SIMILAR PATTERNS OF AMINO ACIDS FOR 2HA4_A_ACHA546_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.
1aq0 1,3-1,4-BETA-GLUCANA
SE

(Hordeum vulgare) 		PF00332
(Glyco_hydro_17) 		4 TYR A 170
GLU A 280
TYR A  33
GLY A   6
 None
 1.08A 2ha4A-1aq0A:
undetectable		 2ha4A-1aq0A:
20.93
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) 		4 TYR A 125
GLU A 193
PHE A 324
HIS A 435
 None
 0.45A 2ha4A-1aqlA:
46.7		 2ha4A-1aqlA:
33.86
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) 		8 TRP A  86
TYR A 124
TYR A 133
GLU A 202
TYR A 337
PHE A 338
HIS A 447
GLY A 448
 None
 0.50A 2ha4A-1b41A:
62.8		 2ha4A-1b41A:
88.31
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 TYR A 133
GLU A 202
PHE A 295
HIS A 447
GLY A 448
 None
 0.98A 2ha4A-1b41A:
62.8		 2ha4A-1b41A:
88.31
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.
1bol PROTEIN
(RIBONUCLEASE RH)

(Rhizopus niveus) 		PF00445
(Ribonuclease_T2) 		4 TYR A  57
GLU A 105
HIS A  46
GLY A  47
 None
 1.02A 2ha4A-1bolA:
undetectable		 2ha4A-1bolA:
15.34
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) 		8 TRP A  86
TYR A 124
TYR A 133
GLU A 202
TYR A 337
PHE A 338
HIS A 447
GLY A 448
 None
 0.25A 2ha4A-1c2oA:
63.2		 2ha4A-1c2oA:
99.81
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 TYR A 133
GLU A 202
PHE A 295
HIS A 447
GLY A 448
 None
 0.97A 2ha4A-1c2oA:
63.2		 2ha4A-1c2oA:
99.81
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 TYR A 118
GLU A 188
PHE A 314
HIS A 399
 None
 0.66A 2ha4A-1c7jA:
44.5		 2ha4A-1c7jA:
34.22
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.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE SUBUNIT
GAMMA

(Methanosarcina
barkeri;
Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		4 TYR C3216
TYR B2289
PHE B2291
GLY C3010
 None
 1.06A 2ha4A-1e6yC:
undetectable		 2ha4A-1e6yC:
18.27
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) 		7 TRP A  84
TYR A 121
TYR A 130
GLU A 199
PHE A 331
HIS A 440
GLY A 441
 SAF  A1998 (-3.8A)
None
None
SAF  A1998 (-3.5A)
EMM  A1999 (-4.7A)
EMM  A1999 ( 3.8A)
SAF  A1998 ( 4.6A)
 0.75A 2ha4A-1gqrA:
60.4		 2ha4A-1gqrA:
58.60
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) 		4 GLU A 208
PHE A 345
HIS A 449
GLY A 450
 None
 0.19A 2ha4A-1gz7A:
41.1		 2ha4A-1gz7A:
32.99
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.
1h0h FORMATE
DEHYDROGENASE
SUBUNIT ALPHA

(Desulfovibrio
gigas) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 TYR A 355
TYR A 170
PHE A 788
GLY A 402
 None
 1.07A 2ha4A-1h0hA:
undetectable		 2ha4A-1h0hA:
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.
1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE

(Sulfolobus
acidocaldarius) 		PF00128
(Alpha-amylase)
PF09196
(DUF1953) 		4 TYR A 352
PHE A 194
HIS A 229
GLY A 232
 None
 1.10A 2ha4A-1iv8A:
undetectable		 2ha4A-1iv8A:
20.78
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) 		4 TYR A 125
GLU A 193
PHE A 324
HIS A 435
 None
 0.57A 2ha4A-1jmyA:
46.3		 2ha4A-1jmyA:
34.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1k4y LIVER
CARBOXYLESTERASE

(Oryctolagus
cuniculus) 		PF00135
(COesterase) 		4 TYR A 152
GLU A 220
HIS A 467
GLY A 468
 None
 0.69A 2ha4A-1k4yA:
48.5		 2ha4A-1k4yA:
33.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kq0 METHIONINE
AMINOPEPTIDASE 2

(Homo sapiens) 		PF00557
(Peptidase_M24) 		4 TYR A 444
GLU A 364
HIS A 331
GLY A 330
 MED  A 601 ( 4.7A)
ZN  A 480 (-2.6A)
ZN  A 480 ( 3.4A)
None
 0.82A 2ha4A-1kq0A:
undetectable		 2ha4A-1kq0A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mpy CATECHOL
2,3-DIOXYGENASE

(Pseudomonas
putida) 		PF00903
(Glyoxalase) 		4 GLU A 118
PHE A  53
HIS A  10
GLY A  69
 None
 1.08A 2ha4A-1mpyA:
undetectable		 2ha4A-1mpyA:
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.
1mty METHANE
MONOOXYGENASE
HYDROXYLASE

(Methylococcus
capsulatus) 		PF02332
(Phenol_Hydrox) 		4 TYR D 387
GLU D 291
HIS D 343
GLY D 287
 None
 1.07A 2ha4A-1mtyD:
undetectable		 2ha4A-1mtyD:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n7u ADSORPTION PROTEIN
P2

(Salmonella
virus PRD1) 		PF09214
(Prd1-P2) 		4 TYR A  89
GLU A 111
TYR A 135
HIS A 136
 None
 0.97A 2ha4A-1n7uA:
undetectable		 2ha4A-1n7uA:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ps9 2,4-DIENOYL-COA
REDUCTASE

(Escherichia
coli) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 TYR A 109
GLU A  31
HIS A  26
GLY A  28
 None
None
MDE  A 704 ( 4.1A)
None
 0.83A 2ha4A-1ps9A:
undetectable		 2ha4A-1ps9A:
22.75
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) 		6 TRP A  83
TYR A 162
GLU A 237
PHE A 371
HIS A 480
GLY A 481
 I40  A 997 (-3.2A)
None
I40  A 997 (-4.2A)
I40  A 997 (-4.9A)
SO4  A 593 (-4.1A)
I40  A 997 ( 4.3A)
 0.40A 2ha4A-1qonA:
56.4		 2ha4A-1qonA:
38.59
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 TRP A  83
TYR A 162
GLU A 237
TYR A 370
GLY A 481
 I40  A 997 (-3.2A)
None
I40  A 997 (-4.2A)
I40  A 997 (-3.9A)
I40  A 997 ( 4.3A)
 0.87A 2ha4A-1qonA:
56.4		 2ha4A-1qonA:
38.59
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) 		6 TYR A  71
TYR A 162
GLU A 237
PHE A 371
HIS A 480
GLY A 481
 I40  A 997 ( 3.8A)
None
I40  A 997 (-4.2A)
I40  A 997 (-4.9A)
SO4  A 593 (-4.1A)
I40  A 997 ( 4.3A)
 1.39A 2ha4A-1qonA:
56.4		 2ha4A-1qonA:
38.59
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.
1rqb TRANSCARBOXYLASE 5S
SUBUNIT

(Propionibacterium
freudenreichii) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		4 TYR A 103
TYR A  61
PHE A 445
GLY A  57
 None
 1.11A 2ha4A-1rqbA:
undetectable		 2ha4A-1rqbA:
21.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1thg LIPASE 2

(Galactomyces
candidus) 		PF00135
(COesterase) 		5 TYR A 141
GLU A 216
PHE A 358
HIS A 463
GLY A 464
 None
 0.53A 2ha4A-1thgA:
36.4		 2ha4A-1thgA:
30.90
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.
1usy ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT

(Thermotoga
maritima) 		PF13393
(tRNA-synt_His) 		4 TYR C  75
GLU C  96
TYR C 234
GLY C 265
 None
 1.05A 2ha4A-1usyC:
undetectable		 2ha4A-1usyC:
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.
1w74 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
A

(Mycobacterium
tuberculosis) 		PF00160
(Pro_isomerase) 		4 TYR A  95
TYR A  66
PHE A  65
GLY A  82
 None
 1.10A 2ha4A-1w74A:
undetectable		 2ha4A-1w74A:
15.30
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.
1wkm METHIONINE
AMINOPEPTIDASE

(Pyrococcus
furiosus) 		PF00557
(Peptidase_M24) 		4 TYR A 265
GLU A 187
HIS A 153
GLY A 152
 MET  A1298 ( 4.7A)
MN  A 296 ( 2.6A)
MN  A 296 ( 3.3A)
None
 0.83A 2ha4A-1wkmA:
undetectable		 2ha4A-1wkmA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wom SIGMA FACTOR SIGB
REGULATION PROTEIN
RSBQ

(Bacillus
subtilis) 		PF12697
(Abhydrolase_6) 		4 TYR A  52
TYR A 125
HIS A  95
GLY A 120
 None
None
PGO  A 601 ( 4.8A)
None
 1.11A 2ha4A-1womA:
11.4		 2ha4A-1womA:
20.55
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.
2adu METHIONINE
AMINOPEPTIDASE 2

(Homo sapiens) 		PF00557
(Peptidase_M24) 		4 TYR A 444
GLU A 364
HIS A 331
GLY A 330
 R20  A 906 (-3.5A)
CO  A 502 ( 2.6A)
CO  A 502 ( 3.2A)
None
 0.87A 2ha4A-2aduA:
undetectable		 2ha4A-2aduA:
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.
2fsr ACETYLTRANSFERASE

(Agrobacterium
fabrum) 		PF13302
(Acetyltransf_3) 		4 TRP A  95
TYR A 165
GLU A  92
GLY A  94
 None
 1.13A 2ha4A-2fsrA:
undetectable		 2ha4A-2fsrA:
16.82
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.
2fvm DIHYDROPYRIMIDINASE

(Lachancea
kluyveri) 		PF01979
(Amidohydro_1) 		4 GLU A 278
PHE A  97
HIS A  62
GLY A 356
 None
KCX  A 167 ( 4.5A)
ZN  A 601 (-3.2A)
None
 1.07A 2ha4A-2fvmA:
undetectable		 2ha4A-2fvmA:
20.82
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.
2g5g PUTATIVE LIPOPROTEIN

(Campylobacter
jejuni) 		PF04187
(Cofac_haem_bdg) 		4 GLU X  80
TYR X 219
HIS X 220
GLY X 217
 None
 0.88A 2ha4A-2g5gX:
undetectable		 2ha4A-2g5gX:
20.08
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.
2g5g PUTATIVE LIPOPROTEIN

(Campylobacter
jejuni) 		PF04187
(Cofac_haem_bdg) 		4 TYR X 120
GLU X  80
HIS X 220
GLY X 217
 None
 1.06A 2ha4A-2g5gX:
undetectable		 2ha4A-2g5gX:
20.08
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.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT ALPHA
BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN A

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		4 TYR N 526
TYR N 456
HIS I 179
GLY I 461
 None
 1.13A 2ha4A-2gk1N:
undetectable		 2ha4A-2gk1N:
16.94
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.
2h34 SERINE/THREONINE-PRO
TEIN KINASE PKNE

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		4 GLU A  73
TYR A 154
PHE A 152
HIS A  75
 None
 0.99A 2ha4A-2h34A:
undetectable		 2ha4A-2h34A:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nsm CARBOXYPEPTIDASE N
CATALYTIC CHAIN

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		4 TYR A 127
GLU A  69
HIS A 196
GLY A 197
 None
SO4  A1776 ( 4.6A)
SO4  A1776 (-3.9A)
None
 0.97A 2ha4A-2nsmA:
2.6		 2ha4A-2nsmA:
21.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o4v PORIN P

(Pseudomonas
aeruginosa) 		PF07396
(Porin_O_P) 		4 TYR A 298
GLU A 264
HIS A 200
GLY A 265
 None
None
None
C8E  A1298 (-3.4A)
 1.09A 2ha4A-2o4vA:
undetectable		 2ha4A-2o4vA:
22.28
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.
2pjs UNCHARACTERIZED
PROTEIN ATU1953

(Agrobacterium
fabrum) 		PF00903
(Glyoxalase) 		4 GLU A  55
TYR A  88
PHE A 101
GLY A  59
 None
 0.81A 2ha4A-2pjsA:
undetectable		 2ha4A-2pjsA:
11.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wac CG7008-PA

(Drosophila
melanogaster) 		PF00567
(TUDOR) 		4 GLU A 709
TYR A 783
PHE A 760
GLY A 787
 None
 1.14A 2ha4A-2wacA:
undetectable		 2ha4A-2wacA:
16.94
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.
3fk3 PROTEIN AF-9 HOMOLOG

(Saccharomyces
cerevisiae) 		PF03366
(YEATS) 		4 TYR A  57
GLU A  53
PHE A 150
GLY A  49
 None
 1.02A 2ha4A-3fk3A:
undetectable		 2ha4A-3fk3A:
13.50
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.
3fmq METHIONINE
AMINOPEPTIDASE 2

(Encephalitozoon
cuniculi) 		PF00557
(Peptidase_M24) 		4 TYR A 324
GLU A 243
HIS A 210
GLY A 209
 FUG  A 481 (-3.9A)
FE  A 451 ( 2.7A)
FE  A 451 (-3.4A)
None
 0.80A 2ha4A-3fmqA:
undetectable		 2ha4A-3fmqA:
19.17
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.
3hno PYROPHOSPHATE-DEPEND
ENT
PHOSPHOFRUCTOKINASE

(Nitrosospira
multiformis) 		PF00365
(PFK) 		4 TYR A  93
TYR A 110
PHE A 108
GLY A  45
 None
 1.03A 2ha4A-3hnoA:
undetectable		 2ha4A-3hnoA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ip3 OXIDOREDUCTASE,
PUTATIVE

(Thermotoga
maritima) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 TYR A 236
GLU A  96
HIS A  12
GLY A  11
 None
 1.13A 2ha4A-3ip3A:
undetectable		 2ha4A-3ip3A:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iyl VP1

(Aquareovirus C) 		PF06016
(Reovirus_L2) 		4 TYR W 443
TYR W1160
HIS W1065
GLY W1106
 None
 1.12A 2ha4A-3iylW:
undetectable		 2ha4A-3iylW:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k1d 1,4-ALPHA-GLUCAN-BRA
NCHING ENZYME

(Mycobacterium
tuberculosis) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		4 TRP A 491
TYR A 631
TYR A 562
PHE A 660
 None
 1.15A 2ha4A-3k1dA:
undetectable		 2ha4A-3k1dA:
23.13
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.
3k28 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
2

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		4 TYR A 184
GLU A 241
TYR A 257
GLY A 253
 None
 1.08A 2ha4A-3k28A:
undetectable		 2ha4A-3k28A:
21.49
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.
3k2q PYROPHOSPHATE-DEPEND
ENT
PHOSPHOFRUCTOKINASE

(Marinobacter
hydrocarbonoclasticus) 		PF00365
(PFK) 		4 TYR A  93
TYR A 110
PHE A 108
GLY A  45
 None
 1.06A 2ha4A-3k2qA:
undetectable		 2ha4A-3k2qA:
22.83
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) 		4 TYR A1152
GLU A1220
HIS A1468
GLY A1469
 None
WW2  A 193 ( 4.2A)
None
None
 0.40A 2ha4A-3k9bA:
46.7		 2ha4A-3k9bA:
35.54
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.
3kgy BIFUNCTIONAL
DEAMINASE-REDUCTASE
DOMAIN PROTEIN

(Chloroflexus
aurantiacus) 		PF01872
(RibD_C) 		4 GLU A  97
PHE A  74
HIS A 101
GLY A 119
 None
 1.13A 2ha4A-3kgyA:
undetectable		 2ha4A-3kgyA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n2z LYSOSOMAL PRO-X
CARBOXYPEPTIDASE

(Homo sapiens) 		PF05577
(Peptidase_S28) 		4 TYR B 192
TYR B 180
GLU B 366
PHE B  60
 None
 1.12A 2ha4A-3n2zB:
12.7		 2ha4A-3n2zB:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nap CAPSID PROTEIN

(Triatoma virus) 		PF08762
(CRPV_capsid) 		4 TYR A 145
TYR A 113
PHE A  75
GLY A 116
 None
 1.14A 2ha4A-3napA:
undetectable		 2ha4A-3napA:
21.06
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.
3nap CAPSID PROTEIN

(Triatoma virus) 		PF08762
(CRPV_capsid) 		4 TYR A 206
TYR A 113
PHE A 227
GLY A 116
 None
 1.07A 2ha4A-3napA:
undetectable		 2ha4A-3napA:
21.06
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.
3rcy MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN

(Roseovarius sp.
TM1035) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A  41
TYR A 128
HIS A 210
GLY A 208
 None
None
MG  A 500 ( 4.9A)
None
 1.06A 2ha4A-3rcyA:
undetectable		 2ha4A-3rcyA:
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.
3rze HISTAMINE H1
RECEPTOR, LYSOZYME
CHIMERA

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 TYR A 108
TYR A 431
PHE A 432
GLY A 457
 D7V  A1201 ( 3.7A)
5EH  A1200 (-4.4A)
5EH  A1200 ( 4.3A)
None
 1.14A 2ha4A-3rzeA:
undetectable		 2ha4A-3rzeA:
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.
3stp GALACTONATE
DEHYDRATASE,
PUTATIVE

(Labrenzia
aggregata) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A 154
GLU A 266
PHE A 338
HIS A 316
 None
MG  A 391 (-2.6A)
None
None
 1.08A 2ha4A-3stpA:
undetectable		 2ha4A-3stpA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3szb ALDEHYDE
DEHYDROGENASE

(Homo sapiens) 		PF00171
(Aldedh) 		4 TRP A  80
GLU A  69
HIS A 397
GLY A 414
 None
 1.12A 2ha4A-3szbA:
undetectable		 2ha4A-3szbA:
21.58
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.
3t4w MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Sulfitobacter
sp. NAS-14.1) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A  41
TYR A 128
HIS A 210
GLY A 208
 None
 1.12A 2ha4A-3t4wA:
undetectable		 2ha4A-3t4wA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v8u TRANSFERRIN
BINDING-PROTEIN B

(Neisseria
meningitidis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 TYR A 103
PHE A 166
HIS A 168
GLY A 169
 None
 0.78A 2ha4A-3v8uA:
undetectable		 2ha4A-3v8uA:
21.87
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.
3ve2 TRANSFERRIN-BINDING
PROTEIN 2

(Neisseria
meningitidis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 TYR A 104
PHE A 164
HIS A 166
GLY A 167
 None
 0.66A 2ha4A-3ve2A:
undetectable		 2ha4A-3ve2A:
22.13
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.
3vuo NTNHA

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		4 TRP A 962
TYR A1032
GLU A1014
GLY A 871
 None
 0.80A 2ha4A-3vuoA:
undetectable		 2ha4A-3vuoA:
17.07
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) 		4 TYR A 144
GLU A 219
PHE A 356
HIS A 465
 None
 0.34A 2ha4A-4be9A:
40.3		 2ha4A-4be9A:
30.94
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.
4bq4 B-AGARASE

(Saccharophagus
degradans) 		PF02449
(Glyco_hydro_42) 		4 GLU A 634
TYR A 663
HIS A 630
GLY A 631
 None
 1.01A 2ha4A-4bq4A:
undetectable		 2ha4A-4bq4A:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cvu BETA-MANNOSIDASE

(Trichoderma
harzianum) 		PF00703
(Glyco_hydro_2) 		4 TYR A 683
GLU A 647
HIS A 628
GLY A 644
 None
 0.95A 2ha4A-4cvuA:
undetectable		 2ha4A-4cvuA:
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.
4e4u MANDALATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(unidentified) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A  41
TYR A 128
HIS A 209
GLY A 207
 None
 1.06A 2ha4A-4e4uA:
undetectable		 2ha4A-4e4uA:
21.90
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.
4e5t MANDELATE RACEMASE /
MUCONATE LACTONIZING
ENZYME, C-TERMINAL
DOMAIN PROTEIN

(Labrenzia
alexandrii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A  41
TYR A 128
HIS A 215
GLY A 213
 None
None
MG  A 501 ( 4.5A)
None
 0.99A 2ha4A-4e5tA:
undetectable		 2ha4A-4e5tA:
23.73
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.
4el8 GLYCOSIDE HYDROLASE
FAMILY 48

(Caldicellulosiruptor
bescii) 		PF02011
(Glyco_hydro_48) 		4 TYR A 386
TYR A 108
GLU A 111
HIS A 319
 None
 1.12A 2ha4A-4el8A:
undetectable		 2ha4A-4el8A:
22.95
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.
4fo7 METHIONINE
AMINOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF00557
(Peptidase_M24) 		4 TYR A  62
GLU A 203
HIS A 170
GLY A 169
 None
MN  A 301 (-2.7A)
MN  A 301 (-3.5A)
None
 1.09A 2ha4A-4fo7A:
undetectable		 2ha4A-4fo7A:
19.89
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.
4foz PORIN D

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 TYR A 305
GLU A 313
TYR A 359
GLY A 310
 None
 0.99A 2ha4A-4fozA:
undetectable		 2ha4A-4fozA:
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.
4grx AMINOTRANSFERASE

(Paracoccus
denitrificans) 		PF00202
(Aminotran_3) 		4 GLU A 257
TYR A 274
PHE A 239
GLY A 270
 None
 1.04A 2ha4A-4grxA:
undetectable		 2ha4A-4grxA:
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.
4gzi GLUCAN
ENDO-1,3-BETA-D-GLUC
OSIDASE

(Solanum
tuberosum) 		PF00332
(Glyco_hydro_17) 		4 TYR A 201
GLU A 310
TYR A  58
GLY A  31
 BGC  A 401 (-4.2A)
BGC  A 402 (-2.8A)
BGC  A 402 (-3.5A)
BGC  A 402 ( 3.7A)
 1.07A 2ha4A-4gziA:
undetectable		 2ha4A-4gziA:
20.37
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		4 TYR A 195
TYR A 418
PHE A 340
HIS A 424
 OPE  A 502 (-3.9A)
None
None
None
 1.03A 2ha4A-4ineA:
undetectable		 2ha4A-4ineA:
21.21
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.
4lr2 BIS(5'-ADENOSYL)-TRI
PHOSPHATASE ENPP4

(Homo sapiens) 		PF01663
(Phosphodiest) 		4 TYR A 338
TYR A  40
HIS A 193
GLY A 192
 None
None
ZN  A 506 ( 3.3A)
None
 0.99A 2ha4A-4lr2A:
undetectable		 2ha4A-4lr2A:
19.46
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.
4q88 UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF07470
(Glyco_hydro_88) 		4 TYR A 320
GLU A 285
PHE A 356
GLY A 288
 None
 1.04A 2ha4A-4q88A:
undetectable		 2ha4A-4q88A:
20.69
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) 		8 TRP A  84
TYR A 121
TYR A 130
GLU A 199
TYR A 330
PHE A 331
HIS A 440
GLY A 441
 None
 0.39A 2ha4A-4qwwA:
61.9		 2ha4A-4qwwA:
64.02
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 TYR A 121
TYR A 130
GLU A 199
PHE A 288
HIS A 440
 None
 1.34A 2ha4A-4qwwA:
61.9		 2ha4A-4qwwA:
64.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		4 TYR A2357
TYR A2390
HIS A2319
GLY A2324
 None
 0.85A 2ha4A-4tvcA:
2.1		 2ha4A-4tvcA:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4um8 INTEGRIN ALPHA-V
INTEGRIN BETA-6

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		4 GLU B 291
TYR A 275
PHE A 278
GLY B 260
 None
 1.11A 2ha4A-4um8B:
2.2		 2ha4A-4um8B:
21.67
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) 		6 TRP A  82
TYR A 128
GLU A 197
PHE A 329
HIS A 438
GLY A 439
 40V  A1001 (-3.3A)
None
40V  A1001 (-3.2A)
40V  A1001 (-4.0A)
40V  A1001 (-3.6A)
40V  A1001 ( 3.9A)
 0.28A 2ha4A-4xiiA:
61.7		 2ha4A-4xiiA:
52.12
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.
4zxc HYDROQUINONE
DIOXYGENASE LARGE
SUBUNIT

(Pseudomonas sp.
WBC-3) 		no annotation 4 TYR W  95
TYR W 101
HIS W 256
GLY W 257
 None
None
FE  W 500 (-3.1A)
None
 1.13A 2ha4A-4zxcW:
undetectable		 2ha4A-4zxcW:
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.
5ege ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 6

(Mus musculus) 		PF01663
(Phosphodiest) 		4 TYR A 356
TYR A  38
HIS A 197
GLY A 196
 None
None
ZN  A 508 ( 3.2A)
None
 1.10A 2ha4A-5egeA:
undetectable		 2ha4A-5egeA:
22.47
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.
5ev7 CONSERVED DOMAIN
PROTEIN

(Bacillus
anthracis) 		PF13402
(Peptidase_M60)
PF17291
(M60-like_N) 		4 GLU A 216
PHE A  69
HIS A 287
GLY A 284
 None
 1.04A 2ha4A-5ev7A:
undetectable		 2ha4A-5ev7A:
21.78
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.
5f7c ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 TYR A 516
TYR A 298
PHE A 253
GLY A 303
 None
 1.15A 2ha4A-5f7cA:
undetectable		 2ha4A-5f7cA:
22.32
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) 		4 TYR A 135
GLU A 203
HIS A 449
GLY A 450
 None
 0.28A 2ha4A-5fv4A:
50.0		 2ha4A-5fv4A:
35.62
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.
5hsi PUTATIVE
DECARBOXYLASE

(Lactobacillus
brevis) 		PF00282
(Pyridoxal_deC) 		4 TYR A 147
TYR A 324
HIS A 326
GLY A 165
 None
 1.13A 2ha4A-5hsiA:
3.9		 2ha4A-5hsiA:
21.98
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.
5icl LIPOATE--PROTEIN
LIGASE

(Enterococcus
faecalis) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		4 TYR A 239
TYR A 138
PHE A 145
GLY A  71
 None
 1.01A 2ha4A-5iclA:
undetectable		 2ha4A-5iclA:
20.58
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.
5kf2 PREDICTED
ACETYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF00583
(Acetyltransf_1) 		4 TYR A 226
TYR A 297
PHE A 197
GLY A 254
 None
None
None
COA  A 401 (-3.3A)
 1.07A 2ha4A-5kf2A:
undetectable		 2ha4A-5kf2A:
18.55
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.
5m59 PUTATIVE PRE-MRNA
SPLICING FACTOR

(Chaetomium
thermophilum) 		PF08084
(PROCT) 		4 TRP B2180
TYR B2271
TYR B2102
GLY B2149
 None
 1.02A 2ha4A-5m59B:
undetectable		 2ha4A-5m59B:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5noa FAMILY 88 GLYCOSYL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF07470
(Glyco_hydro_88) 		4 TYR A 323
GLU A 288
PHE A 359
GLY A 291
 None
 1.11A 2ha4A-5noaA:
undetectable		 2ha4A-5noaA:
21.94
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.
5t3b GLYCOSIDE HYDROLASE

(Bacteroides
plebeius) 		no annotation 4 TYR A  57
TYR A 397
TYR A  99
GLY A 412
 None
 1.01A 2ha4A-5t3bA:
undetectable		 2ha4A-5t3bA:
21.73
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.
5veo ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 5

(Mus musculus) 		PF01663
(Phosphodiest) 		4 TYR A 341
TYR A  42
HIS A 195
GLY A 194
 None
None
ZN  A 501 ( 3.2A)
None
 0.99A 2ha4A-5veoA:
undetectable		 2ha4A-5veoA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wi9 -

(-) 		no annotation 4 TYR A 221
TYR A 175
PHE A 229
GLY A 171
 None
 1.04A 2ha4A-5wi9A:
undetectable		 2ha4A-5wi9A:
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.
5x3j GLYCOSIDE HYDROLASE
FAMILY 31

(Kribbella
flavida) 		no annotation 4 TYR A 191
GLU A 314
HIS A 575
GLY A 285
 GLC  A 819 ( 4.3A)
GLC  A 822 ( 2.6A)
GLC  A 822 ( 4.0A)
None
 1.12A 2ha4A-5x3jA:
undetectable		 2ha4A-5x3jA:
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.
5ydj ACETYLCHOLINESTERASE

(Anopheles
gambiae) 		no annotation 8 TRP A 245
TYR A 282
TYR A 291
GLU A 359
TYR A 489
PHE A 490
HIS A 600
GLY A 601
 SEB  A 360 ( 4.2A)
None
None
SEB  A 360 ( 3.3A)
None
None
SEB  A 360 ( 4.2A)
None
 0.38A 2ha4A-5ydjA:
59.7		 2ha4A-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.
5yj6 DOCKERIN TYPE I
REPEAT-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 4 TYR A 413
TYR A 141
GLU A 144
HIS A 346
 None
 1.13A 2ha4A-5yj6A:
undetectable		 2ha4A-5yj6A:
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.
6apj ALPHA-N-ACETYLGALACT
OSAMINIDE
ALPHA-2,6-SIALYLTRAN
SFERASE 2

(Homo sapiens) 		no annotation 4 TYR A 337
PHE A 338
HIS A 336
GLY A 157
 None
 1.11A 2ha4A-6apjA:
undetectable		 2ha4A-6apjA:
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 8 TRP A 245
TYR A 282
TYR A 291
GLU A 359
TYR A 489
PHE A 490
HIS A 600
GLY A 601
 None
 0.43A 2ha4A-6arxA:
57.2		 2ha4A-6arxA:
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.
6c01 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 3

(Homo sapiens) 		no annotation 4 TYR A 485
TYR A 173
HIS A 329
GLY A 328
 None
None
ZN  A 901 ( 3.3A)
None
 0.96A 2ha4A-6c01A:
undetectable		 2ha4A-6c01A:
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.
6f2t -

(-) 		no annotation 4 TYR A 485
TYR A 174
HIS A 330
GLY A 329
 None
None
ZN  A1003 (-3.2A)
None
 1.03A 2ha4A-6f2tA:
undetectable		 2ha4A-6f2tA:
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.
6g3u -

(-) 		no annotation 4 TYR A 598
PHE A 607
HIS A 660
GLY A 658
 None
 1.15A 2ha4A-6g3uA:
undetectable		 2ha4A-6g3uA:
undetectable