SIMILAR PATTERNS OF AMINO ACIDS FOR 3FI0_Q_TRPQ1001

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.
1c9w CHO REDUCTASE

(Cricetulus
griseus) 		PF00248
(Aldo_ket_red) 		4 GLY A  55
ILE A  42
VAL A  31
VAL A  27
 None
 0.74A 3fi0Q-1c9wA:
undetectable		 3fi0Q-1c9wA:
23.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d2r PROTEIN
(TRYPTOPHANYL TRNA
SYNTHETASE)

(Geobacillus
stearothermophilus) 		PF00579
(tRNA-synt_1b) 		8 GLY A   7
GLN A   9
VAL A  40
HIS A  43
ASP A 132
ILE A 133
VAL A 141
VAL A 143
 None
 0.40A 3fi0Q-1d2rA:
42.0		 3fi0Q-1d2rA:
98.77
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.
1i7o 4-HYDROXYPHENYLACETA
TE DEGRADATION
BIFUNCTIONAL
ISOMERASE/DECARBOXYL
ASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		5 VAL A 372
HIS A 347
ILE A 343
VAL A 415
VAL A 412
 None
 1.27A 3fi0Q-1i7oA:
undetectable		 3fi0Q-1i7oA:
24.78
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.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum) 		PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ) 		4 GLY A 388
ILE A 364
VAL A 367
VAL A 375
 None
 0.75A 3fi0Q-1k32A:
undetectable		 3fi0Q-1k32A:
16.74
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.
1kj9 PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE 2

(Escherichia
coli) 		PF02222
(ATP-grasp) 		4 GLN A 349
ILE A 326
VAL A 388
VAL A 340
 None
 0.65A 3fi0Q-1kj9A:
undetectable		 3fi0Q-1kj9A:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mns MANDELATE RACEMASE

(Pseudomonas
putida) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLN A 210
ILE A 167
VAL A 194
VAL A 217
 None
 0.79A 3fi0Q-1mnsA:
undetectable		 3fi0Q-1mnsA:
22.22
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 GLN A 333
VAL A 364
ILE A 407
VAL A 308
 None
 0.79A 3fi0Q-1n5xA:
undetectable		 3fi0Q-1n5xA:
14.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q1n HYPOTHETICAL
ZINC-TYPE ALCOHOL
DEHYDROGENASE-LIKE
PROTEIN IN PRE5-FET4
INTERGENIC REGION

(Saccharomyces
cerevisiae) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 ASP A  35
ILE A  36
VAL A 146
VAL A  93
 None
 0.77A 3fi0Q-1q1nA:
undetectable		 3fi0Q-1q1nA:
23.86
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.
1tz0 HYPOTHETICAL PROTEIN

(Bacillus cereus) 		PF03992
(ABM) 		4 VAL A  13
HIS A  90
VAL A  56
VAL A  42
 None
 0.73A 3fi0Q-1tz0A:
undetectable		 3fi0Q-1tz0A:
15.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u2h AORTIC
PREFERENTIALLY
EXPRESSED PROTEIN 1

(Homo sapiens) 		PF07679
(I-set) 		4 GLY A  34
ASP A  36
VAL A  31
VAL A 110
 None
 0.79A 3fi0Q-1u2hA:
undetectable		 3fi0Q-1u2hA:
15.64
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.
1uep MEMBRANE ASSOCIATED
GUANYLATE KINASE
INVERTED-2 (MAGI-2)

(Homo sapiens) 		PF00595
(PDZ) 		4 GLN A  34
ILE A  26
VAL A  75
VAL A  67
 None
 0.79A 3fi0Q-1uepA:
undetectable		 3fi0Q-1uepA:
15.84
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.
1uep MEMBRANE ASSOCIATED
GUANYLATE KINASE
INVERTED-2 (MAGI-2)

(Homo sapiens) 		PF00595
(PDZ) 		4 GLY A  29
ILE A  26
VAL A  75
VAL A  67
 None
 0.65A 3fi0Q-1uepA:
undetectable		 3fi0Q-1uepA:
15.84
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.
1us4 PUTATIVE GLUR0
LIGAND BINDING CORE

(Thermus
thermophilus) 		PF16868
(NMT1_3) 		4 GLN A 145
ILE A 214
VAL A 244
VAL A 113
 None
 0.67A 3fi0Q-1us4A:
undetectable		 3fi0Q-1us4A:
23.90
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.
1xfg GLUCOSAMINE--FRUCTOS
E-6-PHOSPHATE
AMINOTRANSFERASE
[ISOMERIZING]

(Escherichia
coli) 		PF13522
(GATase_6) 		4 GLY A  68
ILE A 189
VAL A 159
VAL A  96
 None
 0.77A 3fi0Q-1xfgA:
undetectable		 3fi0Q-1xfgA:
24.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y7n AMYLOID BETA A4
PRECURSOR
PROTEIN-BINDING
FAMILY A MEMBER 1

(Homo sapiens) 		PF00595
(PDZ) 		4 GLY A  27
GLN A  25
ILE A  35
VAL A  49
 None
 0.63A 3fi0Q-1y7nA:
undetectable		 3fi0Q-1y7nA:
13.04
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.
2a9v GMP SYNTHASE

(Thermoplasma
acidophilum) 		PF00117
(GATase) 		4 GLY A 118
ASP A 178
ILE A 179
VAL A 109
 None
 0.72A 3fi0Q-2a9vA:
undetectable		 3fi0Q-2a9vA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2az3 NUCLEOSIDE
DIPHOSPHATE KINASE

(Halobacterium
salinarum) 		PF00334
(NDK) 		4 GLY A  20
ASP A  24
ILE A  25
VAL A  12
 None
 0.75A 3fi0Q-2az3A:
undetectable		 3fi0Q-2az3A:
20.99
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.
2cya TYROSYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		4 GLY A  41
HIS A  77
ASP A 172
ILE A 173
 None
 0.47A 3fi0Q-2cyaA:
20.8		 3fi0Q-2cyaA:
25.77
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.
2cyb TYROSYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF00579
(tRNA-synt_1b) 		4 GLY A  38
HIS A  74
ASP A 165
ILE A 166
 None
 0.59A 3fi0Q-2cybA:
20.2		 3fi0Q-2cybA:
24.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		5 GLY A   7
VAL A  42
ILE A 137
VAL A 145
VAL A 147
 None
 0.57A 3fi0Q-2el7A:
32.9		 3fi0Q-2el7A:
40.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		4 VAL A  42
ASP A 136
ILE A 137
VAL A 145
 None
 0.75A 3fi0Q-2el7A:
32.9		 3fi0Q-2el7A:
40.86
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.
2f43 ATP SYNTHASE ALPHA
CHAIN, MITOCHONDRIAL

(Rattus
norvegicus) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		4 GLY A 250
VAL A 204
VAL A  97
VAL A 129
 None
 0.75A 3fi0Q-2f43A:
undetectable		 3fi0Q-2f43A:
22.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g36 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermotoga
maritima) 		PF00579
(tRNA-synt_1b) 		6 GLY A   6
HIS A  43
ASP A 136
ILE A 137
VAL A 145
VAL A 147
 TRP  A 401 (-4.1A)
TRP  A 401 (-3.9A)
TRP  A 401 (-3.8A)
TRP  A 401 (-4.9A)
TRP  A 401 (-4.7A)
None
 0.49A 3fi0Q-2g36A:
33.1		 3fi0Q-2g36A:
37.99
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.
2is7 ALDOSE REDUCTASE

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		4 GLY A  55
ILE A  42
VAL A  31
VAL A  27
 None
 0.69A 3fi0Q-2is7A:
undetectable		 3fi0Q-2is7A:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n59 PUTATIVE
UNCHARACTERIZED
PROTEIN CSGH

(Rhodopseudomonas
palustris) 		no annotation 4 GLY A  29
ILE A  21
VAL A  81
VAL A  86
 None
 0.75A 3fi0Q-2n59A:
undetectable		 3fi0Q-2n59A:
18.15
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.
2qsi PUTATIVE HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HUPG

(Rhodopseudomonas
palustris) 		PF07449
(HyaE) 		4 GLY A  31
ILE A  27
VAL A  34
VAL A  67
 None
 0.74A 3fi0Q-2qsiA:
undetectable		 3fi0Q-2qsiA:
17.98
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.
2v65 L-LACTATE
DEHYDROGENASE A
CHAIN

(Champsocephalus
gunnari) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 GLN A 314
VAL A 200
VAL A 275
VAL A 281
 None
 0.75A 3fi0Q-2v65A:
undetectable		 3fi0Q-2v65A:
19.33
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.
2ywg GTP-BINDING PROTEIN
LEPA

(Aquifex
aeolicus) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF06421
(LepA_C) 		4 GLN A 113
HIS A  83
VAL A 408
VAL A 410
 None
 0.74A 3fi0Q-2ywgA:
undetectable		 3fi0Q-2ywgA:
20.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yy5 TRYPTOPHANYL-TRNA
SYNTHETASE

(Mycoplasma
pneumoniae) 		PF00579
(tRNA-synt_1b) 		7 GLY A   8
GLN A  10
HIS A  44
ASP A 140
ILE A 141
VAL A 149
VAL A 151
 WSA  A1350 (-3.7A)
WSA  A1350 (-3.6A)
WSA  A1350 (-3.5A)
WSA  A1350 (-4.1A)
WSA  A1350 ( 4.9A)
None
WSA  A1350 ( 3.7A)
 0.70A 3fi0Q-2yy5A:
35.2		 3fi0Q-2yy5A:
40.52
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.
2zoo PROBABLE NITRITE
REDUCTASE

(Pseudoalteromonas
haloplanktis) 		PF00034
(Cytochrom_C)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3) 		4 GLY A  67
ILE A  70
VAL A  64
VAL A 144
 None
 0.71A 3fi0Q-2zooA:
undetectable		 3fi0Q-2zooA:
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.
2ztg ALANYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		4 GLY A 206
ASP A 183
ILE A 184
VAL A 210
 None
None
None
A5A  A 801 (-4.8A)
 0.76A 3fi0Q-2ztgA:
undetectable		 3fi0Q-2ztgA:
17.50
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.
2zua NUCLEOSIDE
DIPHOSPHATE KINASE

(Haloarcula
quadrata) 		PF00334
(NDK) 		4 GLY A  19
ASP A  23
ILE A  24
VAL A  11
 None
 0.73A 3fi0Q-2zuaA:
undetectable		 3fi0Q-2zuaA:
19.94
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.
3a05 TRYPTOPHANYL-TRNA
SYNTHETASE

(Aeropyrum
pernix) 		PF00579
(tRNA-synt_1b) 		4 GLY A  76
ASP A 195
ILE A 196
VAL A 212
 TRP  A 377 (-3.6A)
TRP  A 377 (-3.6A)
None
None
 0.42A 3fi0Q-3a05A:
2.5		 3fi0Q-3a05A:
25.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a21 PUTATIVE SECRETED
ALPHA-GALACTOSIDASE

(Streptomyces
avermitilis) 		PF00652
(Ricin_B_lectin)
PF16499
(Melibiase_2) 		4 GLN A 653
ILE A 614
VAL A 657
VAL A 535
 GOL  A 903 ( 4.5A)
None
None
None
 0.75A 3fi0Q-3a21A:
undetectable		 3fi0Q-3a21A:
19.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ce1 SUPEROXIDE DISMUTASE
[CU-ZN]

(Naganishia
liquefaciens) 		PF00080
(Sod_Cu) 		4 VAL A  17
ILE A  21
VAL A 101
VAL A  91
 None
 0.69A 3fi0Q-3ce1A:
undetectable		 3fi0Q-3ce1A:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dul O-METHYLTRANSFERASE,
PUTATIVE

(Bacillus cereus) 		PF01596
(Methyltransf_3) 		4 GLN A  51
ILE A 103
VAL A 112
VAL A  86
 None
 0.69A 3fi0Q-3dulA:
undetectable		 3fi0Q-3dulA:
23.22
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.
3g77 CYTOSINE DEAMINASE

(Escherichia
coli) 		PF07969
(Amidohydro_3) 		4 GLN A 283
HIS A 246
ASP A 313
VAL A 330
 None
FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
None
 0.79A 3fi0Q-3g77A:
undetectable		 3fi0Q-3g77A:
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.
3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL

(Schizosaccharomyces
pombe) 		PF00682
(HMGL-like) 		4 GLN A  47
ILE A 251
VAL A 294
VAL A 298
 AKG  A1000 ( 4.9A)
None
None
None
 0.77A 3fi0Q-3ivuA:
undetectable		 3fi0Q-3ivuA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j31 A223 PENTON BASE

(Sulfolobus
turreted
icosahedral
virus 1) 		no annotation 4 GLN Q  85
ASP Q 102
VAL Q  28
VAL Q 113
 None
 0.78A 3fi0Q-3j31Q:
undetectable		 3fi0Q-3j31Q:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j9u V-TYPE PROTON ATPASE
CATALYTIC SUBUNIT A

(Saccharomyces
cerevisiae) 		no annotation 4 GLY C 336
VAL C 281
VAL C  94
VAL C 217
 None
 0.76A 3fi0Q-3j9uC:
undetectable		 3fi0Q-3j9uC:
20.10
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.
3jrr INOSITOL
1,4,5-TRISPHOSPHATE
RECEPTOR TYPE 3

(Mus musculus) 		PF08709
(Ins145_P3_rec) 		4 GLY A 119
ILE A 122
VAL A 116
VAL A 177
 None
 0.60A 3fi0Q-3jrrA:
undetectable		 3fi0Q-3jrrA:
19.94
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.
3jtw DIHYDROFOLATE
REDUCTASE

(Pediococcus
pentosaceus) 		PF01872
(RibD_C) 		4 GLN A 105
VAL A   5
ILE A 120
VAL A  79
 None
None
SO4  A 179 ( 4.9A)
None
 0.78A 3fi0Q-3jtwA:
undetectable		 3fi0Q-3jtwA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jy6 TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Lactobacillus
brevis) 		PF13407
(Peripla_BP_4) 		4 GLN A 180
ILE A 206
VAL A 186
VAL A 244
 None
 0.77A 3fi0Q-3jy6A:
undetectable		 3fi0Q-3jy6A:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k53 FERROUS IRON
TRANSPORT PROTEIN B

(Pyrococcus
furiosus) 		PF02421
(FeoB_N) 		4 VAL A  89
ASP A  87
ILE A 112
VAL A 140
 None
 0.76A 3fi0Q-3k53A:
undetectable		 3fi0Q-3k53A:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3krb ALDOSE REDUCTASE

(Giardia
intestinalis) 		PF00248
(Aldo_ket_red) 		4 GLY A  47
ILE A  34
VAL A  23
VAL A  19
 None
 0.74A 3fi0Q-3krbA:
undetectable		 3fi0Q-3krbA:
22.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3m5w TRYPTOPHANYL-TRNA
SYNTHETASE

(Campylobacter
jejuni) 		PF00579
(tRNA-synt_1b) 		5 GLY A   6
HIS A  42
ASP A 131
ILE A 132
VAL A 140
 None
 0.51A 3fi0Q-3m5wA:
33.1		 3fi0Q-3m5wA:
39.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3m5w TRYPTOPHANYL-TRNA
SYNTHETASE

(Campylobacter
jejuni) 		PF00579
(tRNA-synt_1b) 		5 GLY A   6
HIS A  42
ILE A 132
VAL A 140
VAL A 142
 None
 0.38A 3fi0Q-3m5wA:
33.1		 3fi0Q-3m5wA:
39.47
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.
3m7n PROBABLE EXOSOME
COMPLEX EXONUCLEASE
1

(Archaeoglobus
fulgidus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 GLY D  58
ASP D 124
ILE D 125
VAL D 153
 None
 0.73A 3fi0Q-3m7nD:
undetectable		 3fi0Q-3m7nD:
24.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n9i TRYPTOPHANYL-TRNA
SYNTHETASE

(Yersinia pestis) 		PF00579
(tRNA-synt_1b) 		7 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
 0.37A 3fi0Q-3n9iA:
39.0		 3fi0Q-3n9iA:
54.94
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.
3ntv MW1564 PROTEIN

(Staphylococcus
aureus) 		PF01596
(Methyltransf_3) 		4 GLY A 181
ASP A 185
ILE A 188
VAL A 198
 None
 0.78A 3fi0Q-3ntvA:
2.2		 3fi0Q-3ntvA:
22.42
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.
3o66 GLYCINE
BETAINE/CARNITINE/CH
OLINE ABC
TRANSPORTER

(Staphylococcus
aureus) 		PF04069
(OpuAC) 		4 GLY A 219
ASP A 223
ILE A 226
VAL A 233
 None
ACT  A 323 (-4.3A)
None
None
 0.76A 3fi0Q-3o66A:
undetectable		 3fi0Q-3o66A:
21.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3prh TRYPTOPHANYL-TRNA
SYNTHETASE

(Bacillus
subtilis) 		PF00579
(tRNA-synt_1b) 		7 GLY A   8
GLN A  10
VAL A  41
HIS A  44
ASP A 133
ILE A 134
VAL A 142
 None
 0.39A 3fi0Q-3prhA:
40.4		 3fi0Q-3prhA:
69.44
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.
3pxl LACCASE

(Trametes
hirsuta) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 VAL A 474
ILE A  82
VAL A 466
VAL A 371
 None
 0.74A 3fi0Q-3pxlA:
undetectable		 3fi0Q-3pxlA:
20.94
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.
3sn0 PUTATIVE
L-ALANINE-DL-GLUTAMA
TE EPIMERASE

(Paraburkholderia
xenovorans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A 226
VAL A 189
ILE A 244
VAL A 255
 None
 0.75A 3fi0Q-3sn0A:
undetectable		 3fi0Q-3sn0A:
21.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sz3 TRYPTOPHANYL-TRNA
SYNTHETASE

(Vibrio cholerae) 		PF00579
(tRNA-synt_1b) 		6 GLY A   9
VAL A  42
ASP A 135
ILE A 136
VAL A 144
VAL A 146
 TRP  A 401 (-3.8A)
TRP  A 401 (-4.7A)
TRP  A 401 (-4.0A)
None
TRP  A 401 (-4.9A)
None
 0.53A 3fi0Q-3sz3A:
38.4		 3fi0Q-3sz3A:
52.52
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.
3ufa SERINE PROTEASE SPLA

(Staphylococcus
aureus) 		PF00089
(Trypsin) 		4 GLY A 167
ILE A 194
VAL A  35
VAL A  27
 None
 0.72A 3fi0Q-3ufaA:
undetectable		 3fi0Q-3ufaA:
20.77
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.
3ujz METALLOPROTEASE STCE

(Escherichia
coli) 		PF10462
(Peptidase_M66) 		4 GLY A 844
ASP A 842
VAL A 849
VAL A 895
 None
 0.70A 3fi0Q-3ujzA:
undetectable		 3fi0Q-3ujzA:
14.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w9i MULTIDRUG RESISTANCE
PROTEIN MEXB

(Pseudomonas
aeruginosa) 		PF00873
(ACR_tran) 		4 GLY A 179
GLN A 176
ASP A 274
VAL A 159
 None
 0.75A 3fi0Q-3w9iA:
undetectable		 3fi0Q-3w9iA:
15.22
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.
3wia NITRITE REDUCTASE

(Geobacillus
kaustophilus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 GLY A  79
ILE A  82
VAL A  76
VAL A 154
 None
 0.79A 3fi0Q-3wiaA:
undetectable		 3fi0Q-3wiaA:
18.53
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.
3wqy ALANINE--TRNA LIGASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF02272
(DHHA1)
PF07973
(tRNA_SAD) 		4 GLY A 206
ASP A 183
ILE A 184
VAL A 210
 None
 0.76A 3fi0Q-3wqyA:
undetectable		 3fi0Q-3wqyA:
16.65
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.
4ah6 ASPARTATE--TRNA
LIGASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		4 GLN A 422
VAL A 347
ILE A 342
VAL A 438
 None
 0.72A 3fi0Q-4ah6A:
undetectable		 3fi0Q-4ah6A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b62 TSSL1

(Pseudomonas
aeruginosa) 		PF00691
(OmpA) 		4 VAL A 365
ILE A 358
VAL A 332
VAL A 323
 None
 0.77A 3fi0Q-4b62A:
undetectable		 3fi0Q-4b62A:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c4o CARBONYL REDUCTASE
CPCR2

(Candida
parapsilosis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 214
GLN A 188
VAL A 218
VAL A 199
 None
 0.75A 3fi0Q-4c4oA:
undetectable		 3fi0Q-4c4oA:
21.29
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.
4dq7 MEMBRANE PROTEIN
PHI6 P5

(Pseudomonas
virus phi6) 		PF10464
(Peptidase_U40) 		4 GLY A 102
VAL A  99
ILE A  92
VAL A  70
 None
 0.79A 3fi0Q-4dq7A:
undetectable		 3fi0Q-4dq7A:
19.87
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.
4h7u PYRANOSE
DEHYDROGENASE

(Leucoagaricus
meleagris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 GLY A 283
ILE A 290
VAL A 280
VAL A 543
 FED  A 801 (-3.5A)
FED  A 801 (-4.9A)
None
None
 0.78A 3fi0Q-4h7uA:
undetectable		 3fi0Q-4h7uA:
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.
4i2o FIXK2 PROTEIN

(Bradyrhizobium
japonicum) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 GLY A 192
HIS A 148
ILE A 187
VAL A 198
 None
 0.76A 3fi0Q-4i2oA:
undetectable		 3fi0Q-4i2oA:
24.13
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.
4l3a INTERNALIN K

(Listeria
monocytogenes) 		no annotation 5 VAL A 377
ASP A 385
ILE A 386
VAL A 431
VAL A 414
 None
 1.24A 3fi0Q-4l3aA:
undetectable		 3fi0Q-4l3aA:
20.27
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.
4l9r INOSITOL
2-DEHYDROGENASE/D-CH
IRO-INOSITOL
3-DEHYDROGENASE

(Bacillus
subtilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 GLN A  90
VAL A 116
ILE A 109
VAL A  93
 None
 0.72A 3fi0Q-4l9rA:
undetectable		 3fi0Q-4l9rA:
23.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lh7 DNA LIGASE

(Enterococcus
faecalis) 		PF01653
(DNA_ligase_aden) 		4 GLY A 233
ILE A 168
VAL A 170
VAL A 229
 None
 0.73A 3fi0Q-4lh7A:
undetectable		 3fi0Q-4lh7A:
21.75
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.
4lrs ACETALDEHYDE
DEHYDROGENASE

(Thermomonospora
curvata) 		PF01118
(Semialdhyde_dh)
PF09290
(AcetDehyd-dimer) 		4 VAL B 249
ILE B 242
VAL B 279
VAL B 225
 None
None
CL  B 402 (-3.8A)
None
 0.65A 3fi0Q-4lrsB:
undetectable		 3fi0Q-4lrsB:
23.08
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.
4rdy PARATHION HYDROLASE

(Vulcanisaeta
moutnovskia) 		PF02126
(PTE) 		4 GLY A  94
ASP A 122
ILE A 123
VAL A 166
 None
 0.79A 3fi0Q-4rdyA:
undetectable		 3fi0Q-4rdyA:
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.
4ry9 PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Verminephrobacter
eiseniae) 		PF13407
(Peripla_BP_4) 		4 GLY A 232
VAL A 238
ILE A 162
VAL A 181
 None
 0.69A 3fi0Q-4ry9A:
undetectable		 3fi0Q-4ry9A:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4txg CHITINASE

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18)
PF06483
(ChiC) 		4 GLY A 660
ASP A 658
ILE A 657
VAL A 771
 None
 0.78A 3fi0Q-4txgA:
undetectable		 3fi0Q-4txgA:
17.23
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.
4v1j FIMBRIAL PROTEIN

(Neisseria
meningitidis) 		PF00114
(Pilin) 		4 GLY A  64
VAL A  26
VAL A 115
VAL A 103
 None
 0.72A 3fi0Q-4v1jA:
undetectable		 3fi0Q-4v1jA:
17.36
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.
4xr9 CALS8

(Micromonospora
echinospora) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		4 GLY A  86
ILE A 117
VAL A  91
VAL A  16
 None
 0.76A 3fi0Q-4xr9A:
undetectable		 3fi0Q-4xr9A:
21.72
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.
5bu6 BPSB (PGAB),
POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
N-DEACETYLASE

(Bordetella
bronchiseptica) 		PF01522
(Polysacc_deac_1) 		4 VAL A 139
HIS A 189
ASP A 114
VAL A 159
 None
NI  A 401 ( 3.3A)
NI  A 401 (-2.5A)
None
 0.78A 3fi0Q-5bu6A:
undetectable		 3fi0Q-5bu6A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e0q NUCLEAR PORE COMPLEX
PROTEIN NUP98-NUP96

(Xenopus
tropicalis) 		PF04096
(Nucleoporin2) 		4 VAL B 767
ILE B 753
VAL B 778
VAL B 787
 None
 0.74A 3fi0Q-5e0qB:
undetectable		 3fi0Q-5e0qB:
19.94
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.
5e7g IPT/TIG
DOMAIN-CONTAINING
PROTEIN BACOVA_02650

(Bacteroides
ovatus) 		no annotation 4 GLY A  60
ILE A  63
VAL A  57
VAL A 131
 None
 0.79A 3fi0Q-5e7gA:
undetectable		 3fi0Q-5e7gA:
19.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		7 GLY A  40
GLN A  42
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
 0.69A 3fi0Q-5ekdA:
35.9		 3fi0Q-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		7 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
 0.38A 3fi0Q-5ekdA:
35.9		 3fi0Q-5ekdA:
40.75
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.
5f9q MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN YKNZ

(Bacillus
amyloliquefaciens) 		PF12704
(MacB_PCD) 		4 GLY A 193
VAL A 212
VAL A  52
VAL A  55
 None
 0.67A 3fi0Q-5f9qA:
undetectable		 3fi0Q-5f9qA:
18.52
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.
5fhh ATP-DEPENDENT DNA
HELICASE PIF1

(Homo sapiens) 		PF02689
(Herpes_Helicase)
PF05970
(PIF1) 		4 GLY A 342
GLN A 346
ASP A 306
ILE A 305
 ALF  A 702 ( 4.7A)
ALF  A 702 (-2.2A)
ALF  A 702 ( 4.0A)
None
 0.72A 3fi0Q-5fhhA:
undetectable		 3fi0Q-5fhhA:
22.98
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.
5g06 EXOSOME COMPLEX
COMPONENT RRP42

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL E 102
ILE E  95
VAL E  80
VAL E 128
 None
 0.77A 3fi0Q-5g06E:
undetectable		 3fi0Q-5g06E:
21.69
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.
5ho1 MAGNETOSOME PROTEIN
MAMB

(Magnetospira
sp. QH-2) 		PF16916
(ZT_dimer) 		4 GLY A 237
HIS A 245
ASP A 247
ILE A 248
 None
ZN  A 301 (-3.4A)
ZN  A 301 (-2.1A)
None
 0.79A 3fi0Q-5ho1A:
undetectable		 3fi0Q-5ho1A:
14.07
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.
5jos CYCLOHEXADIENYL
DEHYDRATASE

(synthetic
construct) 		PF00497
(SBP_bac_3) 		4 ASP A 128
ILE A 129
VAL A 177
VAL A 115
 None
 0.75A 3fi0Q-5josA:
undetectable		 3fi0Q-5josA:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jw8 MAJOR PILIN PILE

(Neisseria
meningitidis) 		PF00114
(Pilin) 		4 GLY A  85
VAL A  47
VAL A 134
VAL A 124
 None
 0.72A 3fi0Q-5jw8A:
undetectable		 3fi0Q-5jw8A:
16.51
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.
5jzx UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		4 VAL A 109
ILE A 150
VAL A 153
VAL A 192
 None
None
None
FAD  A 401 (-3.7A)
 0.73A 3fi0Q-5jzxA:
undetectable		 3fi0Q-5jzxA:
21.36
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.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		4 GLN A 103
ILE A  70
VAL A  93
VAL A  44
 None
 0.78A 3fi0Q-5lq3A:
undetectable		 3fi0Q-5lq3A:
15.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n8p S-LAYER PROTEIN

(Caulobacter
vibrioides) 		PF00353
(HemolysinCabind) 		4 GLY A 450
ILE A 481
VAL A 457
VAL A 427
 None
 0.78A 3fi0Q-5n8pA:
undetectable		 3fi0Q-5n8pA:
13.01
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.
5n97 S-LAYER PROTEIN RSAA

(Caulobacter
vibrioides) 		PF00353
(HemolysinCabind) 		4 GLY A 450
ILE A 481
VAL A 457
VAL A 427
 None
 0.78A 3fi0Q-5n97A:
undetectable		 3fi0Q-5n97A:
15.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tev TRYPTOPHAN--TRNA
LIGASE

(Neisseria
gonorrhoeae) 		PF00579
(tRNA-synt_1b) 		6 GLY A   9
HIS A  47
ASP A 145
ILE A 146
VAL A 154
VAL A 156
 None
 0.42A 3fi0Q-5tevA:
33.2		 3fi0Q-5tevA:
33.62
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.
5tvo S-ADENOSYLMETHIONINE
DECARBOXYLASE
PROENZYME

(Trypanosoma
brucei) 		PF01536
(SAM_decarbox) 		4 VAL A 119
ILE A 112
VAL A  95
VAL A  90
 None
 0.74A 3fi0Q-5tvoA:
undetectable		 3fi0Q-5tvoA:
22.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v0i TRYPTOPHAN--TRNA
LIGASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		8 GLY A   9
GLN A  11
VAL A  42
HIS A  45
ASP A 135
ILE A 136
VAL A 144
VAL A 146
 TRP  A 402 (-3.7A)
TRP  A 402 (-4.2A)
TRP  A 402 (-4.7A)
TRP  A 402 (-3.6A)
TRP  A 402 (-3.9A)
None
None
None
 0.45A 3fi0Q-5v0iA:
39.7		 3fi0Q-5v0iA:
57.23
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.
5wpk 3-HYDROXY-3-METHYLGL
UTARYL COENZYME A
REDUCTASE

(Streptococcus
pneumoniae) 		no annotation 4 GLY A 277
VAL A 335
ILE A 272
VAL A 322
 None
 0.79A 3fi0Q-5wpkA:
undetectable		 3fi0Q-5wpkA:
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.
5wx1 SERINE PROTEASE NS3

(Pestivirus C) 		PF00271
(Helicase_C)
PF05578
(Peptidase_S31)
PF07652
(Flavi_DEAD) 		4 GLY A 164
VAL A  67
ILE A 167
VAL A 117
 None
 0.67A 3fi0Q-5wx1A:
undetectable		 3fi0Q-5wx1A:
19.65
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.
5xcx VL-SARAH(S37C)
CHIMERA

(Homo sapiens;
Mus musculus) 		PF07686
(V-set)
PF11629
(Mst1_SARAH) 		4 HIS B  34
ILE B  29
VAL B  25
VAL B   4
 None
 0.76A 3fi0Q-5xcxB:
undetectable		 3fi0Q-5xcxB:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xmd EPOXIDE HYDROLASE A

(Vigna radiata) 		no annotation 5 GLY A  91
ASP A  88
ILE A  87
VAL A  95
VAL A  26
 None
 1.49A 3fi0Q-5xmdA:
undetectable		 3fi0Q-5xmdA:
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.
5zct -

(-) 		no annotation 4 GLY A 246
ASP A 248
ILE A 249
VAL A 197
 None
 0.75A 3fi0Q-5zctA:
undetectable		 3fi0Q-5zctA:
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.
6dfu TRYPTOPHAN--TRNA
LIGASE

(Haemophilus
influenzae) 		no annotation 8 GLY A   9
GLN A  11
VAL A  42
HIS A  45
ASP A 135
ILE A 136
VAL A 144
VAL A 146
 TRP  A 501 (-3.5A)
TRP  A 501 (-4.2A)
TRP  A 501 ( 4.6A)
TRP  A 501 (-4.0A)
TRP  A 501 (-3.9A)
None
None
None
 0.74A 3fi0Q-6dfuA:
39.8		 3fi0Q-6dfuA:
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.
7pcy PLASTOCYANIN

(Ulva prolifera) 		PF00127
(Copper-bind) 		4 GLY A  24
ILE A  27
VAL A  21
VAL A  98
 None
 0.79A 3fi0Q-7pcyA:
undetectable		 3fi0Q-7pcyA:
14.86