SIMILAR PATTERNS OF AMINO ACIDS FOR 5EEW_R_TRPR101

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.
1ezi CMP-N-ACETYLNEURAMIN
IC ACID SYNTHETASE

(Neisseria
meningitidis) 		PF02348
(CTP_transf_3) 		5 GLY A 112
THR A  35
HIS A  34
ILE A 115
ALA A 177
 None
 1.17A 5eewQ-1eziA:
undetectable
5eewR-1eziA:
undetectable		 5eewQ-1eziA:
17.03
5eewR-1eziA:
17.03
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.
1h81 POLYAMINE OXIDASE

(Zea mays) 		PF01593
(Amino_oxidase) 		5 GLY A  11
ALA A  20
ILE A  33
THR A 428
ALA A  19
 FAD  A 579 (-3.1A)
None
None
None
None
 1.09A 5eewQ-1h81A:
0.0
5eewR-1h81A:
0.0		 5eewQ-1h81A:
9.76
5eewR-1h81A:
9.76
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.
1ka0 HALOTOLERANCE
PROTEIN HAL2

(Saccharomyces
cerevisiae) 		PF00459
(Inositol_P) 		5 GLY A 306
HIS A 303
ALA A 206
HIS A 309
ALA A 200
 None
 1.19A 5eewQ-1ka0A:
0.0
5eewR-1ka0A:
0.0		 5eewQ-1ka0A:
12.32
5eewR-1ka0A:
12.32
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 GLY A 264
HIS A 131
THR A 259
SER A 389
ALA A 388
 None
None
CL  A 541 (-3.9A)
FAD  A 800 (-4.3A)
None
 1.19A 5eewQ-1knrA:
undetectable
5eewR-1knrA:
undetectable		 5eewQ-1knrA:
9.07
5eewR-1knrA:
9.07
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 GLY A 412
ALA A 510
THR A 500
THR A 417
SER A 245
 None
None
None
TRA  A 866 (-4.0A)
TRA  A 866 (-2.6A)
 1.09A 5eewQ-1l5jA:
undetectable
5eewR-1l5jA:
undetectable		 5eewQ-1l5jA:
7.07
5eewR-1l5jA:
7.07
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.
1odi PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermus
thermophilus) 		PF01048
(PNP_UDP_1) 		5 GLY A 151
ALA A 177
ILE A 104
SER A  95
ALA A  94
 None
 1.05A 5eewQ-1odiA:
0.0
5eewR-1odiA:
0.0		 5eewQ-1odiA:
14.71
5eewR-1odiA:
14.71
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.
1rzr GLUCOSE-RESISTANCE
AMYLASE REGULATOR

(Bacillus
megaterium) 		no annotation 5 ALA G 145
HIS G 131
ILE G 121
SER G 147
ALA G 146
 None
 1.17A 5eewQ-1rzrG:
undetectable
5eewR-1rzrG:
undetectable		 5eewQ-1rzrG:
13.55
5eewR-1rzrG:
13.55
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.
1v9c PRECORRIN-8X METHYL
MUTASE

(Thermus
thermophilus) 		PF02570
(CbiC) 		5 GLY A 188
ALA A 196
THR A  49
THR A 183
THR A  40
 None
 1.14A 5eewQ-1v9cA:
undetectable
5eewR-1v9cA:
undetectable		 5eewQ-1v9cA:
19.25
5eewR-1v9cA:
19.25
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.
1xhl SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY MEMBER
(5L265), PUTATIVE
TROPINONE
REDUCTASE-II

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		5 GLY A  17
ALA A  22
ILE A  18
THR A  46
ALA A  23
 NDP  A1278 (-3.1A)
None
NDP  A1278 (-4.0A)
None
None
 1.04A 5eewQ-1xhlA:
undetectable
5eewR-1xhlA:
undetectable		 5eewQ-1xhlA:
16.80
5eewR-1xhlA:
16.80
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.
1y6j L-LACTATE
DEHYDROGENASE

(Ruminiclostridium
thermocellum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A  14
ALA A  22
THR A  81
ILE A  12
ALA A 239
 None
 1.14A 5eewQ-1y6jA:
undetectable
5eewR-1y6jA:
undetectable		 5eewQ-1y6jA:
15.48
5eewR-1y6jA:
15.48
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		5 GLY A  15
ALA A  23
THR A 252
ILE A  13
SER A 495
 FAD  A 803 (-3.2A)
None
FAD  A 803 (-4.6A)
None
None
 1.03A 5eewQ-1yy5A:
undetectable
5eewR-1yy5A:
undetectable		 5eewQ-1yy5A:
9.73
5eewR-1yy5A:
9.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zwx SPHINGOMYELINASE-C

(Listeria
ivanovii) 		PF03372
(Exo_endo_phos) 		5 GLY A 227
THR A 186
HIS A 185
THR A 184
ILE A 226
 None
 1.19A 5eewQ-1zwxA:
undetectable
5eewR-1zwxA:
undetectable		 5eewQ-1zwxA:
13.62
5eewR-1zwxA:
13.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dw4 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 285
ALA A 293
THR A 624
ILE A 283
ALA A 292
 FAD  A1001 (-3.2A)
None
FAD  A1001 (-4.9A)
None
None
 1.11A 5eewQ-2dw4A:
undetectable
5eewR-2dw4A:
undetectable		 5eewQ-2dw4A:
8.15
5eewR-2dw4A:
8.15
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.
2dw4 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 285
ALA A 293
THR A 624
ILE A 283
SER A 817
 FAD  A1001 (-3.2A)
None
FAD  A1001 (-4.9A)
None
None
 0.94A 5eewQ-2dw4A:
undetectable
5eewR-2dw4A:
undetectable		 5eewQ-2dw4A:
8.15
5eewR-2dw4A:
8.15
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		5 GLY B 677
ALA B 688
THR B 417
HIS B 682
ILE B 676
 None
None
None
NI  B 901 (-2.8A)
None
 1.04A 5eewQ-2fffB:
undetectable
5eewR-2fffB:
undetectable		 5eewQ-2fffB:
11.03
5eewR-2fffB:
11.03
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		5 GLY A 184
ALA A 217
ILE A 183
SER A 219
ALA A 218
 LLP  A  58 ( 3.5A)
None
None
None
None
 1.14A 5eewQ-2gn1A:
undetectable
5eewR-2gn1A:
undetectable		 5eewQ-2gn1A:
11.99
5eewR-2gn1A:
11.99
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC

(Salmonella
enterica) 		PF00291
(PALP) 		5 GLY A 185
ALA A 217
ILE A 183
SER A 219
ALA A 218
 LLP  A  58 ( 3.8A)
None
None
None
None
 1.14A 5eewQ-2gn1A:
undetectable
5eewR-2gn1A:
undetectable		 5eewQ-2gn1A:
11.99
5eewR-2gn1A:
11.99
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.
2nrh TRANSCRIPTIONAL
ACTIVATOR, PUTATIVE,
BAF FAMILY

(Campylobacter
jejuni) 		PF03309
(Pan_kinase) 		5 GLY A  72
ALA A  77
ILE A  73
THR A  95
ALA A  78
 None
 1.09A 5eewQ-2nrhA:
undetectable
5eewR-2nrhA:
undetectable		 5eewQ-2nrhA:
18.14
5eewR-2nrhA:
18.14
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.
2nzu CATABOLITE CONTROL
PROTEIN

(Bacillus
megaterium) 		PF13377
(Peripla_BP_3) 		5 ALA G 145
HIS G 131
ILE G 121
SER G 147
ALA G 146
 None
 1.19A 5eewQ-2nzuG:
undetectable
5eewR-2nzuG:
undetectable		 5eewQ-2nzuG:
15.10
5eewR-2nzuG:
15.10
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.
2o2c GLUCOSE-6-PHOSPHATE
ISOMERASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00342
(PGI) 		5 ALA A 273
THR A 252
HIS A 199
ILE A 203
ALA A 276
 None
 1.05A 5eewQ-2o2cA:
undetectable
5eewR-2o2cA:
undetectable		 5eewQ-2o2cA:
9.57
5eewR-2o2cA:
9.57
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.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		5 GLY A  87
ALA A  92
THR A  60
SER A  94
ALA A  93
 SAM  A 300 (-3.2A)
None
None
None
None
 1.18A 5eewQ-2oxtA:
undetectable
5eewR-2oxtA:
undetectable		 5eewQ-2oxtA:
11.76
5eewR-2oxtA:
11.76
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.
2pan GLYOXYLATE
CARBOLIGASE

(Escherichia
coli) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A 394
ALA A 399
THR A 259
THR A 391
ALA A 400
 TDP  A 801 (-3.6A)
None
FAD  A 701 (-3.2A)
None
None
 1.13A 5eewQ-2panA:
undetectable
5eewR-2panA:
undetectable		 5eewQ-2panA:
9.74
5eewR-2panA:
9.74
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.
2pbg 6-PHOSPHO-BETA-D-GAL
ACTOSIDASE

(Lactococcus
lactis) 		PF00232
(Glyco_hydro_1) 		5 GLY A 213
THR A 157
ILE A 212
THR A 250
ALA A 287
 None
 1.19A 5eewQ-2pbgA:
undetectable
5eewR-2pbgA:
undetectable		 5eewQ-2pbgA:
10.65
5eewR-2pbgA:
10.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aex THREONINE SYNTHASE

(Thermus
thermophilus) 		PF00291
(PALP) 		5 GLY A 187
ALA A 292
THR A 317
ILE A 241
ALA A 293
 AN7  A1001 (-3.5A)
None
AN7  A1001 (-2.8A)
AN7  A1001 (-4.7A)
None
 1.10A 5eewQ-3aexA:
undetectable
5eewR-3aexA:
undetectable		 5eewQ-3aexA:
11.36
5eewR-3aexA:
11.36
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.
3b9g IAG-NUCLEOSIDE
HYDROLASE

(Trypanosoma
vivax) 		PF01156
(IU_nuc_hydro) 		5 GLY A 166
ALA A 194
THR A 284
ILE A 187
THR A 295
 None
 1.08A 5eewQ-3b9gA:
undetectable
5eewR-3b9gA:
undetectable		 5eewQ-3b9gA:
13.11
5eewR-3b9gA:
13.11
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.
3byw PUTATIVE
ARABINOFURANOSYLTRAN
SFERASE

(Corynebacterium
diphtheriae) 		PF04602
(Arabinose_trans) 		5 GLY A  86
ALA A 188
THR A  87
ILE A 169
ALA A  67
 None
 1.19A 5eewQ-3bywA:
undetectable
5eewR-3bywA:
undetectable		 5eewQ-3bywA:
22.45
5eewR-3bywA:
22.45
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.
3cb5 FACT COMPLEX SUBUNIT
SPT16

(Schizosaccharomyces
pombe) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 ALA A 187
THR A 426
THR A 414
ILE A 184
SER A 191
 None
 0.97A 5eewQ-3cb5A:
undetectable
5eewR-3cb5A:
undetectable		 5eewQ-3cb5A:
9.95
5eewR-3cb5A:
9.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3csk PROBABLE
DIPEPTIDYL-PEPTIDASE
3

(Saccharomyces
cerevisiae) 		PF03571
(Peptidase_M49) 		5 GLY A 322
ALA A  39
THR A 391
ILE A 321
ALA A  42
 None
 1.19A 5eewQ-3cskA:
undetectable
5eewR-3cskA:
undetectable		 5eewQ-3cskA:
7.05
5eewR-3cskA:
7.05
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.
3e8o UNCHARACTERIZED
PROTEIN WITH
FERREDOXIN-LIKE FOLD

(Deinococcus
radiodurans) 		PF03992
(ABM) 		5 GLY A  77
HIS A  80
HIS A  82
SER A  21
ALA A 107
 None
None
UNL  A 200 (-4.1A)
UNL  A 200 ( 4.9A)
None
 1.18A 5eewQ-3e8oA:
undetectable
5eewR-3e8oA:
undetectable		 5eewQ-3e8oA:
19.83
5eewR-3e8oA:
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.
3fdi UNCHARACTERIZED
PROTEIN

(Eubacterium
ventriosum) 		PF13189
(Cytidylate_kin2) 		5 GLY A  16
HIS A  17
THR A 186
ILE A   8
ALA A  24
 SO4  A2003 (-3.6A)
None
None
None
None
 1.04A 5eewQ-3fdiA:
undetectable
5eewR-3fdiA:
undetectable		 5eewQ-3fdiA:
22.44
5eewR-3fdiA:
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.
3jsk CYPBP37 PROTEIN

(Neurospora
crassa) 		PF01946
(Thi4) 		5 GLY A  86
ALA A  94
THR A 246
ILE A  84
SER A 322
 AHZ  A 500 (-3.0A)
None
None
None
None
 1.15A 5eewQ-3jskA:
undetectable
5eewR-3jskA:
undetectable		 5eewQ-3jskA:
13.37
5eewR-3jskA:
13.37
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.
3k55 BETA-HEMOLYSIN

(Staphylococcus
aureus) 		PF03372
(Exo_endo_phos) 		5 GLY A 192
THR A 151
HIS A 150
THR A 149
ILE A 191
 None
 1.16A 5eewQ-3k55A:
undetectable
5eewR-3k55A:
undetectable		 5eewQ-3k55A:
13.73
5eewR-3k55A:
13.73
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.
3kto RESPONSE REGULATOR
RECEIVER PROTEIN

(Pseudoalteromonas
atlantica) 		PF00072
(Response_reg) 		5 GLY A  72
ALA A 103
THR A  88
SER A 107
ALA A 106
 None
 1.17A 5eewQ-3ktoA:
undetectable
5eewR-3ktoA:
undetectable		 5eewQ-3ktoA:
18.94
5eewR-3ktoA:
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.
3nix FLAVOPROTEIN/DEHYDRO
GENASE

(Cytophaga
hutchinsonii) 		PF01494
(FAD_binding_3) 		5 GLY A  12
ALA A  21
ILE A  33
THR A 293
ALA A  20
 FAD  A 501 (-3.2A)
None
None
None
None
 1.03A 5eewQ-3nixA:
undetectable
5eewR-3nixA:
undetectable		 5eewQ-3nixA:
11.11
5eewR-3nixA:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3on3 KETO/OXOACID
FERREDOXIN
OXIDOREDUCTASE,
GAMMA SUBUNIT

(Geobacter
sulfurreducens) 		PF01558
(POR) 		5 GLY A  21
ALA A  27
ILE A  23
SER A  29
ALA A  28
 None
 1.02A 5eewQ-3on3A:
undetectable
5eewR-3on3A:
undetectable		 5eewQ-3on3A:
15.68
5eewR-3on3A:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ot5 UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Listeria
monocytogenes) 		PF02350
(Epimerase_2) 		5 GLY A  11
ALA A 106
THR A  40
ILE A   9
ALA A 105
 None
 1.09A 5eewQ-3ot5A:
undetectable
5eewR-3ot5A:
undetectable		 5eewQ-3ot5A:
13.22
5eewR-3ot5A:
13.22
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.
3q8n 4-AMINOBUTYRATE
TRANSAMINASE

(Mycolicibacterium
smegmatis) 		PF00202
(Aminotran_3) 		5 GLY A 237
HIS A 234
ALA A 173
THR A 416
THR A 194
 None
 1.15A 5eewQ-3q8nA:
undetectable
5eewR-3q8nA:
undetectable		 5eewQ-3q8nA:
9.98
5eewR-3q8nA:
9.98
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.
3rwb PYRIDOXAL
4-DEHYDROGENASE

(Mesorhizobium
loti) 		PF13561
(adh_short_C2) 		5 GLY A 160
ALA A 140
THR A 116
THR A 165
SER A 138
 None
 1.17A 5eewQ-3rwbA:
undetectable
5eewR-3rwbA:
undetectable		 5eewQ-3rwbA:
16.06
5eewR-3rwbA:
16.06
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.
3swx PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 GLY A 178
ALA A 117
THR A 153
ILE A 179
ALA A 120
 None
 1.20A 5eewQ-3swxA:
undetectable
5eewR-3swxA:
undetectable		 5eewQ-3swxA:
14.72
5eewR-3swxA:
14.72
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.
3tm9 BACTERIAL HEMOGLOBIN

(Vitreoscilla
stercoraria) 		PF00042
(Globin) 		5 HIS A  20
ALA A 114
THR A  13
ILE A 106
ALA A 113
 None
 1.16A 5eewQ-3tm9A:
undetectable
5eewR-3tm9A:
undetectable		 5eewQ-3tm9A:
22.70
5eewR-3tm9A:
22.70
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.
3tpc SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00106
(adh_short) 		5 GLY A 143
ALA A 128
HIS A  81
ILE A 186
ALA A 127
 None
 1.18A 5eewQ-3tpcA:
undetectable
5eewR-3tpcA:
undetectable		 5eewQ-3tpcA:
15.08
5eewR-3tpcA:
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.
3uem PROTEIN
DISULFIDE-ISOMERASE

(Homo sapiens) 		PF00085
(Thioredoxin)
PF13848
(Thioredoxin_6) 		5 GLY A 185
ALA A 146
ILE A 158
SER A 148
ALA A 145
 None
 1.19A 5eewQ-3uemA:
undetectable
5eewR-3uemA:
undetectable		 5eewQ-3uemA:
12.29
5eewR-3uemA:
12.29
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.
3wpe TOLL-LIKE RECEPTOR 9

(Bos taurus) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		5 GLY A 133
HIS A 151
THR A 152
ILE A 134
SER A 148
 None
 1.17A 5eewQ-3wpeA:
undetectable
5eewR-3wpeA:
undetectable		 5eewQ-3wpeA:
7.17
5eewR-3wpeA:
7.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zte TRYPTOPHAN OPERON
RNA-BINDING
ATTENUATION PROTEIN
(TRAP)

(Bacillus
licheniformis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
THR A  49
HIS A  51
THR A  52
ILE A  55
 TRP  A  80 (-3.5A)
TRP  A  80 ( 4.9A)
TRP  A  80 (-2.8A)
None
TRP  A  80 (-3.6A)
TRP  A  80 ( 4.6A)
 0.25A 5eewQ-3zteA:
14.1
5eewR-3zteA:
14.2		 5eewQ-3zteA:
78.21
5eewR-3zteA:
78.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzl TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
halodurans) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A  81 (-3.5A)
TRP  A  81 ( 4.7A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
 0.33A 5eewQ-3zzlA:
13.0
5eewR-3zzlA:
13.1		 5eewQ-3zzlA:
71.43
5eewR-3zzlA:
71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzl TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
halodurans) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 TRP  A  81 (-3.5A)
TRP  A  81 ( 4.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
TRP  A  81 ( 3.7A)
 0.98A 5eewQ-3zzlA:
13.0
5eewR-3zzlA:
13.1		 5eewQ-3zzlA:
71.43
5eewR-3zzlA:
71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzq TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
ALA A  46
THR A  49
THR A  52
ILE A  55
 TRP  A  81 (-3.4A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
TRP  A  81 ( 4.4A)
 0.17A 5eewQ-3zzqA:
13.6
5eewR-3zzqA:
13.6		 5eewQ-3zzqA:
80.00
5eewR-3zzqA:
80.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzq TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		5 GLY A  23
HIS A  34
THR A  49
THR A  52
ALA A  46
 TRP  A  81 (-3.4A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
TRP  A  81 ( 3.7A)
 1.04A 5eewQ-3zzqA:
13.6
5eewR-3zzqA:
13.6		 5eewQ-3zzqA:
80.00
5eewR-3zzqA:
80.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzs TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 TRP  A1072 (-3.5A)
TRP  A1072 ( 4.7A)
TRP  A1072 ( 3.8A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
TRP  A1072 ( 4.4A)
 0.16A 5eewQ-3zzsA:
13.4
5eewR-3zzsA:
13.4		 5eewQ-3zzsA:
100.00
5eewR-3zzsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzs TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 TRP  A1072 (-3.5A)
TRP  A1072 ( 4.7A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
TRP  A1072 ( 3.8A)
 1.09A 5eewQ-3zzsA:
13.4
5eewR-3zzsA:
13.4		 5eewQ-3zzsA:
100.00
5eewR-3zzsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4b27 TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 GLY  A  23 (-0.0A)
HIS  A  34 ( 1.0A)
ALA  A  46 ( 0.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
ILE  A  55 ( 0.6A)
 0.25A 5eewQ-4b27A:
13.1
5eewR-4b27A:
13.1		 5eewQ-4b27A:
76.32
5eewR-4b27A:
76.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4b27 TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 GLY  A  23 (-0.0A)
HIS  A  34 ( 1.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
ALA  A  46 ( 0.0A)
 1.14A 5eewQ-4b27A:
13.1
5eewR-4b27A:
13.1		 5eewQ-4b27A:
76.32
5eewR-4b27A:
76.32
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.
4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A

(Homo sapiens) 		PF00995
(Sec1) 		5 ALA A 500
THR A 572
THR A 545
ILE A 547
SER A 504
 None
 1.12A 5eewQ-4bx9A:
undetectable
5eewR-4bx9A:
undetectable		 5eewQ-4bx9A:
7.91
5eewR-4bx9A:
7.91
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.
4cta CINA-LIKE PROTEIN

(Thermus
thermophilus) 		PF00994
(MoCF_biosynth)
PF02464
(CinA) 		5 GLY A 276
THR A 266
ILE A 279
THR A 271
ALA A 388
 None
 1.14A 5eewQ-4ctaA:
undetectable
5eewR-4ctaA:
undetectable		 5eewQ-4ctaA:
12.96
5eewR-4ctaA:
12.96
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.
4ebj AMINOGLYCOSIDE
NUCLEOTIDYLTRANSFERA
SE

(Pseudomonas
aeruginosa) 		PF01909
(NTP_transf_2) 		5 GLY A  90
ALA A 177
THR A  93
HIS A 118
ALA A 174
 None
None
None
None
SO4  A 303 (-3.6A)
 1.14A 5eewQ-4ebjA:
undetectable
5eewR-4ebjA:
undetectable		 5eewQ-4ebjA:
14.71
5eewR-4ebjA:
14.71
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.
4gkv ALCOHOL
DEHYDROGENASE,
PROPANOL-PREFERRING

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  60
ALA A  80
THR A 144
ILE A  61
ALA A 128
 None
 1.12A 5eewQ-4gkvA:
undetectable
5eewR-4gkvA:
undetectable		 5eewQ-4gkvA:
13.15
5eewR-4gkvA:
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		5 GLY A 358
ALA A 366
THR A 418
ILE A 356
ALA A 365
 AMP  A 602 (-3.6A)
None
None
None
None
 1.14A 5eewQ-4gvlA:
undetectable
5eewR-4gvlA:
undetectable		 5eewQ-4gvlA:
10.47
5eewR-4gvlA:
10.47
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		5 HIS A 359
ALA A 366
THR A 418
ILE A 416
ALA A 365
 ZN  A 601 (-3.4A)
None
None
None
None
 1.07A 5eewQ-4gvlA:
undetectable
5eewR-4gvlA:
undetectable		 5eewQ-4gvlA:
10.47
5eewR-4gvlA:
10.47
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.
4gx0 TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N)
PF07885
(Ion_trans_2) 		5 GLY A 358
ALA A 366
THR A 418
ILE A 356
ALA A 365
 None
 1.13A 5eewQ-4gx0A:
undetectable
5eewR-4gx0A:
undetectable		 5eewQ-4gx0A:
8.70
5eewR-4gx0A:
8.70
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.
4gx0 TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N)
PF07885
(Ion_trans_2) 		5 HIS A 359
ALA A 366
THR A 418
ILE A 416
ALA A 365
 ZN  A 606 (-3.5A)
None
None
None
None
 1.14A 5eewQ-4gx0A:
undetectable
5eewR-4gx0A:
undetectable		 5eewQ-4gx0A:
8.70
5eewR-4gx0A:
8.70
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.
4h6x THIAZOLINE
OXIDASE/SUBTILISIN-L
IKE PROTEASE

(Prochloron
didemni) 		PF00082
(Peptidase_S8) 		5 HIS A 618
ALA A 785
THR A 625
ILE A 766
ALA A 786
 None
 1.13A 5eewQ-4h6xA:
undetectable
5eewR-4h6xA:
undetectable		 5eewQ-4h6xA:
13.06
5eewR-4h6xA:
13.06
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.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 GLY A 389
ALA A 397
THR A 626
ILE A 387
SER A 811
 FAD  A 901 (-3.3A)
None
None
None
None
 0.99A 5eewQ-4hsuA:
undetectable
5eewR-4hsuA:
undetectable		 5eewQ-4hsuA:
7.64
5eewR-4hsuA:
7.64
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.
4i4n INTRACELLULAR
PROTEASE/AMIDASE

(Vibrio cholerae) 		no annotation 5 GLY A 190
THR A  80
HIS A  76
ILE A 154
ALA A  58
 None
 1.10A 5eewQ-4i4nA:
undetectable
5eewR-4i4nA:
undetectable		 5eewQ-4i4nA:
12.10
5eewR-4i4nA:
12.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i6m ACTIN-LIKE PROTEIN
ARP9

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		5 GLY B 191
THR B 340
THR B 339
ILE B 194
THR B 169
 None
 1.04A 5eewQ-4i6mB:
undetectable
5eewR-4i6mB:
undetectable		 5eewQ-4i6mB:
11.93
5eewR-4i6mB:
11.93
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.
4jre IMMUNOGLOBULIN
GAMMA-2A, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY B  33
ALA B  79
THR B  53
ILE B  51
SER B  77
 None
 1.03A 5eewQ-4jreB:
undetectable
5eewR-4jreB:
undetectable		 5eewQ-4jreB:
15.89
5eewR-4jreB:
15.89
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.
4kpr THIOREDOXIN
REDUCTASE 1,
CYTOPLASMIC

(Rattus
norvegicus) 		no annotation 5 GLY E 470
HIS E 472
THR E 481
THR E 480
ILE E 469
 None
 1.18A 5eewQ-4kprE:
undetectable
5eewR-4kprE:
undetectable		 5eewQ-4kprE:
9.64
5eewR-4kprE:
9.64
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.
4lx4 ENDOGLUCANASE(ENDO-1
,4-BETA-GLUCANASE)PR
OTEIN

(Pseudomonas
stutzeri) 		PF00150
(Cellulase) 		5 GLY A 176
ALA A 156
ILE A 174
THR A 148
ALA A 155
 None
 0.95A 5eewQ-4lx4A:
undetectable
5eewR-4lx4A:
undetectable		 5eewQ-4lx4A:
13.42
5eewR-4lx4A:
13.42
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.
4lz6 BH2163 PROTEIN

(Bacillus
halodurans) 		PF01554
(MatE) 		5 GLY A  55
THR A 129
THR A 132
ILE A  58
SER A 271
 None
 1.12A 5eewQ-4lz6A:
undetectable
5eewR-4lz6A:
undetectable		 5eewQ-4lz6A:
11.37
5eewR-4lz6A:
11.37
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.
4ov4 2-ISOPROPYLMALATE
SYNTHASE

(Leptospira
biflexa) 		PF00682
(HMGL-like) 		5 GLY A 213
ALA A 217
THR A 244
HIS A 209
SER A 219
 None
None
None
ZN  A 401 ( 3.4A)
None
 1.11A 5eewQ-4ov4A:
undetectable
5eewR-4ov4A:
undetectable		 5eewQ-4ov4A:
11.11
5eewR-4ov4A:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pzc 3-HYDROXYACYL-COA
DEHYDROGENASE

(Cupriavidus
necator) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A 156
THR A 163
HIS A 164
THR A 159
ALA A 115
 None
 1.15A 5eewQ-4pzcA:
undetectable
5eewR-4pzcA:
undetectable		 5eewQ-4pzcA:
14.04
5eewR-4pzcA:
14.04
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.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		6 GLY A  84
ALA A  71
HIS A 119
THR A 115
THR A  87
ALA A  68
 None
 1.38A 5eewQ-4q0gA:
undetectable
5eewR-4q0gA:
undetectable		 5eewQ-4q0gA:
9.33
5eewR-4q0gA:
9.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qgs ALCOHOL
DEHYDROGENASE YQHD

(Escherichia
coli) 		PF00465
(Fe-ADH) 		5 GLY A 124
ALA A 106
ILE A 119
SER A 129
ALA A 130
 None
 1.14A 5eewQ-4qgsA:
undetectable
5eewR-4qgsA:
undetectable		 5eewQ-4qgsA:
11.89
5eewR-4qgsA:
11.89
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.
4rqo L-SERINE DEHYDRATASE

(Legionella
pneumophila) 		PF03313
(SDH_alpha)
PF03315
(SDH_beta) 		5 GLY A 403
ALA A 354
HIS A 379
ILE A 296
ALA A 355
 None
 1.17A 5eewQ-4rqoA:
undetectable
5eewR-4rqoA:
undetectable		 5eewQ-4rqoA:
10.45
5eewR-4rqoA:
10.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xgn 3-HYDROXYACYL-COA
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00106
(adh_short) 		5 GLY A 164
ALA A 144
THR A 115
THR A 169
SER A 142
 None
 1.10A 5eewQ-4xgnA:
undetectable
5eewR-4xgnA:
undetectable		 5eewQ-4xgnA:
13.85
5eewR-4xgnA:
13.85
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.
4yhs MONOSACCHARIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT2 FAMILY

(Bradyrhizobium
sp. BTAi1) 		PF13407
(Peripla_BP_4) 		5 GLY A 284
ALA A 293
THR A 278
ILE A 285
ALA A 274
 None
 1.06A 5eewQ-4yhsA:
undetectable
5eewR-4yhsA:
undetectable		 5eewQ-4yhsA:
14.02
5eewR-4yhsA:
14.02
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.
4ztb PROTEASE NSP2

(Chikungunya
virus) 		PF01707
(Peptidase_C9) 		5 HIS A 140
HIS A 309
THR A 308
ILE A 268
ALA A 280
 None
 1.08A 5eewQ-4ztbA:
undetectable
5eewR-4ztbA:
undetectable		 5eewQ-4ztbA:
14.60
5eewR-4ztbA:
14.60
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.
5ay9 4-O-BETA-D-MANNOSYL-
D-GLUCOSE
PHOSPHORYLASE

(Ruminococcus
albus) 		PF04041
(Glyco_hydro_130) 		5 GLY A 255
ALA A 325
THR A 322
ILE A 268
ALA A  74
 None
 1.17A 5eewQ-5ay9A:
undetectable
5eewR-5ay9A:
undetectable		 5eewQ-5ay9A:
12.60
5eewR-5ay9A:
12.60
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.
5b7n MTA/SAH NUCLEOSIDASE

(Aeromonas
hydrophila) 		PF01048
(PNP_UDP_1) 		5 GLY A 115
ALA A 105
THR A 245
HIS A 248
ALA A 217
 None
 1.05A 5eewQ-5b7nA:
undetectable
5eewR-5b7nA:
undetectable		 5eewQ-5b7nA:
15.74
5eewR-5b7nA:
15.74
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.
5dgq PUTATIVE
ENDOGLUCANASE-RELATE
D PROTEIN

(Photobacterium
profundum) 		PF00759
(Glyco_hydro_9) 		5 GLY A 290
HIS A 293
ALA A 250
ILE A 254
ALA A 244
 None
 1.06A 5eewQ-5dgqA:
undetectable
5eewR-5dgqA:
undetectable		 5eewQ-5dgqA:
8.27
5eewR-5dgqA:
8.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eex TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 None
 0.18A 5eewQ-5eexA:
15.7
5eewR-5eexA:
15.8		 5eewQ-5eexA:
100.00
5eewR-5eexA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eex TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 None
 1.11A 5eewQ-5eexA:
15.7
5eewR-5eexA:
15.8		 5eewQ-5eexA:
100.00
5eewR-5eexA:
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.
5eso 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Mycobacterium
tuberculosis) 		PF02776
(TPP_enzyme_N) 		5 HIS A 232
ALA A 402
THR A 279
THR A 250
ALA A 376
 None
 1.06A 5eewQ-5esoA:
undetectable
5eewR-5esoA:
undetectable		 5eewQ-5esoA:
7.88
5eewR-5esoA:
7.88
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.
5ggg PROTEIN
O-LINKED-MANNOSE
BETA-1,2-N-ACETYLGLU
COSAMINYLTRANSFERASE
1

(Homo sapiens) 		PF03071
(GNT-I)
PF15711
(ILEI) 		5 GLY A 181
HIS A 184
THR A 151
ILE A 131
ALA A 189
 None
 0.99A 5eewQ-5gggA:
2.0
5eewR-5gggA:
1.7		 5eewQ-5gggA:
8.92
5eewR-5gggA:
8.92
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.
5ggk PROTEIN
O-LINKED-MANNOSE
BETA-1,2-N-ACETYLGLU
COSAMINYLTRANSFERASE
1

(Homo sapiens) 		PF15711
(ILEI) 		5 GLY A 181
HIS A 184
THR A 151
ILE A 131
ALA A 189
 None
 1.01A 5eewQ-5ggkA:
1.3
5eewR-5ggkA:
1.3		 5eewQ-5ggkA:
23.23
5eewR-5ggkA:
23.23
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.
5hpn PERMUTED PDUA

(synthetic
construct) 		PF00936
(BMC) 		5 GLY A  28
ALA A  74
THR A  79
SER A  48
ALA A  49
 None
 1.15A 5eewQ-5hpnA:
undetectable
5eewR-5hpnA:
undetectable		 5eewQ-5hpnA:
23.16
5eewR-5hpnA:
23.16
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.
5hzk INTERSECTIN-1,NPH1-1
,INTERSECTIN-1

(Avena sativa;
Homo sapiens) 		PF00621
(RhoGEF)
PF13426
(PAS_9)
PF16652
(PH_13) 		5 GLY B1459
HIS B1548
THR B1539
HIS B1546
ILE B1458
 None
 1.19A 5eewQ-5hzkB:
undetectable
5eewR-5hzkB:
undetectable		 5eewQ-5hzkB:
9.11
5eewR-5hzkB:
9.11
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.
5j84 DIHYDROXY-ACID
DEHYDRATASE

(Rhizobium
leguminosarum) 		PF00920
(ILVD_EDD) 		5 GLY A 381
ILE A 382
THR A 377
SER A 315
ALA A 400
 None
 1.12A 5eewQ-5j84A:
undetectable
5eewR-5j84A:
undetectable		 5eewQ-5j84A:
8.03
5eewR-5j84A:
8.03
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.
5jn6 UNCHARACTERIZED
PROTEIN

(Rhodopseudomonas
palustris) 		no annotation 5 GLY A  16
ALA A  37
HIS A  49
ILE A  17
ALA A  36
 None
 1.14A 5eewQ-5jn6A:
undetectable
5eewR-5jn6A:
undetectable		 5eewQ-5jn6A:
24.18
5eewR-5jn6A:
24.18
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.
5kgn 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Caenorhabditis
elegans) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 GLY A 139
ALA A 213
HIS A 136
THR A 206
ALA A 226
 None
 1.18A 5eewQ-5kgnA:
undetectable
5eewR-5kgnA:
undetectable		 5eewQ-5kgnA:
11.00
5eewR-5kgnA:
11.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 285
ALA A 293
THR A 624
ILE A 283
ALA A 292
 FAD  A 901 (-3.3A)
None
None
None
None
 1.13A 5eewQ-5l3dA:
undetectable
5eewR-5l3dA:
undetectable		 5eewQ-5l3dA:
6.27
5eewR-5l3dA:
6.27
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.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 285
ALA A 293
THR A 624
ILE A 283
SER A 817
 FAD  A 901 (-3.3A)
None
None
None
None
 0.97A 5eewQ-5l3dA:
undetectable
5eewR-5l3dA:
undetectable		 5eewQ-5l3dA:
6.27
5eewR-5l3dA:
6.27
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.
5lgc ARCE4A

(Arthrobacter
sp. AW19M34-1) 		PF01522
(Polysacc_deac_1) 		5 GLY A  80
THR A 199
HIS A  77
THR A  54
ILE A 118
 None
 1.11A 5eewQ-5lgcA:
undetectable
5eewR-5lgcA:
undetectable		 5eewQ-5lgcA:
17.89
5eewR-5lgcA:
17.89
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.
5o1m RUBBER OXYGENASE

(Streptomyces
sp. K30) 		PF09995
(DUF2236) 		5 GLY A 172
ALA A 180
THR A 190
ILE A 175
SER A 186
 None
 1.19A 5eewQ-5o1mA:
undetectable
5eewR-5o1mA:
undetectable		 5eewQ-5o1mA:
12.64
5eewR-5o1mA:
12.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5sy4 CHAPERONE YAJL

(Escherichia
coli) 		PF01965
(DJ-1_PfpI) 		5 GLY A 165
ALA A 103
THR A  21
ILE A 168
ALA A 104
 None
 1.00A 5eewQ-5sy4A:
undetectable
5eewR-5sy4A:
undetectable		 5eewQ-5sy4A:
17.62
5eewR-5sy4A:
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.
5twt PEROXIDASE PVI9

(Panicum
virgatum) 		PF00141
(peroxidase) 		5 GLY A  74
ALA A 102
HIS A  42
ILE A  78
ALA A 103
 SO4  A 304 (-3.5A)
None
None
None
None
 1.19A 5eewQ-5twtA:
undetectable
5eewR-5twtA:
undetectable		 5eewQ-5twtA:
11.01
5eewR-5twtA:
11.01
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		6 GLY A 874
ALA A 726
THR A 846
ILE A 696
SER A 724
ALA A 725
 None
None
None
None
SO4  A2003 (-2.4A)
None
 1.23A 5eewQ-5ux5A:
undetectable
5eewR-5ux5A:
undetectable		 5eewQ-5ux5A:
5.76
5eewR-5ux5A:
5.76
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.
5y6r GENOME POLYPROTEIN

(Pestivirus C) 		no annotation 5 GLY A 147
ALA A 622
HIS A 626
THR A 627
ILE A 148
 SO4  A 706 ( 4.4A)
None
SO4  A 706 (-3.9A)
None
None
 1.16A 5eewQ-5y6rA:
undetectable
5eewR-5y6rA:
undetectable		 5eewQ-5y6rA:
undetectable
5eewR-5y6rA:
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.
5ygr DIAMINOPROPIONATE
AMMONIA LYASE

(Salmonella
enterica) 		no annotation 5 GLY A 126
ALA A 133
THR A 122
THR A 124
ILE A 159
 PO4  A 504 (-4.5A)
None
None
PO4  A 504 (-3.6A)
None
 1.07A 5eewQ-5ygrA:
undetectable
5eewR-5ygrA:
undetectable		 5eewQ-5ygrA:
undetectable
5eewR-5ygrA:
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.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus) 		no annotation 5 GLY A 134
HIS A 152
THR A 153
ILE A 135
SER A 149
 None
 1.12A 5eewQ-5zlnA:
undetectable
5eewR-5zlnA:
undetectable		 5eewQ-5zlnA:
undetectable
5eewR-5zlnA:
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.
6geb DOTB

(Legionella
pneumophila) 		no annotation 5 GLY A 150
ALA A 245
THR A 290
ILE A 151
THR A 251
 None
 1.13A 5eewQ-6gebA:
undetectable
5eewR-6gebA:
undetectable		 5eewQ-6gebA:
undetectable
5eewR-6gebA:
undetectable