SIMILAR PATTERNS OF AMINO ACIDS FOR 3ARU_A_PNXA607

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.
1azz COLLAGENASE

(Leptuca
pugilator) 		PF00089
(Trypsin) 		4 GLY A 140
THR A 139
PHE A  41
GLY A  43
 None
 0.75A 3aruA-1azzA:
undetectable		 3aruA-1azzA:
17.43
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.
1bgp BARLEY GRAIN
PEROXIDASE

(Hordeum vulgare) 		PF00141
(peroxidase) 		4 VAL A 144
GLY A  68
THR A  67
GLY A  64
 None
 0.71A 3aruA-1bgpA:
undetectable		 3aruA-1bgpA:
18.00
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.
1dab P.69 PERTACTIN

(Bordetella
pertussis) 		PF03212
(Pertactin) 		5 VAL A  61
GLY A  77
THR A  78
GLY A 128
ALA A 106
 None
 1.20A 3aruA-1dabA:
undetectable		 3aruA-1dabA:
23.15
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.
1dih DIHYDRODIPICOLINATE
REDUCTASE

(Escherichia
coli) 		PF01113
(DapB_N)
PF05173
(DapB_C) 		4 VAL A 133
GLY A 169
THR A 170
ALA A 173
 None
 0.66A 3aruA-1dihA:
undetectable		 3aruA-1dihA:
19.79
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.
1e1c METHYLMALONYL-COA
MUTASE ALPHA CHAIN

(Propionibacterium
freudenreichii) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding) 		4 PHE A 280
GLY A 270
ALA A 269
GLU A 428
 None
 0.74A 3aruA-1e1cA:
5.1		 3aruA-1e1cA:
22.88
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.
1eg7 FORMYLTETRAHYDROFOLA
TE SYNTHETASE

(Moorella
thermoacetica) 		PF01268
(FTHFS) 		5 VAL A1092
GLY A1080
THR A1082
GLY A1419
ALA A1084
 None
 1.32A 3aruA-1eg7A:
1.9		 3aruA-1eg7A:
23.11
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.
1fbw ENDO-1,4-BETA-GLUCAN
ASE F

([Clostridium]
cellulolyticum) 		PF02011
(Glyco_hydro_48) 		4 GLY A  76
THR A  75
GLU A  64
GLY A  68
 None
 0.69A 3aruA-1fbwA:
undetectable		 3aruA-1fbwA:
22.38
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.
1i16 INTERLEUKIN 16

(Homo sapiens) 		PF00595
(PDZ) 		4 VAL A 110
GLY A  43
GLY A  67
ALA A  68
 None
 0.72A 3aruA-1i16A:
undetectable		 3aruA-1i16A:
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.
1ism BONE MARROW STROMAL
CELL ANTIGEN 1

(Homo sapiens) 		PF02267
(Rib_hydrolayse) 		4 GLY A 166
THR A 165
GLU A 204
GLY A 161
 None
 0.77A 3aruA-1ismA:
2.0		 3aruA-1ismA:
18.03
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.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans) 		PF00704
(Glyco_hydro_18) 		4 THR A 165
GLU A 204
GLY A 210
GLU A 366
 None
GOL  A1007 (-3.7A)
None
None
 0.58A 3aruA-1itxA:
44.8		 3aruA-1itxA:
29.57
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.
1jxn ANTI-H(O) LECTIN I

(Ulex europaeus) 		PF00139
(Lectin_legB) 		4 GLY A  46
THR A  45
GLY A 108
ALA A 103
 None
 0.73A 3aruA-1jxnA:
undetectable		 3aruA-1jxnA:
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.
1ka9 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF00977
(His_biosynth) 		4 VAL F 197
GLY F 165
GLY F 122
ALA F 123
 None
 0.75A 3aruA-1ka9F:
5.0		 3aruA-1ka9F:
16.84
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.
1kfw CHITINASE B

(Arthrobacter
sp. TAD20) 		PF00704
(Glyco_hydro_18) 		4 THR A 137
GLU A 192
GLY A 199
GLU A 353
 None
GOL  A 530 (-3.9A)
None
None
 0.62A 3aruA-1kfwA:
39.6		 3aruA-1kfwA:
26.23
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.
1nbw GLYCEROL DEHYDRATASE
REACTIVASE ALPHA
SUBUNIT

(Klebsiella
pneumoniae) 		PF08841
(DDR) 		5 VAL A 359
GLY A 264
GLU A 302
GLY A 308
ALA A 307
 None
 1.15A 3aruA-1nbwA:
undetectable		 3aruA-1nbwA:
23.11
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.
1ofu CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 VAL A 312
GLY A 315
THR A 314
GLY A 257
ALA A 258
 None
 1.38A 3aruA-1ofuA:
3.3		 3aruA-1ofuA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1orr CDP-TYVELOSE-2-EPIME
RASE

(Salmonella
enterica) 		PF16363
(GDP_Man_Dehyd) 		5 VAL A  30
GLY A  11
PHE A 201
GLY A  38
ALA A  39
 None
NAD  A1200 (-3.1A)
None
None
NAD  A1200 ( 4.1A)
 1.30A 3aruA-1orrA:
undetectable		 3aruA-1orrA:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oyp RIBONUCLEASE PH

(Bacillus
subtilis) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL A 118
GLY A 124
THR A 125
ALA A 128
 None
SO4  A 301 (-3.8A)
SO4  A 301 (-3.1A)
None
 0.69A 3aruA-1oypA:
undetectable		 3aruA-1oypA:
18.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p1m HYPOTHETICAL PROTEIN
TM0936

(Thermotoga
maritima) 		PF01979
(Amidohydro_1) 		5 VAL A 125
GLY A  95
THR A  96
ALA A  99
GLU A 118
 None
 1.44A 3aruA-1p1mA:
5.6		 3aruA-1p1mA:
21.50
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.
1p9w GENERAL SECRETION
PATHWAY PROTEIN E

(Vibrio cholerae) 		PF00437
(T2SSE) 		4 VAL A 387
GLY A 264
THR A 263
GLY A 269
 None
None
None
ANP  A 701 (-3.1A)
 0.76A 3aruA-1p9wA:
undetectable		 3aruA-1p9wA:
21.24
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.
1q8f PYRIMIDINE
NUCLEOSIDE HYDROLASE

(Escherichia
coli) 		PF01156
(IU_nuc_hydro) 		4 GLY A 157
THR A 156
GLY A 152
ALA A 153
 None
 0.75A 3aruA-1q8fA:
undetectable		 3aruA-1q8fA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qh5 PROTEIN
(HYDROXYACYLGLUTATHI
ONE HYDROLASE)

(Homo sapiens) 		PF00753
(Lactamase_B)
PF16123
(HAGH_C) 		4 GLY A  83
GLU A  64
GLY A  61
ALA A  60
 None
 0.61A 3aruA-1qh5A:
undetectable		 3aruA-1qh5A:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r6m RIBONUCLEASE PH

(Pseudomonas
aeruginosa) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL A 119
GLY A 125
THR A 126
ALA A 129
 None
PO4  A 242 (-3.6A)
PO4  A 242 (-2.8A)
None
 0.64A 3aruA-1r6mA:
undetectable		 3aruA-1r6mA:
18.91
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.
1r88 MPT51/MPB51 ANTIGEN

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		4 VAL A  62
GLY A 143
GLY A 150
ALA A 151
 None
 0.75A 3aruA-1r88A:
undetectable		 3aruA-1r88A:
19.73
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.
1rk2 RIBOKINASE

(Escherichia
coli) 		PF00294
(PfkB) 		5 VAL A  87
GLY A  65
THR A  64
GLY A 115
ALA A 116
 None
 1.38A 3aruA-1rk2A:
undetectable		 3aruA-1rk2A:
19.52
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 2

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY B 390
GLU B 160
GLY B 163
ALA B 162
GLU B 308
 None
 1.10A 3aruA-1tqyB:
undetectable		 3aruA-1tqyB:
23.91
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.
1u7g PROBABLE AMMONIUM
TRANSPORTER

(Escherichia
coli) 		PF00909
(Ammonium_transp) 		5 VAL A 299
GLY A 292
GLY A 268
ALA A 267
GLU A 249
 BOG  A 400 ( 4.6A)
None
None
None
BOG  A 400 (-3.7A)
 1.25A 3aruA-1u7gA:
undetectable		 3aruA-1u7gA:
23.68
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.
1urj MAJOR DNA-BINDING
PROTEIN

(Human
alphaherpesvirus
1) 		PF00747
(Viral_DNA_bp) 		4 GLY A 412
THR A 413
PHE A 287
ALA A 416
 None
 0.72A 3aruA-1urjA:
undetectable		 3aruA-1urjA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v5f PYRUVATE OXIDASE

(Aerococcus
viridans) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 VAL A 225
GLY A 217
THR A 218
ALA A 321
 None
FAD  A1601 (-3.4A)
None
FAD  A1601 (-3.5A)
 0.69A 3aruA-1v5fA:
undetectable		 3aruA-1v5fA:
23.24
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.
1w5e FTSZ

(Methanocaldococcus
jannaschii) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		4 GLY A 339
THR A 338
GLY A 281
ALA A 282
 None
 0.75A 3aruA-1w5eA:
3.2		 3aruA-1w5eA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wa5 IMPORTIN ALPHA
RE-EXPORTER
IMPORTIN ALPHA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00514
(Arm)
PF01749
(IBB)
PF03378
(CAS_CSE1)
PF03810
(IBN_N)
PF08506
(Cse1)
PF16186
(Arm_3) 		4 VAL C 914
GLY C 826
ALA C 873
GLU B 464
 None
 0.70A 3aruA-1wa5C:
undetectable		 3aruA-1wa5C:
19.90
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.
1wls L-ASPARAGINASE

(Pyrococcus
horikoshii) 		PF00710
(Asparaginase) 		4 VAL A  78
GLY A 108
THR A 107
GLY A  82
 None
 0.74A 3aruA-1wlsA:
undetectable		 3aruA-1wlsA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x9s DNA POLYMERASE

(Escherichia
virus T7) 		PF00476
(DNA_pol_A) 		5 GLY A 428
THR A 427
GLY A 424
ALA A 425
GLU A 480
 None
 1.35A 3aruA-1x9sA:
undetectable		 3aruA-1x9sA:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yzy HYPOTHETICAL PROTEIN
HI1011

(Haemophilus
influenzae) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 GLY A 236
THR A 237
GLU A  20
GLY A 372
ALA A 239
 None
 1.31A 3aruA-1yzyA:
undetectable		 3aruA-1yzyA:
22.55
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.
2a6y EMP47P (FORM1)

(Saccharomyces
cerevisiae) 		PF03388
(Lectin_leg-like) 		5 VAL A  27
GLY A  34
THR A  33
GLU A  35
ALA A  37
 None
 1.37A 3aruA-2a6yA:
undetectable		 3aruA-2a6yA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a70 EMP47P

(Saccharomyces
cerevisiae) 		PF03388
(Lectin_leg-like) 		5 VAL A  27
GLY A  34
THR A  33
GLU A  35
ALA A  37
 None
 1.31A 3aruA-2a70A:
undetectable		 3aruA-2a70A:
18.18
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.
2b9l PROPHENOLOXIDASE
ACTIVATING FACTOR

(Holotrichia
diomphalia) 		PF00089
(Trypsin) 		5 VAL A 195
GLY A 198
THR A 197
PHE A 244
ALA A 254
 None
 1.30A 3aruA-2b9lA:
undetectable		 3aruA-2b9lA:
20.07
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.
2dix INTERFERON-INDUCIBLE
DOUBLE STRANDED
RNA-DEPENDENT
PROTEIN KINASE
ACTIVATOR A

(Homo sapiens) 		PF00035
(dsrm) 		5 GLY A  56
THR A  57
GLU A  55
GLY A  54
ALA A  62
 None
 1.42A 3aruA-2dixA:
undetectable		 3aruA-2dixA:
8.94
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.
2drh 361AA LONG
HYPOTHETICAL
D-AMINOPEPTIDASE

(Pyrococcus
horikoshii) 		PF03576
(Peptidase_S58) 		4 GLY A  90
THR A  91
GLY A  70
ALA A  69
 None
 0.75A 3aruA-2drhA:
undetectable		 3aruA-2drhA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2efe SIMILARITY TO
VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN VPS9
SMALL GTP-BINDING
PROTEIN-LIKE

(Arabidopsis
thaliana) 		PF00071
(Ras)
PF02204
(VPS9) 		5 VAL B  27
GLY A 183
GLU A 186
PHE A 130
ALA A 181
 None
None
GNH  B1200 ( 4.8A)
None
None
 1.20A 3aruA-2efeB:
2.1		 3aruA-2efeB:
16.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ehr INAD-LIKE PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		4 VAL A 102
GLY A  30
GLY A  64
ALA A  63
 None
 0.69A 3aruA-2ehrA:
undetectable		 3aruA-2ehrA:
11.23
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		5 VAL A 327
GLY A 192
PHE A 182
GLY A 195
ALA A 194
 None
 1.43A 3aruA-2fj0A:
2.3		 3aruA-2fj0A:
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.
2fp7 GENOME POLYPROTEIN

(West Nile virus) 		PF00949
(Peptidase_S7) 		4 VAL B  99
GLY B 133
THR B 134
ALA B  38
 None
 0.74A 3aruA-2fp7B:
undetectable		 3aruA-2fp7B:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fr1 ERYTHROMYCIN
SYNTHASE, ERYAI

(Saccharopolyspora
erythraea) 		PF08659
(KR) 		4 VAL A1668
GLY A1689
GLY A1717
ALA A1718
 None
 0.75A 3aruA-2fr1A:
3.4		 3aruA-2fr1A:
23.95
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.
2ggv NON-STRUCTURAL
PROTEIN 3

(West Nile virus) 		PF00949
(Peptidase_S7) 		4 VAL B  99
GLY B 133
THR B 134
ALA B  38
 None
 0.74A 3aruA-2ggvB:
undetectable		 3aruA-2ggvB:
17.94
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.
2gj4 GLYCOGEN
PHOSPHORYLASE,
MUSCLE FORM

(Oryctolagus
cuniculus) 		PF00343
(Phosphorylase) 		5 GLY A 675
THR A 676
GLU A 672
GLY A 694
ALA A 695
 PLR  A 940 (-3.3A)
PLR  A 940 (-4.5A)
PLR  A 940 ( 4.5A)
None
None
 1.09A 3aruA-2gj4A:
2.2		 3aruA-2gj4A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2grj DEPHOSPHO-COA KINASE

(Thermotoga
maritima) 		PF01121
(CoaE) 		4 VAL A 121
GLY A   7
THR A   6
GLY A  12
 None
None
None
ADP  A 200 (-3.1A)
 0.72A 3aruA-2grjA:
undetectable		 3aruA-2grjA:
17.22
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.
2h9f HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF04303
(PrpF) 		4 VAL A 371
GLY A 325
THR A 326
ALA A 329
 None
 0.57A 3aruA-2h9fA:
undetectable		 3aruA-2h9fA:
20.91
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.
2iou PERTACTIN
EXTRACELLULAR DOMAIN

(Bordetella
bronchiseptica) 		PF03212
(Pertactin) 		5 VAL G  98
GLY G 114
THR G 115
GLY G 165
ALA G 143
 None
 1.24A 3aruA-2iouG:
undetectable		 3aruA-2iouG:
22.90
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.
2j1o GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Sinapis alba) 		PF00348
(polyprenyl_synt) 		5 VAL A 202
GLU A 160
GLY A 161
ALA A 156
GLU A 216
 None
 1.48A 3aruA-2j1oA:
undetectable		 3aruA-2j1oA:
19.90
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.
2j6l ALDEHYDE
DEHYDROGENASE FAMILY
7 MEMBER A1

(Homo sapiens) 		PF00171
(Aldedh) 		4 VAL A 369
GLY A 389
THR A 388
GLY A 365
 None
 0.67A 3aruA-2j6lA:
undetectable		 3aruA-2j6lA:
21.57
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.
2jg7 ANTIQUITIN

(Acanthopagrus
schlegelii) 		PF00171
(Aldedh) 		4 VAL A 367
GLY A 387
THR A 386
GLY A 363
 None
 0.69A 3aruA-2jg7A:
undetectable		 3aruA-2jg7A:
23.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n4p TAR DNA-BINDING
PROTEIN 43

(Homo sapiens) 		no annotation 4 GLY A  36
THR A  37
GLY A  79
ALA A  75
 None
 0.64A 3aruA-2n4pA:
undetectable		 3aruA-2n4pA:
9.47
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.
2nvu MALTOSE BINDING
PROTEIN/NEDD8-ACTIVA
TING ENZYME E1
CATALYTIC SUBUNIT
CHIMERA

(Homo sapiens) 		PF00899
(ThiF)
PF08825
(E2_bind)
PF13416
(SBP_bac_8) 		4 VAL B1344
GLY B1183
GLY B1188
ALA B1189
 None
 0.74A 3aruA-2nvuB:
undetectable		 3aruA-2nvuB:
22.76
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.
2pnz PROBABLE EXOSOME
COMPLEX EXONUCLEASE
1

(Pyrococcus
abyssi) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL A 129
GLY A 135
THR A 136
ALA A 139
 None
UDP  A 250 (-3.4A)
UDP  A 250 (-2.8A)
None
 0.67A 3aruA-2pnzA:
undetectable		 3aruA-2pnzA:
18.91
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.
2q74 INOSITOL-1-MONOPHOSP
HATASE

(Mycobacterium
tuberculosis) 		PF00459
(Inositol_P) 		4 VAL A 205
GLY A 180
THR A 179
GLY A 209
 None
 0.45A 3aruA-2q74A:
undetectable		 3aruA-2q74A:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qa1 POLYKETIDE OXYGENASE
PGAE

(Streptomyces
sp. PGA64) 		PF01494
(FAD_binding_3) 		4 VAL A   7
GLY A  19
GLY A 111
ALA A 112
 None
 0.59A 3aruA-2qa1A:
undetectable		 3aruA-2qa1A:
20.13
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.
2qa2 POLYKETIDE OXYGENASE
CABE

(Streptomyces) 		PF01494
(FAD_binding_3) 		4 VAL A   7
GLY A  19
GLY A 111
ALA A 112
 None
 0.54A 3aruA-2qa2A:
undetectable		 3aruA-2qa2A:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qm1 GLUCOKINASE

(Enterococcus
faecalis) 		PF00480
(ROK) 		5 VAL A  26
GLY A 311
GLY A  69
ALA A 313
GLU A 306
 None
 1.38A 3aruA-2qm1A:
undetectable		 3aruA-2qm1A:
22.92
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.
2qq0 THYMIDINE KINASE

(Thermotoga
maritima) 		PF00265
(TK) 		4 VAL A 133
GLY A  10
THR A   9
GLY A  15
 None
None
None
ANP  A 601 (-3.2A)
 0.76A 3aruA-2qq0A:
undetectable		 3aruA-2qq0A:
16.52
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.
2vaw CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 VAL A 312
GLY A 315
THR A 314
GLY A 257
ALA A 258
 None
 1.39A 3aruA-2vawA:
3.4		 3aruA-2vawA:
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.
2vf8 EXCINUCLEASE ABC
SUBUNIT A

(Deinococcus
radiodurans) 		PF00005
(ABC_tran) 		4 VAL A 802
GLY A 530
THR A 529
GLY A 535
 None
None
None
ADP  A1844 (-3.2A)
 0.68A 3aruA-2vf8A:
undetectable		 3aruA-2vf8A:
22.12
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.
2vf8 EXCINUCLEASE ABC
SUBUNIT A

(Deinococcus
radiodurans) 		PF00005
(ABC_tran) 		4 VAL A 802
GLY A 530
THR A 529
GLY A 806
 None
 0.74A 3aruA-2vf8A:
undetectable		 3aruA-2vf8A:
22.12
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.
2vsx EUKARYOTIC
INITIATION FACTOR 4F
SUBUNIT P150

(Saccharomyces
cerevisiae) 		PF02854
(MIF4G) 		4 VAL E 700
GLY E 761
THR E 760
PHE E 798
 None
 0.68A 3aruA-2vsxE:
undetectable		 3aruA-2vsxE:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vxy CELL DIVISION
PROTEIN FTSZ

(Bacillus
subtilis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		4 GLY A 314
THR A 313
GLY A 256
ALA A 257
 None
 0.71A 3aruA-2vxyA:
3.0		 3aruA-2vxyA:
21.08
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		4 VAL A1245
THR A1275
GLY A1250
ALA A1249
 None
 0.72A 3aruA-2vz9A:
undetectable		 3aruA-2vz9A:
12.36
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.
2wfg CYTOSOLIC
LEUCYL-TRNA
SYNTHETASE

(Candida
albicans) 		PF00133
(tRNA-synt_1) 		5 VAL A 313
GLY A 408
THR A 409
GLU A 528
ALA A 353
 None
ZZB  A1529 ( 4.6A)
None
None
None
 1.47A 3aruA-2wfgA:
undetectable		 3aruA-2wfgA:
19.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		6 THR A 276
GLU A 315
PHE A 316
GLY A 321
ALA A 322
GLU A 473
 SN5  A1563 ( 3.3A)
SN5  A1566 ( 2.9A)
None
None
None
SN5  A1564 ( 3.6A)
 0.40A 3aruA-2wk2A:
33.2		 3aruA-2wk2A:
51.38
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.
2wnr PROBABLE EXOSOME
COMPLEX EXONUCLEASE
1

(Methanothermobacter
thermautotrophicus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL B 129
GLY B 135
THR B 136
ALA B 139
 None
PO4  B1237 (-3.5A)
PO4  B1237 (-2.8A)
None
 0.65A 3aruA-2wnrB:
undetectable		 3aruA-2wnrB:
17.32
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.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		5 VAL A  81
THR A  95
PHE A  37
GLY A  89
ALA A  92
 None
 1.30A 3aruA-2yxeA:
undetectable		 3aruA-2yxeA:
15.96
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.
2z1q ACYL-COA
DEHYDROGENASE

(Thermus
thermophilus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 VAL A 365
GLY A 273
GLU A  98
GLY A 268
ALA A 271
 None
 1.14A 3aruA-2z1qA:
undetectable		 3aruA-2z1qA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z2i PEPTIDYL-TRNA
HYDROLASE

(Mycobacterium
tuberculosis) 		PF01195
(Pept_tRNA_hydro) 		5 VAL A  50
GLY A  53
THR A  52
GLY A  37
ALA A  38
 None
 1.28A 3aruA-2z2iA:
undetectable		 3aruA-2z2iA:
15.16
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.
2zyj ALPHA-AMINODIPATE
AMINOTRANSFERASE

(Thermus
thermophilus) 		PF00155
(Aminotran_1_2) 		5 VAL A 349
GLY A 387
GLY A 392
ALA A 389
GLU A 381
 None
 1.14A 3aruA-2zyjA:
undetectable		 3aruA-2zyjA:
19.43
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.
3a3g LUMAZINE PROTEIN

(Photobacterium
kishitanii) 		PF00677
(Lum_binding) 		4 VAL A  41
GLY A 100
GLU A 181
GLY A 142
 DLZ  A 191 (-4.4A)
None
None
None
 0.75A 3aruA-3a3gA:
undetectable		 3aruA-3a3gA:
15.05
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.
3al8 SEMAPHORIN-6A

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI) 		4 VAL A 425
THR A 436
GLY A 430
ALA A 429
 None
 0.75A 3aruA-3al8A:
undetectable		 3aruA-3al8A:
20.46
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.
3aqp PROBABLE SECDF
PROTEIN-EXPORT
MEMBRANE PROTEIN

(Thermus
thermophilus) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG) 		4 GLY A 690
GLY A 274
ALA A 273
GLU A 524
 None
 0.64A 3aruA-3aqpA:
undetectable		 3aruA-3aqpA:
22.94
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.
3b4t RIBONUCLEASE PH

(Mycobacterium
tuberculosis) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL A 119
GLY A 125
THR A 126
ALA A 129
 None
PO4  A 260 ( 3.7A)
PO4  A 260 ( 2.8A)
None
 0.69A 3aruA-3b4tA:
undetectable		 3aruA-3b4tA:
19.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b9e CHITINASE A

(Vibrio harveyi) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		6 VAL A 205
THR A 276
PHE A 316
GLY A 321
ALA A 322
GLU A 498
 None
 1.18A 3aruA-3b9eA:
64.6		 3aruA-3b9eA:
99.66
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.
3bil PROBABLE LACI-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Corynebacterium
glutamicum) 		PF13407
(Peripla_BP_4) 		4 VAL A 272
GLY A 254
GLY A 232
ALA A 233
 None
 0.57A 3aruA-3bilA:
undetectable		 3aruA-3bilA:
21.12
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.
3cem GLYCOGEN
PHOSPHORYLASE, LIVER
FORM

(Homo sapiens) 		PF00343
(Phosphorylase) 		5 GLY A 675
THR A 676
GLU A 672
GLY A 694
ALA A 695
 PLP  A 832 ( 3.3A)
PLP  A 832 (-3.8A)
NBG  A   1 (-3.5A)
None
None
 1.14A 3aruA-3cemA:
undetectable		 3aruA-3cemA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cio TYROSINE-PROTEIN
KINASE ETK

(Escherichia
coli) 		PF13614
(AAA_31) 		5 VAL A 512
THR A 551
PHE A 604
GLY A 607
ALA A 554
 None
 1.22A 3aruA-3cioA:
undetectable		 3aruA-3cioA:
19.55
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.
3cio TYROSINE-PROTEIN
KINASE ETK

(Escherichia
coli) 		PF13614
(AAA_31) 		5 VAL A 515
THR A 551
PHE A 604
GLY A 607
ALA A 554
 None
 1.29A 3aruA-3cioA:
undetectable		 3aruA-3cioA:
19.55
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.
3dd6 RIBONUCLEASE PH

(Bacillus
anthracis) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 VAL A 118
GLY A 124
THR A 125
ALA A 128
 None
SO4  A 301 (-3.5A)
SO4  A 301 (-2.7A)
None
 0.65A 3aruA-3dd6A:
undetectable		 3aruA-3dd6A:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ddn D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00389
(2-Hacid_dh)
PF01842
(ACT)
PF02826
(2-Hacid_dh_C) 		5 VAL A 169
THR A 144
PHE A 141
GLY A 165
ALA A 166
 None
 0.97A 3aruA-3ddnA:
undetectable		 3aruA-3ddnA:
22.83
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.
3ecd SERINE
HYDROXYMETHYLTRANSFE
RASE 2

(Burkholderia
pseudomallei) 		PF00464
(SHMT) 		4 GLY A 378
GLU A 381
PHE A 421
GLY A 376
 None
None
None
GOL  A 425 ( 4.7A)
 0.76A 3aruA-3ecdA:
undetectable		 3aruA-3ecdA:
23.43
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF12708
(Pectate_lyase_3) 		5 VAL A 295
PHE A 213
GLY A 219
ALA A 240
GLU A 281
 None
 1.21A 3aruA-3eqnA:
undetectable		 3aruA-3eqnA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ewb 2-ISOPROPYLMALATE
SYNTHASE

(Listeria
monocytogenes) 		PF00682
(HMGL-like) 		5 VAL X  41
GLY X  71
THR X  70
ALA X  44
GLU X 225
 None
 0.93A 3aruA-3ewbX:
6.0		 3aruA-3ewbX:
20.48
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.
3fcj NITROALKANE OXIDASE

(Fusarium
oxysporum) 		PF00441
(Acyl-CoA_dh_1)
PF02771
(Acyl-CoA_dh_N) 		5 VAL A 370
GLY A 286
THR A 287
GLY A 281
ALA A 284
 None
 1.41A 3aruA-3fcjA:
undetectable		 3aruA-3fcjA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g5s METHYLENETETRAHYDROF
OLATE--TRNA-(URACIL-
5-)-METHYLTRANSFERAS
E TRMFO

(Thermus
thermophilus) 		PF01134
(GIDA) 		4 VAL A 340
THR A 349
GLY A  13
ALA A  12
 None
None
None
FAD  A 444 (-3.4A)
 0.75A 3aruA-3g5sA:
undetectable		 3aruA-3g5sA:
21.42
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.
3gsi N,N-DIMETHYLGLYCINE
OXIDASE

(Arthrobacter
globiformis) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		5 VAL A 154
GLY A  44
THR A  46
PHE A 205
GLY A 204
 None
FAD  A 902 (-3.4A)
FAD  A 902 (-3.4A)
None
FAD  A 902 (-3.4A)
 1.48A 3aruA-3gsiA:
undetectable		 3aruA-3gsiA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gwf CYCLOHEXANONE
MONOOXYGENASE

(Rhodococcus sp.
HI-31) 		PF00743
(FMO-like) 		5 VAL A 206
GLY A 187
THR A 186
GLY A 381
ALA A 379
 None
NAP  A 542 (-3.6A)
NAP  A 542 (-4.2A)
NAP  A 542 (-3.2A)
None
 1.44A 3aruA-3gwfA:
undetectable		 3aruA-3gwfA:
22.82
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.
3h7f SERINE
HYDROXYMETHYLTRANSFE
RASE 1

(Mycobacterium
tuberculosis) 		PF00464
(SHMT) 		4 GLY A 375
GLU A 378
PHE A 412
GLY A 373
 None
 0.76A 3aruA-3h7fA:
undetectable		 3aruA-3h7fA:
22.72
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.
3hp7 HEMOLYSIN, PUTATIVE

(Streptococcus
thermophilus) 		PF01479
(S4)
PF01728
(FtsJ) 		5 VAL A 128
GLY A  94
THR A  97
GLY A  90
ALA A  91
 None
None
None
EOH  A 301 ( 3.7A)
None
 1.38A 3aruA-3hp7A:
undetectable		 3aruA-3hp7A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i0m DNA REPAIR AND
TELOMERE MAINTENANCE
PROTEIN NBS1

(Schizosaccharomyces
pombe) 		PF00498
(FHA) 		4 GLY A 164
THR A 165
GLU A 239
ALA A 168
 None
 0.63A 3aruA-3i0mA:
undetectable		 3aruA-3i0mA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i1c DIISOPROPYL-FLUOROPH
OSPHATASE

(Loligo vulgaris) 		PF08450
(SGL) 		4 VAL A 292
GLY A  22
GLY A 230
ALA A 272
 None
 0.76A 3aruA-3i1cA:
undetectable		 3aruA-3i1cA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i6b 3-DEOXY-D-MANNO-OCTU
LOSONATE 8-PHOSPHATE
PHOSPHATASE

(Escherichia
coli) 		PF08282
(Hydrolase_3) 		4 VAL A  83
GLY A  77
THR A  76
GLU A  50
 None
PO4  A 800 (-4.1A)
PO4  A 800 (-3.8A)
None
 0.75A 3aruA-3i6bA:
undetectable		 3aruA-3i6bA:
17.32
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.
3ie1 RIBONUCLEASE
TTHA0252

(Thermus
thermophilus) 		PF00753
(Lactamase_B)
PF07521
(RMMBL)
PF10996
(Beta-Casp) 		4 GLY A 345
GLY A 348
ALA A 349
GLU A 402
 None
 0.66A 3aruA-3ie1A:
undetectable		 3aruA-3ie1A:
23.03
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.
3ieh PUTATIVE
METALLOPEPTIDASE

(Shewanella
baltica) 		PF04952
(AstE_AspA) 		5 VAL A  48
GLY A 112
THR A 111
GLY A  73
GLU A 124
 None
 1.24A 3aruA-3iehA:
undetectable		 3aruA-3iehA:
18.93
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.
3im8 MALONYL ACYL CARRIER
PROTEIN TRANSACYLASE

(Streptococcus
pneumoniae) 		PF00698
(Acyl_transf_1) 		5 VAL A 260
GLY A 228
GLY A  88
ALA A  87
GLU A 256
 None
 1.06A 3aruA-3im8A:
undetectable		 3aruA-3im8A:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iv7 ALCOHOL
DEHYDROGENASE IV

(Corynebacterium
glutamicum) 		PF00465
(Fe-ADH) 		4 VAL A  54
GLY A  95
GLY A  44
ALA A  43
 None
 0.76A 3aruA-3iv7A:
undetectable		 3aruA-3iv7A:
22.94
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.
3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL

(Schizosaccharomyces
pombe) 		PF00682
(HMGL-like) 		4 VAL A 346
GLY A 349
GLY A 319
ALA A 318
 None
 0.75A 3aruA-3ivuA:
6.8		 3aruA-3ivuA:
22.82