SIMILAR PATTERNS OF AMINO ACIDS FOR 3O9M_A_BEZA999_0

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.
1ap8 TRANSLATION
INITIATION FACTOR
EIF4E

(Saccharomyces
cerevisiae) 		PF01652
(IF4E) 		4 GLY A 112
GLY A 113
TRP A 115
LEU A 165
 None
 0.69A 3o9mA-1ap8A:
undetectable		 3o9mA-1ap8A:
17.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1aql BILE-SALT ACTIVATED
LIPASE

(Bos taurus) 		PF00135
(COesterase) 		5 GLY A 107
SER A 194
TRP A 227
PHE A 393
HIS A 435
 None
 0.81A 3o9mA-1aqlA:
52.2		 3o9mA-1aqlA:
32.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1b41 ACETYLCHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		5 GLY A 121
GLY A 122
SER A 203
TRP A 236
HIS A 447
 None
 0.36A 3o9mA-1b41A:
57.2		 3o9mA-1b41A:
52.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1c2o ACETYLCHOLINESTERASE

(Electrophorus
electricus) 		PF00135
(COesterase) 		5 GLY A 121
GLY A 122
SER A 203
TRP A 236
HIS A 447
 None
 0.36A 3o9mA-1c2oA:
57.0		 3o9mA-1c2oA:
52.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1c7j PROTEIN
(PARA-NITROBENZYL
ESTERASE)

(Bacillus
subtilis) 		PF00135
(COesterase) 		4 GLY A 106
SER A 189
PHE A 363
HIS A 399
 None
 0.58A 3o9mA-1c7jA:
45.8		 3o9mA-1c7jA:
33.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cle CHOLESTEROL ESTERASE

([Candida]
cylindracea) 		PF00135
(COesterase) 		5 GLY A 122
GLY A 123
SER A 209
PHE A 415
HIS A 449
 CLL  A 801 (-4.3A)
CLL  A 801 (-3.3A)
CLL  A 801 ( 2.8A)
None
CLL  A 801 (-4.8A)
 1.40A 3o9mA-1cleA:
43.9		 3o9mA-1cleA:
28.59
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.
1cle CHOLESTEROL ESTERASE

([Candida]
cylindracea) 		PF00135
(COesterase) 		6 GLY A 123
GLY A 124
SER A 209
LEU A 302
PHE A 415
HIS A 449
 CLL  A 801 (-3.3A)
CLL  A 801 (-3.3A)
CLL  A 801 ( 2.8A)
CLL  A 801 (-4.0A)
None
CLL  A 801 (-4.8A)
 0.52A 3o9mA-1cleA:
43.9		 3o9mA-1cleA:
28.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1crl LIPASE

(Diutina rugosa) 		PF00135
(COesterase) 		5 GLY A 122
GLY A 123
SER A 209
PHE A 415
HIS A 449
 None
 1.41A 3o9mA-1crlA:
40.4		 3o9mA-1crlA:
30.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1crl LIPASE

(Diutina rugosa) 		PF00135
(COesterase) 		6 GLY A 123
GLY A 124
SER A 209
LEU A 302
PHE A 415
HIS A 449
 None
 0.71A 3o9mA-1crlA:
40.4		 3o9mA-1crlA:
30.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1crl LIPASE

(Diutina rugosa) 		PF00135
(COesterase) 		5 GLY A 124
SER A 209
LEU A 302
PHE A 415
HIS A 449
 None
 1.02A 3o9mA-1crlA:
40.4		 3o9mA-1crlA:
30.88
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.
1evq SERINE HYDROLASE

(Alicyclobacillus
acidocaldarius) 		PF07859
(Abhydrolase_3) 		4 GLY A  83
GLY A  84
SER A 155
HIS A 282
 EPE  A 455 (-3.3A)
EPE  A 455 (-3.3A)
EPE  A 455 (-1.4A)
EPE  A 455 (-4.0A)
 0.33A 3o9mA-1evqA:
18.2		 3o9mA-1evqA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fw8 PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		4 GLY A 298
GLY A 299
SER A 319
PHE A  92
 None
 0.71A 3o9mA-1fw8A:
undetectable		 3o9mA-1fw8A:
21.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gqr ACETYLCHOLINESTERASE

(Tetronarce
californica) 		PF00135
(COesterase) 		5 GLY A 118
GLY A 119
SER A 200
TRP A 233
HIS A 440
 SAF  A1998 ( 3.5A)
EMM  A1999 (-3.5A)
EMM  A1999 ( 1.4A)
EMM  A1999 (-4.0A)
EMM  A1999 ( 3.8A)
 0.56A 3o9mA-1gqrA:
61.5		 3o9mA-1gqrA:
53.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gz7 LIPASE 2

(Diutina rugosa) 		PF00135
(COesterase) 		5 GLY A 122
GLY A 123
SER A 209
PHE A 415
HIS A 449
 None
 1.41A 3o9mA-1gz7A:
42.3		 3o9mA-1gz7A:
30.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gz7 LIPASE 2

(Diutina rugosa) 		PF00135
(COesterase) 		6 GLY A 123
GLY A 124
SER A 209
LEU A 302
PHE A 415
HIS A 449
 None
 0.64A 3o9mA-1gz7A:
42.3		 3o9mA-1gz7A:
30.52
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.
1itz TRANSKETOLASE

(Zea mays) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLY A 439
SER A 437
LEU A 340
PHE A  67
HIS A 436
 None
 1.44A 3o9mA-1itzA:
undetectable		 3o9mA-1itzA:
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.
1jji CARBOXYLESTERASE

(Archaeoglobus
fulgidus) 		PF07859
(Abhydrolase_3) 		4 GLY A  88
GLY A  89
SER A 160
HIS A 285
 EPE  A 455 (-3.7A)
EPE  A 455 (-3.4A)
EPE  A 455 (-1.6A)
EPE  A 455 (-4.6A)
 0.60A 3o9mA-1jjiA:
4.1		 3o9mA-1jjiA:
20.17
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.
1jkm BREFELDIN A ESTERASE

(Bacillus
subtilis) 		PF07859
(Abhydrolase_3) 		4 GLY A 127
GLY A 128
SER A 202
HIS A 338
 None
 0.36A 3o9mA-1jkmA:
11.1		 3o9mA-1jkmA:
19.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jmy BILE-SALT-ACTIVATED
LIPASE

(Homo sapiens) 		PF00135
(COesterase) 		5 GLY A 107
SER A 194
TRP A 227
PHE A 393
HIS A 435
 None
 0.59A 3o9mA-1jmyA:
52.7		 3o9mA-1jmyA:
34.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 GLY A 149
GLY A 150
SER A 238
PHE A 440
HIS A 480
 SO4  A 593 ( 4.2A)
I40  A 997 (-3.9A)
SO4  A 593 (-1.9A)
SO4  A 593 (-4.5A)
SO4  A 593 (-4.1A)
 1.16A 3o9mA-1qonA:
59.6		 3o9mA-1qonA:
37.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 GLY A 149
SER A 238
TRP A 271
PHE A 440
HIS A 480
 SO4  A 593 ( 4.2A)
SO4  A 593 (-1.9A)
SO4  A 593 (-4.4A)
SO4  A 593 (-4.5A)
SO4  A 593 (-4.1A)
 0.93A 3o9mA-1qonA:
59.6		 3o9mA-1qonA:
37.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster) 		PF00135
(COesterase) 		7 GLY A 150
GLY A 151
SER A 238
TRP A 271
LEU A 328
PHE A 440
HIS A 480
 I40  A 997 (-3.9A)
SO4  A 593 (-3.4A)
SO4  A 593 (-1.9A)
SO4  A 593 (-4.4A)
None
SO4  A 593 (-4.5A)
SO4  A 593 (-4.1A)
 0.44A 3o9mA-1qonA:
59.6		 3o9mA-1qonA:
37.52
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.
1thg LIPASE 2

(Galactomyces
candidus) 		PF00135
(COesterase) 		5 GLY A 131
GLY A 130
SER A 217
PHE A 428
HIS A 463
 None
 1.49A 3o9mA-1thgA:
36.8		 3o9mA-1thgA:
29.55
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.
1ued P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		4 GLY A 245
GLY A 246
LEU A 164
PHE A 116
 PG4  A4502 ( 3.7A)
HEM  A1430 (-3.3A)
None
HEM  A1430 (-4.7A)
 0.60A 3o9mA-1uedA:
undetectable		 3o9mA-1uedA:
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.
1ukc ESTA

(Aspergillus
niger) 		PF00135
(COesterase) 		5 GLY A 127
GLY A 128
SER A 210
PHE A 400
HIS A 440
 EDO  A1902 (-3.6A)
EDO  A1902 (-3.4A)
EDO  A1902 (-2.4A)
None
EDO  A1902 ( 4.9A)
 0.54A 3o9mA-1ukcA:
38.7		 3o9mA-1ukcA:
29.55
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.
1xk5 SNURPORTIN-1

(Homo sapiens) 		no annotation 5 GLY A 159
GLY A 158
SER A 154
LEU A 172
PHE A 229
 None
 1.22A 3o9mA-1xk5A:
undetectable		 3o9mA-1xk5A:
17.61
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.
2c7b CARBOXYLESTERASE

(uncultured
archaeon) 		PF07859
(Abhydrolase_3) 		5 GLY A  82
GLY A  83
SER A 154
LEU A 210
HIS A 281
 None
 1.29A 3o9mA-2c7bA:
18.5		 3o9mA-2c7bA:
21.33
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		5 GLY A 145
GLY A 146
SER A 226
LEU A 313
HIS A 471
 TFC  A 600 (-3.5A)
TFC  A 600 (-3.4A)
TFC  A 600 (-1.4A)
TFC  A 600 (-4.2A)
TFC  A 600 (-4.2A)
 1.05A 3o9mA-2fj0A:
49.9		 3o9mA-2fj0A:
28.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		5 GLY A 146
GLY A 147
SER A 226
PHE A 425
HIS A 471
 TFC  A 600 (-3.4A)
TFC  A 600 (-3.6A)
TFC  A 600 (-1.4A)
None
TFC  A 600 (-4.2A)
 0.75A 3o9mA-2fj0A:
49.9		 3o9mA-2fj0A:
28.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ntt STAPHYLOCOCCAL
ENTEROTOXIN K

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C) 		5 GLY A  80
GLY A  81
SER A  46
LEU A  62
PHE A  37
 None
 1.25A 3o9mA-2nttA:
undetectable		 3o9mA-2nttA:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o7r CXE CARBOXYLESTERASE

(Actinidia
eriantha) 		PF07859
(Abhydrolase_3) 		5 GLY A  92
GLY A  93
SER A 169
LEU A 227
HIS A 306
 4PA  A 369 (-3.5A)
4PA  A 369 (-3.6A)
4PA  A 369 (-1.8A)
None
4PA  A 369 (-4.8A)
 0.50A 3o9mA-2o7rA:
19.4		 3o9mA-2o7rA:
21.33
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.
2pbl PUTATIVE
ESTERASE/LIPASE/THIO
ESTERASE

(Ruegeria sp.
TM1040) 		PF07859
(Abhydrolase_3) 		5 GLY A  70
GLY A  71
SER A 136
PHE A 218
HIS A 241
 UNL  A 263 ( 4.2A)
UNL  A 263 (-4.1A)
UNL  A 263 (-3.7A)
None
UNL  A 263 (-4.3A)
 1.10A 3o9mA-2pblA:
17.5		 3o9mA-2pblA:
18.46
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.
2qk4 TRIFUNCTIONAL PURINE
BIOSYNTHETIC PROTEIN
ADENOSINE-3

(Homo sapiens) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 GLY A 384
GLY A 383
SER A 341
LEU A 387
PHE A 412
 GOL  A 804 (-3.6A)
GOL  A 804 ( 4.5A)
None
None
None
 1.36A 3o9mA-2qk4A:
2.0		 3o9mA-2qk4A:
22.29
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.
2qru UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF07859
(Abhydrolase_3) 		4 GLY A  34
GLY A  35
SER A 102
HIS A 247
 PO4  A 273 (-3.3A)
PO4  A 273 (-3.5A)
PO4  A 273 (-2.3A)
PO4  A 273 (-4.0A)
 0.39A 3o9mA-2qruA:
14.3		 3o9mA-2qruA:
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.
2uz0 TRIBUTYRIN ESTERASE

(Streptococcus
pneumoniae) 		PF00756
(Esterase) 		4 GLY A  44
SER A 120
LEU A 158
HIS A 231
 GOL  A1259 (-3.2A)
GOL  A1259 (-2.9A)
None
GOL  A1259 (-3.9A)
 0.69A 3o9mA-2uz0A:
15.5		 3o9mA-2uz0A:
19.47
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.
2yh2 ESTERASE

(Pyrobaculum
calidifontis) 		PF07859
(Abhydrolase_3) 		4 GLY A  85
GLY A  86
SER A 157
HIS A 284
 None
 0.40A 3o9mA-2yh2A:
19.4		 3o9mA-2yh2A:
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.
3ail 303AA LONG
HYPOTHETICAL
ESTERASE

(Sulfurisphaera
tokodaii) 		PF07859
(Abhydrolase_3) 		4 GLY A  79
GLY A  80
SER A 150
HIS A 273
 DEP  A 304 (-3.6A)
DEP  A 304 (-3.5A)
DEP  A 304 (-1.5A)
DEP  A 304 (-4.1A)
 0.25A 3o9mA-3ailA:
19.0		 3o9mA-3ailA:
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.
3bus METHYLTRANSFERASE

(Lechevalieria
aerocolonigenes) 		PF08241
(Methyltransf_11) 		5 GLY A 189
GLY A 188
LEU A  28
PHE A 167
HIS A 140
 None
 1.31A 3o9mA-3busA:
undetectable		 3o9mA-3busA:
18.84
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.
3ce9 GLYCEROL
DEHYDROGENASE

(Clostridium
acetobutylicum) 		PF13685
(Fe-ADH_2) 		4 GLY A  96
GLY A  97
SER A 120
LEU A 265
 EDO  A 401 ( 3.8A)
None
EDO  A 401 (-3.4A)
None
 0.71A 3o9mA-3ce9A:
undetectable		 3o9mA-3ce9A:
20.61
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.
3dm9 SIGNAL RECOGNITION
PARTICLE RECEPTOR

(Pyrococcus
furiosus) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		4 GLY B 279
GLY B 278
LEU B 272
PHE B 312
 None
 0.70A 3o9mA-3dm9B:
2.5		 3o9mA-3dm9B:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3efb PROBABLE SOR-OPERON
REGULATOR

(Shigella
flexneri) 		PF04198
(Sugar-bind) 		4 GLY A  94
GLY A  95
LEU A 100
PHE A 176
 None
 0.70A 3o9mA-3efbA:
undetectable		 3o9mA-3efbA:
19.50
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.
3g23 LD-CARBOXYPEPTIDASE
A

(Novosphingobium
aromaticivorans) 		PF02016
(Peptidase_S66) 		4 GLY A  76
GLY A  77
SER A 104
HIS A 261
 None
SO4  A 276 ( 4.6A)
None
None
 0.57A 3o9mA-3g23A:
undetectable		 3o9mA-3g23A:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ga7 ACETYL ESTERASE

(Salmonella
enterica) 		PF07859
(Abhydrolase_3) 		4 GLY A  93
GLY A  94
LEU A 221
HIS A 292
 SEP  A 165 ( 3.6A)
SEP  A 165 ( 3.5A)
None
SEP  A 165 ( 3.9A)
 0.55A 3o9mA-3ga7A:
18.2		 3o9mA-3ga7A:
18.90
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.
3h04 UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF07859
(Abhydrolase_3) 		4 GLY A  38
GLY A  39
SER A 104
HIS A 248
 None
 0.29A 3o9mA-3h04A:
16.2		 3o9mA-3h04A:
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.
3hxk SUGAR HYDROLASE

(Lactococcus
lactis) 		PF00326
(Peptidase_S9) 		4 GLY A  52
GLY A  53
SER A 127
HIS A 231
 None
 0.36A 3o9mA-3hxkA:
16.9		 3o9mA-3hxkA:
18.90
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.
3k6k ESTERASE/LIPASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 GLY A  89
GLY A  90
SER A 157
HIS A 281
 None
 0.41A 3o9mA-3k6kA:
17.0		 3o9mA-3k6kA:
19.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		5 GLY A1141
GLY A1142
SER A1221
LEU A1363
HIS A1468
 WW2  A 193 (-3.8A)
WW2  A 193 (-3.4A)
WW2  A 193 (-1.4A)
WW2  A 193 (-3.8A)
None
 1.18A 3o9mA-3k9bA:
53.3		 3o9mA-3k9bA:
36.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		5 GLY A1142
GLY A1143
SER A1221
PHE A1426
HIS A1468
 WW2  A 193 (-3.4A)
WW2  A 193 (-3.4A)
WW2  A 193 (-1.4A)
None
None
 0.74A 3o9mA-3k9bA:
53.3		 3o9mA-3k9bA:
36.58
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.
3kvn ESTERASE ESTA

(Pseudomonas
aeruginosa) 		no annotation 4 GLY X  92
SER X  14
LEU X 150
HIS X 289
 C8E  X 623 ( 4.4A)
C8E  X 623 (-2.9A)
None
C8E  X 623 (-4.4A)
 0.71A 3o9mA-3kvnX:
undetectable		 3o9mA-3kvnX:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION

(Saccharomyces
cerevisiae) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		5 GLY A 355
SER A 342
LEU A 324
PHE A 287
HIS A 285
 None
 1.08A 3o9mA-3of7A:
undetectable		 3o9mA-3of7A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p2m POSSIBLE HYDROLASE

(Mycobacterium
tuberculosis) 		PF12697
(Abhydrolase_6) 		5 GLY A  89
GLY A  90
SER A 154
PHE A 282
HIS A 309
 None
 1.18A 3o9mA-3p2mA:
12.8		 3o9mA-3p2mA:
23.14
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.
3q88 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Francisella
tularensis) 		PF00342
(PGI) 		5 GLY A 287
GLY A 474
SER A 290
LEU A 479
HIS A  36
 None
None
IPA  A 605 ( 4.1A)
None
IPA  A 605 (-4.3A)
 1.43A 3o9mA-3q88A:
undetectable		 3o9mA-3q88A:
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.
3qh4 ESTERASE LIPW

(Mycobacterium
marinum) 		PF07859
(Abhydrolase_3) 		4 GLY A  90
GLY A  91
PHE A 256
HIS A 284
 None
 0.51A 3o9mA-3qh4A:
4.0		 3o9mA-3qh4A:
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.
3sr3 MICROCIN IMMUNITY
PROTEIN MCCF

(Bacillus
anthracis) 		PF02016
(Peptidase_S66) 		4 GLY A  85
GLY A  86
SER A 112
HIS A 303
 None
 0.70A 3o9mA-3sr3A:
undetectable		 3o9mA-3sr3A:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tlz MCCF

(Escherichia
coli) 		PF02016
(Peptidase_S66) 		4 GLY A  91
GLY A  92
SER A 118
HIS A 311
 AMP  A 500 (-3.2A)
AMP  A 500 (-3.9A)
AMP  A 500 (-2.5A)
AMP  A 500 (-3.7A)
 0.63A 3o9mA-3tlzA:
undetectable		 3o9mA-3tlzA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v9a ESTERASE/LIPASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 GLY A  76
GLY A  77
SER A 144
HIS A 268
 None
 0.42A 3o9mA-3v9aA:
16.8		 3o9mA-3v9aA:
18.47
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.
3wj2 CARBOXYLESTERASE

(Ferroplasma
acidiphilum) 		PF07859
(Abhydrolase_3) 		4 GLY A  85
GLY A  86
SER A 156
HIS A 281
 None
 0.42A 3o9mA-3wj2A:
2.8		 3o9mA-3wj2A:
17.73
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.
3wmt PROBABLE FERULOYL
ESTERASE B-1

(Aspergillus
oryzae) 		PF07519
(Tannase) 		4 GLY A 124
GLY A 125
SER A 203
HIS A 457
 None
 0.70A 3o9mA-3wmtA:
12.3		 3o9mA-3wmtA:
21.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4be9 STEROL ESTERASE

(Ophiostoma
piceae) 		PF00135
(COesterase) 		5 GLY A 134
GLY A 135
SER A 220
PHE A 427
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
1PE  A1553 (-4.7A)
None
 0.52A 3o9mA-4be9A:
42.6		 3o9mA-4be9A:
31.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c89 ESTERASE

(Lactobacillus
plantarum) 		PF07859
(Abhydrolase_3) 		4 GLY A 107
SER A 174
PHE A 285
HIS A 313
 None
 0.55A 3o9mA-4c89A:
2.2		 3o9mA-4c89A:
21.34
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.
4eys MCCC FAMILY PROTEIN

(Streptococcus
pneumoniae) 		PF02016
(Peptidase_S66) 		4 GLY A  79
GLY A  80
SER A 109
HIS A 315
 AMP  A 401 (-3.0A)
AMP  A 401 (-4.7A)
AMP  A 401 (-2.9A)
AMP  A 401 (-3.9A)
 0.65A 3o9mA-4eysA:
2.0		 3o9mA-4eysA:
20.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4fnm E3 ALPHA-ESTERASE-7
CARBOXYLESTERASE

(Lucilia cuprina) 		PF00135
(COesterase) 		6 GLY A 136
GLY A 137
SER A 218
TRP A 251
PHE A 421
HIS A 471
 DPF  A 601 (-3.4A)
DPF  A 601 (-3.7A)
DPF  A 601 (-1.5A)
DPF  A 601 ( 3.7A)
None
DPF  A 601 (-4.2A)
 0.66A 3o9mA-4fnmA:
38.7		 3o9mA-4fnmA:
32.05
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.
4g7e UREASE

(Cajanus cajan) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		4 GLY B 551
GLY B 552
LEU B 523
PHE B 605
 NI  B 902 ( 4.9A)
None
None
None
 0.67A 3o9mA-4g7eB:
undetectable		 3o9mA-4g7eB:
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.
4h6b ALLENE OXIDE CYCLASE

(Physcomitrella
patens) 		PF06351
(Allene_ox_cyc) 		4 GLY A  34
GLY A  33
LEU A  75
PHE A  29
 None
 0.69A 3o9mA-4h6bA:
undetectable		 3o9mA-4h6bA:
19.32
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.
4hwi HEAT SHOCK COGNATE
71 KDA PROTEIN

(Homo sapiens) 		PF00012
(HSP70) 		5 GLY A 202
GLY A 201
SER A 340
LEU A 228
PHE A 233
 None
 1.45A 3o9mA-4hwiA:
undetectable		 3o9mA-4hwiA:
22.07
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.
4j0k TANNASE

(Lactobacillus
plantarum) 		no annotation 4 GLY A  76
GLY A  77
SER A 163
HIS A 451
 EGR  A 501 (-3.3A)
EGR  A 501 (-3.3A)
EGR  A 501 (-2.6A)
EGR  A 501 (-3.8A)
 0.68A 3o9mA-4j0kA:
2.4		 3o9mA-4j0kA:
23.06
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.
4kry ACETYL ESTERASE

(Escherichia
coli) 		PF07859
(Abhydrolase_3) 		4 GLY A  93
GLY A  94
LEU A 221
HIS A 292
 SEB  A 165 ( 3.6A)
SEB  A 165 ( 3.5A)
PGE  A 401 (-4.1A)
SEB  A 165 ( 4.1A)
 0.48A 3o9mA-4kryA:
2.9		 3o9mA-4kryA:
18.84
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.
4n5i ESTERASE/LIPASE

(Lactobacillus
rhamnosus) 		PF07859
(Abhydrolase_3) 		5 GLY X  75
GLY X  76
SER X 146
PHE X 245
HIS X 278
 2HD  X 401 (-3.5A)
2HD  X 401 (-3.6A)
2HD  X 401 (-1.7A)
2HD  X 401 (-4.6A)
2HD  X 401 (-3.5A)
 0.87A 3o9mA-4n5iX:
20.5		 3o9mA-4n5iX:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p9n CARBOXYLESTERASE

(Sulfolobus
shibatae) 		PF07859
(Abhydrolase_3) 		4 GLY A  80
GLY A  81
SER A 151
HIS A 274
 None
 0.37A 3o9mA-4p9nA:
18.5		 3o9mA-4p9nA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pmh PECTINESTERASE

(Sitophilus
oryzae) 		PF01095
(Pectinesterase) 		4 GLY A 231
GLY A 230
LEU A 202
PHE A 236
 None
 0.65A 3o9mA-4pmhA:
undetectable		 3o9mA-4pmhA:
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.
4q3k MGS-M1

(unidentified) 		PF00326
(Peptidase_S9)
PF07859
(Abhydrolase_3) 		4 GLY A  42
GLY A  43
SER A 113
HIS A 201
 F  A 302 (-3.9A)
F  A 302 (-3.4A)
F  A 302 (-2.5A)
None
 0.42A 3o9mA-4q3kA:
18.6		 3o9mA-4q3kA:
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.
4q3o MGS-MT1

(unidentified) 		PF07859
(Abhydrolase_3) 		6 GLY A 126
GLY A 127
SER A 194
LEU A 251
PHE A 292
HIS A 320
 CL  A 401 ( 4.4A)
CL  A 401 (-3.5A)
CL  A 401 (-2.5A)
None
None
None
 1.34A 3o9mA-4q3oA:
2.3		 3o9mA-4q3oA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q3o MGS-MT1

(unidentified) 		PF07859
(Abhydrolase_3) 		5 GLY A 127
SER A 194
LEU A 251
PHE A 292
HIS A 320
 CL  A 401 (-3.5A)
CL  A 401 (-2.5A)
None
None
None
 0.86A 3o9mA-4q3oA:
2.3		 3o9mA-4q3oA:
20.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qww ACETYLCHOLINESTERASE

(Bungarus
fasciatus) 		PF00135
(COesterase) 		5 GLY A 118
GLY A 119
SER A 200
TRP A 233
HIS A 440
 None
 0.33A 3o9mA-4qwwA:
61.4		 3o9mA-4qwwA:
50.72
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.
4wy5 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		5 GLY A  89
GLY A  90
SER A 161
LEU A 218
HIS A 292
 None
 0.73A 3o9mA-4wy5A:
4.1		 3o9mA-4wy5A:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wy8 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		5 GLY A  89
GLY A  90
SER A 164
LEU A 217
HIS A 291
 None
 1.23A 3o9mA-4wy8A:
4.3		 3o9mA-4wy8A:
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.
4wy8 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		5 GLY A  90
GLY A  91
SER A 164
LEU A 217
HIS A 291
 None
 1.39A 3o9mA-4wy8A:
4.3		 3o9mA-4wy8A:
20.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xii CHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		5 GLY A 115
GLY A 116
SER A 198
PHE A 398
HIS A 438
 None
40V  A1001 (-3.2A)
40V  A1001 (-3.1A)
40V  A1001 (-4.9A)
40V  A1001 (-3.6A)
 1.18A 3o9mA-4xiiA:
70.4		 3o9mA-4xiiA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xii CHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		5 GLY A 115
SER A 198
TRP A 231
PHE A 398
HIS A 438
 None
40V  A1001 (-3.1A)
40V  A1001 (-3.4A)
40V  A1001 (-4.9A)
40V  A1001 (-3.6A)
 0.97A 3o9mA-4xiiA:
70.4		 3o9mA-4xiiA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xii CHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		7 GLY A 116
GLY A 117
SER A 198
TRP A 231
LEU A 286
PHE A 398
HIS A 438
 40V  A1001 (-3.2A)
40V  A1001 (-3.4A)
40V  A1001 (-3.1A)
40V  A1001 (-3.4A)
40V  A1001 ( 4.7A)
40V  A1001 (-4.9A)
40V  A1001 (-3.6A)
 0.45A 3o9mA-4xiiA:
70.4		 3o9mA-4xiiA:
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.
4ypv EST8

(Parvibaculum) 		PF07859
(Abhydrolase_3) 		4 GLY A  87
GLY A  88
SER A 159
HIS A 283
 None
 0.25A 3o9mA-4ypvA:
4.5		 3o9mA-4ypvA:
20.34
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.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 GLY A  75
GLY A  76
PHE A 234
HIS A 263
 SEB  A 151 ( 3.8A)
SEB  A 151 ( 3.5A)
SEB  A 151 ( 4.5A)
SEB  A 151 ( 4.1A)
 0.41A 3o9mA-4zrsA:
21.5		 3o9mA-4zrsA:
20.41
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.
5a1k ADSEVERIN

(Homo sapiens) 		PF00626
(Gelsolin) 		4 GLY A 234
GLY A 233
PHE A 166
HIS A 141
 None
 0.68A 3o9mA-5a1kA:
undetectable		 3o9mA-5a1kA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a2g CARBOXYLIC ESTER
HYDROLASE

(Hungatella
hathewayi) 		PF00135
(COesterase) 		4 GLY A 114
SER A 200
PHE A 379
HIS A 416
 None
 0.62A 3o9mA-5a2gA:
43.4		 3o9mA-5a2gA:
27.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aoc ESTERASE

(Thermogutta
terrifontis) 		PF07859
(Abhydrolase_3) 		4 GLY A  53
GLY A  54
SER A 126
HIS A 248
 LEA  A1283 (-3.4A)
LEA  A1283 (-3.5A)
LEA  A1283 (-2.3A)
LEA  A1283 (-4.0A)
 0.39A 3o9mA-5aocA:
18.1		 3o9mA-5aocA:
20.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		5 GLY A 125
GLY A 126
SER A 204
PHE A 407
HIS A 449
 None
 0.39A 3o9mA-5fv4A:
52.8		 3o9mA-5fv4A:
33.72
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.
5g37 41.9 KDA
INSECTICIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05431
(Toxin_10) 		4 SER A 320
LEU A 266
PHE A 322
HIS A 218
 None
 0.70A 3o9mA-5g37A:
undetectable		 3o9mA-5g37A:
22.18
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 GLY A 107
GLY A 108
SER A 188
LEU A  24
HIS A 317
 TRS  A 402 ( 3.8A)
TRS  A 402 (-3.3A)
TRS  A 402 (-2.3A)
None
TRS  A 402 (-4.3A)
 1.32A 3o9mA-5hc4A:
4.6		 3o9mA-5hc4A:
23.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 GLY A 108
GLY A 109
SER A 188
HIS A 317
 TRS  A 402 (-3.3A)
TRS  A 402 (-3.4A)
TRS  A 402 (-2.3A)
TRS  A 402 (-4.3A)
 0.45A 3o9mA-5hc4A:
4.6		 3o9mA-5hc4A:
23.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 GLY A  27
SER A  97
LEU A 179
PHE A 175
HIS A 247
 6OM  A 301 ( 4.4A)
6OM  A 301 (-1.5A)
None
6OM  A 301 ( 4.9A)
6OM  A 301 (-2.6A)
 1.36A 3o9mA-5hzgA:
11.1		 3o9mA-5hzgA:
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.
5iq0 ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 GLY A 126
GLY A 127
SER A 201
HIS A 333
 None
 0.36A 3o9mA-5iq0A:
4.1		 3o9mA-5iq0A:
22.99
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.
5jd5 MGS-MILE3

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 GLY A  98
GLY A  99
LEU A 225
HIS A 295
 OAS  A 169 ( 4.0A)
OAS  A 169 ( 3.0A)
None
OAS  A 169 ( 4.1A)
 0.54A 3o9mA-5jd5A:
3.1		 3o9mA-5jd5A:
19.82
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.
5loq PUTATIVE
HEME-DEPENDENT
PEROXIDASE LMO2113

(Listeria
monocytogenes) 		PF06778
(Chlor_dismutase) 		5 GLY A 201
GLY A 190
LEU A  75
PHE A  73
HIS A  15
 None
 1.48A 3o9mA-5loqA:
undetectable		 3o9mA-5loqA:
17.99
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.
5mb9 PUTATIVE HEAT SHOCK
PROTEIN

(Chaetomium
thermophilum) 		PF00012
(HSP70) 		5 GLY A 213
GLY A 214
SER A 217
LEU A 245
PHE A 327
 ATP  A 700 (-3.5A)
ATP  A 700 (-3.2A)
None
None
None
 1.07A 3o9mA-5mb9A:
undetectable		 3o9mA-5mb9A:
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.
5mif 'CARBOXYL ESTERASE 2

(Tuber
melanosporum) 		PF07859
(Abhydrolase_3) 		4 GLY A 118
GLY A 119
SER A 190
HIS A 317
 None
 0.37A 3o9mA-5mifA:
19.6		 3o9mA-5mifA:
22.24
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.
5thm ESTERASE-6

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 GLY A 109
SER A 188
TRP A 221
PHE A 397
HIS A 445
 7BZ  A 601 (-3.0A)
7BZ  A 601 (-1.4A)
None
None
7BZ  A 601 (-3.8A)
 0.50A 3o9mA-5thmA:
40.4		 3o9mA-5thmA:
28.62
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.
5vbk LECTIN

(Mytilus
californianus) 		no annotation 4 GLY A  68
LEU A  78
PHE A  90
HIS A 101
 GOL  A 203 (-3.7A)
None
None
None
 0.67A 3o9mA-5vbkA:
undetectable		 3o9mA-5vbkA:
12.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5w1u CARBOXYLIC ESTER
HYDROLASE

(Culex
quinquefasciatus) 		PF00135
(COesterase) 		6 GLY A 109
GLY A 110
SER A 191
TRP A 224
PHE A 394
HIS A 442
 EPE  A 600 (-3.0A)
EPE  A 600 ( 4.4A)
MLI  A 601 ( 3.8A)
MLI  A 601 (-3.4A)
MLI  A 601 ( 4.1A)
EPE  A 600 ( 4.0A)
 0.54A 3o9mA-5w1uA:
41.1		 3o9mA-5w1uA:
31.28
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.
5ydj ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 GLY A 279
GLY A 280
TRP A 393
PHE A 560
HIS A 600
 SEB  A 360 ( 3.0A)
SEB  A 360 ( 3.0A)
None
None
SEB  A 360 ( 4.2A)
 0.43A 3o9mA-5ydjA:
65.9		 3o9mA-5ydjA:
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.
6arx ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 5 GLY A 279
SER A 360
TRP A 393
PHE A 560
HIS A 600
 None
 0.30A 3o9mA-6arxA:
64.2		 3o9mA-6arxA:
undetectable