SIMILAR PATTERNS OF AMINO ACIDS FOR 5HFJ_G_SAMG301

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.
1bgp BARLEY GRAIN
PEROXIDASE

(Hordeum vulgare) 		PF00141
(peroxidase) 		5 ALA A 184
PRO A 151
PHE A 247
SER A 187
GLU A 190
 HEM  A 400 (-4.0A)
HEM  A 400 (-4.1A)
HEM  A 400 (-4.4A)
HEM  A 400 ( 4.9A)
None
 1.37A 5hfjG-1bgpA:
undetectable		 5hfjG-1bgpA:
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.
1bgp BARLEY GRAIN
PEROXIDASE

(Hordeum vulgare) 		PF00141
(peroxidase) 		5 ALA A 184
PRO A 151
PHE A 247
THR A 200
GLU A 190
 HEM  A 400 (-4.0A)
HEM  A 400 (-4.1A)
HEM  A 400 (-4.4A)
None
None
 0.88A 5hfjG-1bgpA:
undetectable		 5hfjG-1bgpA:
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.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		5 PRO A  55
PHE A 273
GLY A 275
THR A 278
TYR A 299
 SAH  A 401 (-3.9A)
SAH  A 401 (-4.6A)
SAH  A 401 (-3.5A)
SAH  A 401 (-4.0A)
SAH  A 401 (-4.2A)
 0.51A 5hfjG-1booA:
20.0		 5hfjG-1booA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bqc PROTEIN
(BETA-MANNANASE)

(Thermobifida
fusca) 		PF00150
(Cellulase) 		5 ALA A 138
PRO A 165
GLN A  94
GLY A  92
SER A 134
 None
 1.27A 5hfjG-1bqcA:
2.1		 5hfjG-1bqcA:
22.33
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.
1e1c METHYLMALONYL-COA
MUTASE ALPHA CHAIN

(Propionibacterium
freudenreichii) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding) 		5 ALA A 715
ASP A 627
PRO A 598
PHE A 626
GLU A 588
 None
 1.23A 5hfjG-1e1cA:
undetectable		 5hfjG-1e1cA:
15.15
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA

(Moraxella bovis) 		PF01555
(N6_N4_Mtase) 		7 ASP A  30
PRO A  32
LYS A 197
PHE A 220
GLY A 222
THR A 225
TYR A 246
 SAM  A 500 (-3.7A)
None
None
SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
SAM  A 500 (-3.4A)
SAM  A 500 (-4.4A)
 0.79A 5hfjG-1g60A:
22.9		 5hfjG-1g60A:
29.63
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.
1gae D-GLYCERALDEHYDE-3-P
HOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 ALA O 294
PHE O 292
GLY O 272
THR O 289
GLU O 264
 None
 1.13A 5hfjG-1gaeO:
undetectable		 5hfjG-1gaeO:
21.95
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.
1gfn MATRIX PORIN OUTER
MEMBRANE PROTEIN F

(Escherichia
coli) 		PF00267
(Porin_1) 		5 ALA A 166
PRO A 239
PHE A 250
GLY A 206
SER A 248
 None
 1.43A 5hfjG-1gfnA:
undetectable		 5hfjG-1gfnA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j7x INTERPHOTORECEPTOR
RETINOID-BINDING
PROTEIN

(Xenopus laevis) 		PF03572
(Peptidase_S41)
PF11918
(Peptidase_S41_N) 		5 ALA A 158
THR A 214
GLY A 153
SER A 156
GLU A 220
 None
 1.40A 5hfjG-1j7xA:
undetectable		 5hfjG-1j7xA:
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.
1ms8 TRANS-SIALIDASE

(Trypanosoma
cruzi) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		5 ALA A 341
ASP A  96
THR A  98
THR A  65
SER A 343
 None
DAN  A 700 (-3.3A)
None
None
None
 1.20A 5hfjG-1ms8A:
undetectable		 5hfjG-1ms8A:
15.41
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.
1nku 3-METHYLADENINE DNA
GLYCOSYLASE I (TAG)

(Escherichia
coli) 		PF03352
(Adenine_glyco) 		5 ALA A 148
ASP A 114
PHE A 115
THR A  26
TYR A 102
 None
 1.33A 5hfjG-1nkuA:
undetectable		 5hfjG-1nkuA:
21.95
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.
1nw5 MODIFICATION
METHYLASE RSRI

(Rhodobacter
sphaeroides) 		PF01555
(N6_N4_Mtase) 		7 ASP A  65
PRO A  67
THR A 225
GLN A 226
LYS A 227
PHE A 250
GLY A 252
 SAM  A 401 (-3.3A)
SAM  A 401 (-4.3A)
SAM  A 401 (-3.6A)
None
SAM  A 401 (-4.4A)
SAM  A 401 (-4.7A)
SAM  A 401 (-3.3A)
 0.57A 5hfjG-1nw5A:
21.6		 5hfjG-1nw5A:
24.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ox4 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
HISHF

(Saccharomyces
cerevisiae) 		PF00117
(GATase)
PF00977
(His_biosynth) 		5 ASP B 230
GLY B 235
THR B 237
SER B 175
TYR B 234
 None
 1.37A 5hfjG-1ox4B:
undetectable		 5hfjG-1ox4B:
18.44
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.
1qub PROTEIN (HUMAN
BETA2-GLYCOPROTEIN
I)

(Homo sapiens) 		PF00084
(Sushi)
PF09014
(Sushi_2) 		5 ALA A  68
PRO A 116
PHE A  89
GLY A  74
GLU A  72
 None
 1.28A 5hfjG-1qubA:
undetectable		 5hfjG-1qubA:
21.01
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.
1s40 CELL DIVISION
CONTROL PROTEIN 13

(Saccharomyces
cerevisiae) 		PF02765
(POT1) 		5 ALA A 154
ASP A  51
THR A  53
PHE A  31
GLU A 160
 None
 1.25A 5hfjG-1s40A:
undetectable		 5hfjG-1s40A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s40 CELL DIVISION
CONTROL PROTEIN 13

(Saccharomyces
cerevisiae) 		PF02765
(POT1) 		5 ALA A 154
ASP A  51
THR A  53
PHE A  31
SER A 157
 None
 0.91A 5hfjG-1s40A:
undetectable		 5hfjG-1s40A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sma MALTOGENIC AMYLASE

(Thermus sp.
IM6501) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 PRO A 254
PHE A 252
THR A 288
GLU A 251
TYR A 250
 None
 1.37A 5hfjG-1smaA:
undetectable		 5hfjG-1smaA:
17.38
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.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1)
PF10423
(AMNp_N) 		5 ALA A  27
PRO A 147
PHE A  52
THR A  86
TYR A 125
 None
 1.36A 5hfjG-1t8wA:
2.3		 5hfjG-1t8wA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 420
THR A 384
GLY A 440
THR A 468
TYR A 438
 None
 1.23A 5hfjG-1tkcA:
undetectable		 5hfjG-1tkcA:
15.34
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.
1ux6 THROMBOSPONDIN-1

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C) 		5 ASP A 975
PRO A 949
GLN A 970
GLY A 977
SER A1014
 CA  A2016 (-3.4A)
None
None
None
None
 1.37A 5hfjG-1ux6A:
undetectable		 5hfjG-1ux6A:
20.47
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.
1wiw GLUCOSE-6-PHOSPHATE
ISOMERASE LIKE
PROTEIN

(Thermus
thermophilus) 		PF10432
(bact-PGI_C) 		5 ALA A 230
PRO A 194
PHE A 202
GLY A 205
GLU A 200
 None
 1.30A 5hfjG-1wiwA:
undetectable		 5hfjG-1wiwA:
20.06
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.
2b6o LENS FIBER MAJOR
INTRINSIC PROTEIN

(Ovis aries) 		PF00230
(MIP) 		5 ALA A  97
PRO A  69
THR A 138
GLY A 182
THR A 179
 None
 1.29A 5hfjG-2b6oA:
undetectable		 5hfjG-2b6oA:
21.07
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.
2b6o LENS FIBER MAJOR
INTRINSIC PROTEIN

(Ovis aries) 		PF00230
(MIP) 		5 ALA A 190
PRO A  69
THR A 138
GLY A 182
THR A 179
 None
 1.38A 5hfjG-2b6oA:
undetectable		 5hfjG-2b6oA:
21.07
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.
2cg8 DIHYDRONEOPTERIN
ALDOLASE
6-HYDROXYMETHYL-7,8-
DIHYDROPTERIN
SYNTHASE

(Streptococcus
pneumoniae) 		PF01288
(HPPK)
PF02152
(FolB) 		5 ALA A  13
THR A 110
PHE A  28
THR A 114
GLU A  10
 None
 1.36A 5hfjG-2cg8A:
undetectable		 5hfjG-2cg8A:
24.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dfv PROBABLE L-THREONINE
3-DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A  38
GLN A  63
GLY A  66
SER A  40
GLU A  68
 None
 1.33A 5hfjG-2dfvA:
3.3		 5hfjG-2dfvA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2do8 UPF0301 PROTEIN
HD_1794

([Haemophilus]
ducreyi) 		PF02622
(DUF179) 		5 ALA A 170
THR A 101
GLY A   7
SER A 151
GLU A 152
 None
 1.32A 5hfjG-2do8A:
undetectable		 5hfjG-2do8A:
18.64
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.
2esr METHYLTRANSFERASE

(Streptococcus
pyogenes) 		PF03602
(Cons_hypoth95) 		5 ALA A 100
ASP A 117
PRO A 119
PHE A  49
GLY A  51
 None
 0.77A 5hfjG-2esrA:
3.5		 5hfjG-2esrA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fpo METHYLASE YHHF

(Escherichia
coli) 		PF03602
(Cons_hypoth95) 		5 ALA A 110
ASP A 127
PRO A 129
PHE A  60
GLY A  62
 CL  A 401 (-3.8A)
None
None
None
None
 1.05A 5hfjG-2fpoA:
3.5		 5hfjG-2fpoA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ftp HYDROXYMETHYLGLUTARY
L-COA LYASE

(Pseudomonas
aeruginosa) 		PF00682
(HMGL-like) 		5 ALA A 104
PRO A 149
GLN A 214
THR A 184
SER A 143
 None
None
None
None
GOL  A2001 (-2.9A)
 1.28A 5hfjG-2ftpA:
undetectable		 5hfjG-2ftpA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hw6 MAP
KINASE-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 ALA A 324
ASP A 238
THR A 231
GLN A 233
GLY A 165
 None
 1.38A 5hfjG-2hw6A:
undetectable		 5hfjG-2hw6A:
20.78
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.
2jjq UNCHARACTERIZED RNA
METHYLTRANSFERASE
PYRAB10780

(Pyrococcus
abyssi) 		PF05958
(tRNA_U5-meth_tr) 		5 ASP A 340
PRO A 342
GLY A 280
THR A 283
SER A 300
 SAH  A1406 (-3.8A)
SAH  A1406 (-4.1A)
SAH  A1406 (-3.4A)
SAH  A1406 (-3.4A)
SAH  A1406 (-2.9A)
 1.08A 5hfjG-2jjqA:
2.9		 5hfjG-2jjqA:
18.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ker ALPHA-AMYLASE
INHIBITOR Z-2685

(Streptomyces
parvulus) 		PF01356
(A_amylase_inhib) 		5 ALA A  41
ASP A  20
PHE A  54
GLY A  56
TYR A  63
 None
 0.92A 5hfjG-2kerA:
undetectable		 5hfjG-2kerA:
17.00
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.
2oqh PUTATIVE ISOMERASE

(Streptomyces
coelicolor) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A 210
ASP A 197
PRO A 225
GLY A 171
THR A 135
 None
 1.33A 5hfjG-2oqhA:
undetectable		 5hfjG-2oqhA:
17.83
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.
2qqu BETA-FRUCTOFURANOSID
ASE

(Arabidopsis
thaliana) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 ALA A 175
ASP A 267
GLY A 200
THR A 241
SER A 167
 None
 1.43A 5hfjG-2qquA:
undetectable		 5hfjG-2qquA:
19.63
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		5 ASP A 995
PRO A 969
GLN A 990
GLY A 997
SER A1034
 None
 1.24A 5hfjG-2rhpA:
undetectable		 5hfjG-2rhpA:
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.
2ri8 MANNOSYL-OLIGOSACCHA
RIDE
ALPHA-1,2-MANNOSIDAS
E

(Penicillium
citrinum) 		PF01532
(Glyco_hydro_47) 		5 ALA A1295
ASP A1352
PHE A1350
GLY A1354
SER A1337
 None
 1.32A 5hfjG-2ri8A:
undetectable		 5hfjG-2ri8A:
18.88
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.
2w37 ORNITHINE
CARBAMOYLTRANSFERASE
, CATABOLIC

(Lactobacillus
hilgardii) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ALA A 174
GLN A 159
GLY A 181
SER A 176
GLU A  18
 None
 1.33A 5hfjG-2w37A:
2.2		 5hfjG-2w37A:
22.69
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.
2waa XYLAN ESTERASE,
PUTATIVE, AXE2C

(Cellvibrio
japonicus) 		PF13472
(Lipase_GDSL_2) 		5 ALA A 163
GLN A 111
GLY A  37
THR A  35
GLU A 106
 None
 1.17A 5hfjG-2waaA:
2.4		 5hfjG-2waaA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zie PUTATIVE
MODIFICATION
METHYLASE

(Thermus
thermophilus) 		PF01555
(N6_N4_Mtase) 		6 ALA A  29
PRO A  49
PHE A 243
GLY A 245
THR A 248
TYR A 269
 None
 0.70A 5hfjG-2zieA:
19.9		 5hfjG-2zieA:
26.58
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.
3bga BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		5 ALA A 969
ASP A 794
PRO A 789
THR A 996
TYR A 921
 NA  A   6 (-4.7A)
None
None
None
None
 1.35A 5hfjG-3bgaA:
undetectable		 5hfjG-3bgaA:
12.85
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.
3d9y PROFILIN

(Schizosaccharomyces
pombe) 		PF00235
(Profilin) 		5 ALA A  91
ASP A  52
THR A  59
SER A  77
GLU A  74
 None
 1.31A 5hfjG-3d9yA:
undetectable		 5hfjG-3d9yA:
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.
3dec BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		5 ALA A 945
ASP A 770
PRO A 765
THR A 972
TYR A 897
 K  A1101 (-4.9A)
None
None
None
None
 1.35A 5hfjG-3decA:
undetectable		 5hfjG-3decA:
13.61
Potential target for repurposing, i.e. matched protein structure has less than 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 ALA A 630
THR A 721
GLN A 696
PHE A 681
GLU A 633
 None
None
None
None
GOL  A 765 ( 3.0A)
 1.37A 5hfjG-3eqnA:
undetectable		 5hfjG-3eqnA:
14.29
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.
3g87 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Burkholderia
pseudomallei) 		PF00698
(Acyl_transf_1) 		5 ALA A  98
GLN A  17
PHE A  11
GLY A  13
THR A  62
 None
 1.36A 5hfjG-3g87A:
undetectable		 5hfjG-3g87A:
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.
3iu5 PROTEIN POLYBROMO-1

(Homo sapiens) 		PF00439
(Bromodomain) 		5 ALA A 136
ASP A  93
GLN A  98
PHE A  72
GLU A  70
 None
 1.34A 5hfjG-3iu5A:
undetectable		 5hfjG-3iu5A:
17.60
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.
3m4e ALPHA-HEMOLYSIN

(Staphylococcus
aureus) 		PF07968
(Leukocidin) 		5 ALA A 216
ASP A 254
PRO A  81
GLN A 257
THR A 268
 None
 1.18A 5hfjG-3m4eA:
undetectable		 5hfjG-3m4eA:
23.99
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.
3m9i LENS FIBER MAJOR
INTRINSIC PROTEIN

(Ovis aries) 		PF00230
(MIP) 		5 ALA A  97
PRO A  69
THR A 138
GLY A 182
THR A 179
 None
 1.39A 5hfjG-3m9iA:
undetectable		 5hfjG-3m9iA:
21.05
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.
3o75 FRUCTOSE TRANSPORT
SYSTEM REPRESSOR
FRUR

(Pseudomonas
putida) 		PF00532
(Peripla_BP_1) 		5 ALA A 187
THR A 257
GLY A 253
SER A 221
GLU A 223
 None
 1.39A 5hfjG-3o75A:
undetectable		 5hfjG-3o75A:
20.28
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.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		5 ALA A 683
THR A 704
PHE A 720
GLY A 708
THR A 724
 None
 1.38A 5hfjG-3o8lA:
undetectable		 5hfjG-3o8lA:
15.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oz2 DIGERANYLGERANYLGLYC
EROPHOSPHOLIPID
REDUCTASE

(Thermoplasma
acidophilum) 		PF01494
(FAD_binding_3) 		5 ALA A 137
THR A 310
GLY A 277
THR A 274
TYR A 319
 None
None
None
GOL  A 514 (-3.8A)
None
 1.05A 5hfjG-3oz2A:
undetectable		 5hfjG-3oz2A:
21.59
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.
3pxl LACCASE

(Trametes
hirsuta) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ALA A 468
PRO A 446
GLN A 102
GLY A 401
THR A 403
 None
 1.40A 5hfjG-3pxlA:
undetectable		 5hfjG-3pxlA:
19.21
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.
3rpk BACKBONE PILUS
SUBUNIT

(Streptococcus
pneumoniae) 		PF16555
(GramPos_pilinD1)
PF16569
(GramPos_pilinBB)
PF16570
(GramPos_pilinD3) 		5 ALA A 372
PRO A 315
THR A 446
GLY A 246
THR A 305
 None
 1.42A 5hfjG-3rpkA:
undetectable		 5hfjG-3rpkA:
16.55
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.
3swx PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 ALA A 256
PHE A 258
GLY A 260
THR A  48
GLU A 241
 None
 1.38A 5hfjG-3swxA:
undetectable		 5hfjG-3swxA:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tma METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ALA A 244
PRO A 262
PHE A 192
GLY A 194
THR A 197
 None
 0.72A 5hfjG-3tmaA:
2.8		 5hfjG-3tmaA:
17.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uat DISKS LARGE HOMOLOG
1

(Rattus
norvegicus) 		PF00625
(Guanylate_kin)
PF07653
(SH3_2) 		5 ALA A 587
ASP A 596
PRO A 641
SER A 709
GLU A 647
 None
 1.14A 5hfjG-3uatA:
undetectable		 5hfjG-3uatA:
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.
3vsv XYLOSIDASE

(Thermoanaerobacterium
saccharolyticum) 		PF13229
(Beta_helix) 		5 ALA A 531
ASP A 552
PHE A 533
GLY A 482
GLU A 537
 None
 1.18A 5hfjG-3vsvA:
undetectable		 5hfjG-3vsvA:
16.59
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.
3vte TETRAHYDROCANNABINOL
IC ACID SYNTHASE

(Cannabis sativa) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ALA A 380
ASP A 408
GLY A 412
THR A 295
SER A 382
 None
 1.22A 5hfjG-3vteA:
undetectable		 5hfjG-3vteA:
18.22
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.
3zif HEXON PROTEIN

(Bovine
mastadenovirus
B) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		5 PRO A 288
GLY A 217
THR A 213
SER A 123
TYR A 121
 None
 1.16A 5hfjG-3zifA:
undetectable		 5hfjG-3zifA:
13.54
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.
3zsc PECTATE
TRISACCHARIDE-LYASE

(Thermotoga
maritima) 		PF00544
(Pec_lyase_C) 		5 ASP A 139
LYS A 163
PHE A 116
GLY A 137
TYR A 104
 AQA  A1338 (-3.9A)
AQA  A1338 (-3.0A)
None
None
None
 1.08A 5hfjG-3zscA:
undetectable		 5hfjG-3zscA:
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.
4ccd GALACTOCEREBROSIDASE

(Mus musculus) 		PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M) 		5 ALA A  44
ASP A 175
GLY A 132
SER A  46
GLU A 114
 None
 1.21A 5hfjG-4ccdA:
2.2		 5hfjG-4ccdA:
16.33
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.
4cuo BANYAN PEROXIDASE

(Ficus
benghalensis) 		PF00141
(peroxidase) 		5 ALA A 174
GLN A 239
PHE A 179
GLY A 241
TYR A 240
 HEM  A1307 (-3.8A)
NAG  A1321 (-3.8A)
None
None
NAG  A1321 (-4.9A)
 1.40A 5hfjG-4cuoA:
undetectable		 5hfjG-4cuoA:
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.
4dix PLECTIN-RELATED
PROTEIN

(Arabidopsis
thaliana) 		PF16709
(SCAB-IgPH) 		5 ALA A 328
THR A 490
GLY A 485
SER A 326
GLU A 487
 None
 1.36A 5hfjG-4dixA:
undetectable		 5hfjG-4dixA:
20.78
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.
4eys MCCC FAMILY PROTEIN

(Streptococcus
pneumoniae) 		PF02016
(Peptidase_S66) 		5 ALA A  57
ASP A  49
PHE A  50
GLY A  13
SER A  44
 None
 1.22A 5hfjG-4eysA:
undetectable		 5hfjG-4eysA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hwv PECTATE LYASE/AMB
ALLERGEN

(Acidovorax
citrulli) 		PF00544
(Pec_lyase_C) 		5 ALA A  27
ASP A 189
PRO A 500
GLY A 495
THR A 215
 None
 1.37A 5hfjG-4hwvA:
undetectable		 5hfjG-4hwvA:
17.00
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.
4id9 SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Agrobacterium
fabrum) 		PF01370
(Epimerase) 		5 ALA A 104
THR A 289
PHE A 159
GLY A 107
TYR A 110
 NAD  A 403 ( 3.8A)
None
NAD  A 403 (-3.9A)
None
None
 1.17A 5hfjG-4id9A:
undetectable		 5hfjG-4id9A:
20.29
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.
4lvq PHOSPHATE-BINDING
PROTEIN PSTS 3

(Mycobacterium
tuberculosis) 		PF12849
(PBP_like_2) 		5 THR A  57
GLY A 192
THR A 314
SER A 216
GLU A 190
 PO4  A 401 (-2.8A)
PO4  A 401 (-3.4A)
None
None
None
 1.40A 5hfjG-4lvqA:
undetectable		 5hfjG-4lvqA:
21.60
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.
4nfu EDS1

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		5 ALA A  88
PRO A 159
THR A 155
PHE A  89
THR A 133
 None
 1.20A 5hfjG-4nfuA:
undetectable		 5hfjG-4nfuA:
18.37
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		5 ALA A 115
ASP A  60
THR A 352
SER A 157
TYR A 156
 None
 1.39A 5hfjG-4ojzA:
undetectable		 5hfjG-4ojzA:
14.84
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.
4omb PHOSPHATE BINDING
PROTEIN

(Pseudomonas
aeruginosa) 		PF12849
(PBP_like_2) 		5 ALA A  76
PRO A  83
GLY A  93
SER A  78
TYR A 272
 None
None
None
PO4  A 401 (-2.5A)
None
 1.35A 5hfjG-4ombA:
undetectable		 5hfjG-4ombA:
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.
4oqy (S)-IMINE REDUCTASE

(Streptomyces
sp. GF3546) 		PF03446
(NAD_binding_2) 		5 ASP A  24
PHE A  22
GLY A  26
SER A   5
GLU A  28
 None
 1.25A 5hfjG-4oqyA:
2.5		 5hfjG-4oqyA:
17.24
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.
4owt INTEGRATOR COMPLEX
SUBUNIT 3

(Homo sapiens) 		PF10189
(Ints3) 		5 THR A 306
LYS A 169
GLY A 173
THR A 211
SER A 342
 None
 1.23A 5hfjG-4owtA:
undetectable		 5hfjG-4owtA:
18.57
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.
4pc7 ELONGATION FACTOR TS

(Escherichia
coli) 		PF00889
(EF_TS) 		5 ALA C  56
ASP C  80
GLN C  89
LYS C  84
GLY C  59
 None
 1.37A 5hfjG-4pc7C:
undetectable		 5hfjG-4pc7C:
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		5 ALA A 152
THR A 207
GLN A 209
PHE A 530
SER A 380
 None
HEM  A 602 ( 4.3A)
None
None
None
 1.27A 5hfjG-4ph9A:
undetectable		 5hfjG-4ph9A:
17.55
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.
4rr5 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Synechocystis
sp. PCC 6803) 		PF00698
(Acyl_transf_1) 		5 ALA A  97
GLN A  10
PHE A   7
THR A  59
GLU A  91
 None
ACT  A 301 ( 4.7A)
None
None
None
 1.08A 5hfjG-4rr5A:
undetectable		 5hfjG-4rr5A:
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.
4v2x ENDO-BETA-1,4-GLUCAN
ASE (CELLULASE B)

(Bacillus
halodurans) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		6 ALA A 476
PHE A 478
GLY A 480
THR A 436
GLU A 545
TYR A 457
 None
 1.49A 5hfjG-4v2xA:
undetectable		 5hfjG-4v2xA:
16.58
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.
4w8v CRISPR SYSTEM CMR
SUBUNIT CMR6

(Pyrococcus
furiosus) 		PF03787
(RAMPs) 		5 THR A 290
GLY A 334
THR A 115
SER A 330
TYR A 333
 None
 1.35A 5hfjG-4w8vA:
undetectable		 5hfjG-4w8vA:
20.45
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.
4z3y BENZOYL-COA
REDUCTASE, PUTATIVE

(Geobacter
metallireducens) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 ALA A 167
THR A  82
GLY A 187
THR A  87
SER A 176
 None
None
None
None
MTE  A 703 ( 4.0A)
 1.40A 5hfjG-4z3yA:
undetectable		 5hfjG-4z3yA:
16.59
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.
4zcf RESTRICTION
ENDONUCLEASE
ECOP15I,
MODIFICATION SUBUNIT

(Escherichia
coli) 		PF01555
(N6_N4_Mtase) 		6 ASP A 123
PRO A 125
LYS A 418
PHE A 441
GLY A 443
THR A 446
 None
 0.75A 5hfjG-4zcfA:
18.6		 5hfjG-4zcfA:
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.
5afe ENDOGLUCANASE CEL5A

([Eubacterium]
cellulosolvens) 		no annotation 5 PRO A 692
PHE A 599
GLY A 696
THR A 698
GLU A 694
 None
 1.29A 5hfjG-5afeA:
undetectable		 5hfjG-5afeA:
21.67
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.
5dl7 PORIN

(Acinetobacter
baumannii) 		PF03573
(OprD) 		5 PRO A 117
THR A 185
PHE A 212
GLY A 187
SER A 189
 None
 1.28A 5hfjG-5dl7A:
undetectable		 5hfjG-5dl7A:
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.
5dtu PRP28

(Chaetomium
thermophilum) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 ALA A 396
ASP A 415
GLY A 388
THR A 409
SER A 391
 None
 1.40A 5hfjG-5dtuA:
2.9		 5hfjG-5dtuA:
20.60
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.
5dz7 POLYKETIDE
BIOSYNTHESIS PROTEIN
PKSE

(Bacillus
subtilis) 		PF00698
(Acyl_transf_1) 		5 ALA A  93
GLN A  12
PHE A   6
GLY A   8
THR A  57
 None
 1.29A 5hfjG-5dz7A:
undetectable		 5hfjG-5dz7A:
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ALA A 236
ASP A 254
PRO A 256
PHE A 187
GLY A 189
 SAM  A 400 (-3.5A)
None
SAM  A 400 (-4.2A)
SAM  A 400 (-4.7A)
SAM  A 400 (-3.3A)
 0.73A 5hfjG-5e72A:
3.1		 5hfjG-5e72A:
22.91
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.
5gxb NANOBODY

(Vicugna pacos) 		PF07686
(V-set) 		5 ALA B  49
THR B 123
GLN B 124
THR B  91
TYR B  95
 None
 1.24A 5hfjG-5gxbB:
undetectable		 5hfjG-5gxbB:
18.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hfj ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA)

(Helicobacter
pylori) 		PF01555
(N6_N4_Mtase) 		5 ALA A   7
GLY A 197
THR A 200
GLU A 218
TYR A 221
 None
SAM  A 301 (-3.4A)
SAM  A 301 (-3.6A)
None
SAM  A 301 (-4.2A)
 1.13A 5hfjG-5hfjA:
34.2		 5hfjG-5hfjA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hfj ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA)

(Helicobacter
pylori) 		PF01555
(N6_N4_Mtase) 		8 ALA A   9
ASP A  29
PRO A  31
PHE A 195
GLY A 197
THR A 200
GLU A 218
TYR A 221
 SAM  A 301 (-3.2A)
SAM  A 301 (-3.2A)
SAM  A 301 ( 4.0A)
SAM  A 301 (-4.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.6A)
None
SAM  A 301 (-4.2A)
 0.32A 5hfjG-5hfjA:
34.2		 5hfjG-5hfjA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hfj ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA)

(Helicobacter
pylori) 		PF01555
(N6_N4_Mtase) 		8 ASP A  29
PRO A  31
PHE A 195
GLY A 197
THR A 200
SER A 217
GLU A 218
TYR A 221
 SAM  A 301 (-3.2A)
SAM  A 301 ( 4.0A)
SAM  A 301 (-4.6A)
SAM  A 301 (-3.4A)
SAM  A 301 (-3.6A)
SAM  A 301 (-2.8A)
None
SAM  A 301 (-4.2A)
 0.61A 5hfjG-5hfjA:
34.2		 5hfjG-5hfjA:
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.
5i51 TRANSKETOLASE

(Scheffersomyces
stipitis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 417
THR A 381
GLY A 437
THR A 465
TYR A 435
 None
 1.23A 5hfjG-5i51A:
undetectable		 5hfjG-5i51A:
15.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j78 ACETALDEHYDE
DEHYDROGENASE
(ACETYLATING)

(Parageobacillus
thermoglucosidasius) 		PF00171
(Aldedh) 		5 ALA A 415
PRO A 245
LYS A 363
GLY A 390
GLU A 388
 None
 1.10A 5hfjG-5j78A:
2.6		 5hfjG-5j78A:
18.74
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.
5ltm PHENYLALANINE
AMMONIA LYASE

(Anabaena) 		no annotation 5 ALA B 507
ASP B 296
GLN B 262
THR B 260
SER B 286
 None
 1.40A 5hfjG-5ltmB:
undetectable		 5hfjG-5ltmB:
16.86
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.
5neu INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 PRO A  69
THR A  46
GLN A  47
GLY A  54
SER A  17
 None
 1.40A 5hfjG-5neuA:
undetectable		 5hfjG-5neuA:
17.38
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.
5nyj ANBU

(Hyphomicrobium
sp. MC1) 		PF00227
(Proteasome) 		5 ALA A   3
PHE A 181
GLY A 156
GLU A 152
TYR A 155
 None
 1.31A 5hfjG-5nyjA:
undetectable		 5hfjG-5nyjA:
23.30
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.
5nyj ANBU

(Hyphomicrobium
sp. MC1) 		PF00227
(Proteasome) 		5 ASP A 182
PHE A 181
GLY A 156
GLU A 152
TYR A 155
 None
 1.25A 5hfjG-5nyjA:
undetectable		 5hfjG-5nyjA:
23.30
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.
5w0x TIP41-LIKE PROTEIN

(Mus musculus) 		no annotation 5 ALA A  72
PRO A  46
PHE A 156
GLY A  51
THR A  25
 None
 1.21A 5hfjG-5w0xA:
undetectable		 5hfjG-5w0xA:
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.
5xmg UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 ALA A 336
ASP A 275
GLY A 323
THR A 341
GLU A 304
 None
 1.38A 5hfjG-5xmgA:
undetectable		 5hfjG-5xmgA:
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.
5yh0 DRFAM20C1

(Danio rerio) 		no annotation 6 ALA A 290
THR A 271
GLN A 269
PHE A 459
THR A 266
GLU A 282
 None
 1.36A 5hfjG-5yh0A:
undetectable		 5hfjG-5yh0A:
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.
5yz0 SERINE/THREONINE-PRO
TEIN KINASE ATR

(Homo sapiens) 		no annotation 5 ALA A2043
GLY A2079
THR A2276
SER A2075
TYR A2078
 None
 1.28A 5hfjG-5yz0A:
undetectable		 5hfjG-5yz0A:
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.
6d6u GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1

(Homo sapiens) 		no annotation 5 ALA B 182
THR B 130
GLN B  68
PHE B  46
THR B  43
 None
ABU  A 405 (-3.1A)
None
None
None
 1.24A 5hfjG-6d6uB:
undetectable		 5hfjG-6d6uB:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ejf -

(-) 		no annotation 5 ALA J 281
PRO J 267
PHE J 283
GLY J 220
GLU J 222
 None
 1.35A 5hfjG-6ejfJ:
undetectable		 5hfjG-6ejfJ:
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.
6f91 PUTATIVE
ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		no annotation 5 ALA A 449
ASP A 503
PRO A 444
GLY A 501
THR A 510
 None
 1.39A 5hfjG-6f91A:
undetectable		 5hfjG-6f91A:
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.
1boo PROTEIN (N-4
CYTOSINE-SPECIFIC
METHYLTRANSFERASE
PVU II)

(Proteus
vulgaris) 		PF01555
(N6_N4_Mtase) 		4 ASP A  34
HIS A 246
SER A 276
GLU A 294
 SAH  A 401 (-4.0A)
SAH  A 401 (-4.0A)
SAH  A 401 (-2.7A)
SAH  A 401 (-2.9A)
 0.53A 5hfjG-1booA:
20.0		 5hfjG-1booA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f4h BETA-GALACTOSIDASE

(Escherichia
coli) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 ASP A 997
HIS A 391
SER A 390
GLU A 537
 None
 1.33A 5hfjG-1f4hA:
1.0		 5hfjG-1f4hA:
12.88
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.
1wln AFADIN

(Mus musculus) 		PF00498
(FHA) 		4 ASP A  26
HIS A 107
SER A 106
GLU A  16
 None
 1.37A 5hfjG-1wlnA:
0.0		 5hfjG-1wlnA:
15.38
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN

(Geobacillus
kaustophilus) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		4 ASP A1103
HIS A1186
SER A1182
GLU A1157
 None
DGT  A1456 (-4.1A)
None
None
 1.47A 5hfjG-3f2bA:
0.0		 5hfjG-3f2bA:
13.00
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.
3sfv LIDA PROTEIN,
SUBSTRATE OF THE
DOT/ICM SYSTEM

(Legionella
pneumophila) 		no annotation 4 ASP B 336
HIS B 317
SER B 261
GLU B 259
 None
 1.49A 5hfjG-3sfvB:
0.0		 5hfjG-3sfvB:
21.64
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.
3tkl LIDA PROTEIN,
SUBSTRATE OF THE
DOT/ICM SYSTEM

(Legionella
pneumophila) 		no annotation 4 ASP B 336
HIS B 317
SER B 261
GLU B 259
 None
 1.50A 5hfjG-3tklB:
0.0		 5hfjG-3tklB:
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.
3tm5 CRYSTAL STRUCTURE OF
TRM14

(Pyrococcus
furiosus) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 ASP A 276
HIS A 198
SER A 228
GLU A 248
 SFG  A 401 (-3.4A)
SFG  A 401 (-3.8A)
SFG  A 401 (-3.6A)
SFG  A 401 (-2.6A)
 0.64A 5hfjG-3tm5A:
3.4		 5hfjG-3tm5A:
23.36
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.
3tnf LIDA

(Legionella
pneumophila) 		no annotation 4 ASP B 336
HIS B 317
SER B 261
GLU B 259
 None
 1.44A 5hfjG-3tnfB:
0.0		 5hfjG-3tnfB:
21.47
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.
4blu RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J

(Escherichia
coli) 		PF04378
(RsmJ) 		4 ASP A  40
HIS A 120
SER A 122
GLU A 118
 None
 1.38A 5hfjG-4bluA:
2.4		 5hfjG-4bluA:
21.07
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.
4z26 PUTATIVE GMC-TYPE
OXIDOREDUCTASE R135

(Acanthamoeba
polyphaga
mimivirus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 ASP A 523
HIS A 350
SER A 514
GLU A 516
 None
 1.46A 5hfjG-4z26A:
undetectable		 5hfjG-4z26A:
16.54
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.
6bm8 ENVELOPE
GLYCOPROTEIN B

(Human
alphaherpesvirus
1) 		no annotation 4 ASP A 389
HIS A 433
SER A 457
GLU A 144
 None
 1.21A 5hfjG-6bm8A:
undetectable		 5hfjG-6bm8A:
undetectable