690
ILE A 694
LEU A 713
ILE A 655
PHE A 698
 None
 1.04A 3gwsX-5kcaA:
undetectable		 3gwsX-5kcaA:
15.53
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.
5tz8 GLYCOSYL TRANSFERASE

(Staphylococcus
aureus) 		PF00535
(Glycos_transf_2) 		5 ILE A 192
ALA A 189
MET A 183
ALA A 235
ILE A 232
 None
 1.07A 3gwsX-5tz8A:
undetectable		 3gwsX-5tz8A:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Acinetobacter
baumannii) 		PF00275
(EPSP_synthase) 		5 ILE A 170
ALA A 173
ALA A 146
LEU A  98
ILE A 137
 None
 0.99A 3gwsX-5u4hA:
undetectable		 3gwsX-5u4hA:
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.
5uzh NAFOA.00085.B

(Naegleria
fowleri) 		PF16363
(GDP_Man_Dehyd) 		5 ILE A  82
ALA A  87
ALA A  50
LEU A  78
ILE A  41
 None
 1.09A 3gwsX-5uzhA:
undetectable		 3gwsX-5uzhA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v77 UNCHARACTERIZED
PROTEIN

(Neisseria
gonorrhoeae) 		no annotation 5 ILE A  98
ILE A  93
LEU A  11
ILE A  69
PHE A  47
 None
 0.99A 3gwsX-5v77A:
undetectable		 3gwsX-5v77A:
17.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Komagataella
phaffii) 		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)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		5 ILE B 247
ALA B 229
ALA B 382
LEU B 249
LEU B 306
 None
 0.93A 3gwsX-5xogB:
undetectable		 3gwsX-5xogB:
12.74
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.
5xto FAD-LINKED
SULFHYDRYL OXIDASE

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF05214
(Baculo_p33) 		5 ALA A 202
ALA A 179
LEU A 216
ILE A 176
HIS A 172
 None
 1.02A 3gwsX-5xtoA:
undetectable		 3gwsX-5xtoA:
19.62
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.
6bvd LIGHT CHAIN

(Clostridium
botulinum) 		no annotation 5 ILE A  45
ILE A  46
ALA A  36
ALA A 151
ILE A 190
 None
 0.93A 3gwsX-6bvdA:
undetectable		 3gwsX-6bvdA:
18.69
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.
6c87 RAB GDP DISSOCIATION
INHIBITOR ALPHA

(Naegleria
fowleri) 		no annotation 5 ALA A 191
ALA A 204
LEU A 144
ILE A 172
PHE A 185
 None
 1.03A 3gwsX-6c87A:
undetectable		 3gwsX-6c87A:
15.98
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.
6fbt LYTIC MUREIN
TRANSGLYCOSYLASE

(Pseudomonas
aeruginosa) 		no annotation 5 ILE A 442
ILE A 461
ALA A 445
ALA A 433
LEU A 441
 None
 0.98A 3gwsX-6fbtA:
undetectable		 3gwsX-6fbtA:
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.
6gu8 -

(-) 		no annotation 6 ILE A 276
ILE A 277
ALA A 358
LEU A 338
ILE A 373
HIS A 392
 None
 1.45A 3gwsX-6gu8A:
undetectable		 3gwsX-6gu8A:
undetectable