SIMILAR PATTERNS OF AMINO ACIDS FOR 3PGL_A_RZXA257

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.
1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE

(Rattus rattus) 		PF01242
(PTPS) 		4 PHE A  19
VAL A 131
ILE A 113
SER A 104
 None
 0.83A 3pglA-1b66A:
undetectable		 3pglA-1b66A:
20.63
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.
1d1z SAP SH2 DOMAIN

(Homo sapiens) 		PF00017
(SH2) 		4 ASP A1033
VAL A1004
ILE A1084
TYR A1007
 None
 0.99A 3pglA-1d1zA:
undetectable		 3pglA-1d1zA:
16.30
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.
1fai IGG2B-KAPPA R19.9
FAB (HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 PHE H  29
VAL H  34
ILE H  51
SER H  21
 None
 0.90A 3pglA-1faiH:
undetectable		 3pglA-1faiH:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1foh PHENOL HYDROXYLASE

(Cutaneotrichosporon
cutaneum) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		4 PHE A 531
VAL A 558
ILE A 512
SER A 543
 None
 0.98A 3pglA-1fohA:
3.1		 3pglA-1fohA:
14.05
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.
1jos RIBOSOME-BINDING
FACTOR A

(Haemophilus
influenzae) 		PF02033
(RBFA) 		4 ASP A  45
ILE A  94
SER A  43
TYR A  48
 None
 0.98A 3pglA-1josA:
undetectable		 3pglA-1josA:
20.00
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.
1mu2 HIV-2 RT

(Human
immunodeficiency
virus 2) 		PF00075
(RNase_H)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		4 PHE A 481
VAL A 532
ILE A 530
SER A 507
 None
 0.96A 3pglA-1mu2A:
undetectable		 3pglA-1mu2A:
16.67
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.
1noz DNA POLYMERASE

(Escherichia
virus T4) 		PF03104
(DNA_pol_B_exo1) 		4 PHE A 352
VAL A 106
ILE A   6
TYR A 101
 None
 0.96A 3pglA-1nozA:
undetectable		 3pglA-1nozA:
18.30
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.
1o6u SEC14-LIKE PROTEIN 2

(Homo sapiens) 		PF00650
(CRAL_TRIO) 		4 ASP A 235
VAL A  98
ILE A 152
SER A 233
 None
 0.96A 3pglA-1o6uA:
undetectable		 3pglA-1o6uA:
18.89
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.
1pg5 ASPARTATE
CARBAMOYLTRANSFERASE

(Sulfolobus
acidocaldarius) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		4 PHE A  19
VAL A 134
ILE A 137
SER A  11
 None
 0.88A 3pglA-1pg5A:
2.2		 3pglA-1pg5A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sqj OLIGOXYLOGLUCAN
REDUCING-END-SPECIFI
C CELLOBIOHYDROLASE

(Geotrichum sp.
M128) 		PF15899
(BNR_6) 		4 ASP A 472
PHE A 481
VAL A 502
ILE A 492
 None
 0.67A 3pglA-1sqjA:
undetectable		 3pglA-1sqjA:
12.18
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.
1tj5 SUCROSE-PHOSPHATASE

(Synechocystis
sp. PCC 6803) 		PF05116
(S6PP) 		4 ASP A  99
VAL A 154
ILE A 130
TYR A 119
 None
 0.92A 3pglA-1tj5A:
7.5		 3pglA-1tj5A:
20.72
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.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ASP A 595
VAL A 560
ILE A 558
TYR A 626
 None
 0.99A 3pglA-1tkcA:
undetectable		 3pglA-1tkcA:
13.64
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.
1yb2 HYPOTHETICAL PROTEIN
TA0852

(Thermoplasma
acidophilum) 		PF08704
(GCD14) 		4 ASP A  13
VAL A  48
ILE A  25
SER A  11
 None
 0.93A 3pglA-1yb2A:
3.1		 3pglA-1yb2A:
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.
1yb2 HYPOTHETICAL PROTEIN
TA0852

(Thermoplasma
acidophilum) 		PF08704
(GCD14) 		4 VAL A  66
ILE A  67
SER A  59
TYR A  62
 None
 0.97A 3pglA-1yb2A:
3.1		 3pglA-1yb2A:
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.
2f3o PYRUVATE
FORMATE-LYASE 2

(Archaeoglobus
fulgidus) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 ASP A 527
VAL A 156
ILE A 273
SER A 515
 None
 0.94A 3pglA-2f3oA:
undetectable		 3pglA-2f3oA:
12.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hhl CTD SMALL
PHOSPHATASE-LIKE
PROTEIN

(Homo sapiens) 		PF03031
(NIF) 		4 ASP A  36
PHE A  44
SER A  92
TYR A  96
 None
KEG  A 902 (-3.8A)
None
None
 0.81A 3pglA-2hhlA:
28.9		 3pglA-2hhlA:
75.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hhl CTD SMALL
PHOSPHATASE-LIKE
PROTEIN

(Homo sapiens) 		PF03031
(NIF) 		5 ASP A  36
VAL A  56
ILE A  58
SER A  92
TYR A  96
 None
 0.59A 3pglA-2hhlA:
28.9		 3pglA-2hhlA:
75.79
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.
2jov HYPOTHETICAL PROTEIN
CPE0013

(Clostridium
perfringens) 		PF07892
(DUF1667) 		4 PHE A   6
VAL A  23
ILE A  67
SER A  42
 None
 0.89A 3pglA-2jovA:
undetectable		 3pglA-2jovA:
17.03
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.
2kvc PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycobacterium
tuberculosis) 		PF11829
(DUF3349) 		4 ASP A  58
VAL A  65
ILE A  66
SER A  28
 None
 0.83A 3pglA-2kvcA:
undetectable		 3pglA-2kvcA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lwf MONOTHIOL
GLUTAREDOXIN-S16,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 4 VAL A 126
ILE A  77
SER A 111
TYR A  90
 None
 0.96A 3pglA-2lwfA:
undetectable		 3pglA-2lwfA:
23.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q5e CARBOXY-TERMINAL
DOMAIN RNA
POLYMERASE II
POLYPEPTIDE A SMALL
PHOSPHATASE 2

(Homo sapiens) 		PF03031
(NIF) 		5 ASP A 109
PHE A 117
ILE A 131
SER A 165
TYR A 169
 None
 0.81A 3pglA-2q5eA:
30.8		 3pglA-2q5eA:
75.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q5e CARBOXY-TERMINAL
DOMAIN RNA
POLYMERASE II
POLYPEPTIDE A SMALL
PHOSPHATASE 2

(Homo sapiens) 		PF03031
(NIF) 		4 ASP A 109
SER A 165
TYR A 169
ARG A 189
 None
 0.83A 3pglA-2q5eA:
30.8		 3pglA-2q5eA:
75.96
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.
2qbu PRECORRIN-2
METHYLTRANSFERASE

(Methanothermobacter
thermautotrophicus) 		PF00590
(TP_methylase) 		4 VAL A   8
ILE A 100
SER A  28
ARG A  56
 None
 0.96A 3pglA-2qbuA:
undetectable		 3pglA-2qbuA:
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.
2rcb GLUTAMATE [NMDA]
RECEPTOR SUBUNIT 3B

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 ASP A 222
SER A 123
TYR A 250
ARG A 128
 DSN  A 901 (-3.0A)
DSN  A 901 (-2.7A)
DSN  A 901 (-4.7A)
DSN  A 901 (-3.0A)
 0.94A 3pglA-2rcbA:
undetectable		 3pglA-2rcbA:
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.
2rko VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF09336
(Vps4_C) 		4 PHE A 308
VAL A 342
ILE A 410
SER A 335
 None
 1.00A 3pglA-2rkoA:
undetectable		 3pglA-2rkoA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rmp MUCOROPEPSIN

(Rhizomucor
miehei) 		PF00026
(Asp) 		4 ASP A 260
PHE A 318
VAL A 302
ILE A 282
 None
 0.85A 3pglA-2rmpA:
undetectable		 3pglA-2rmpA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wn4 ADP-RIBOSYLTRANSFERA
SE ENZYMATIC
COMPONENT

(Clostridioides
difficile) 		PF03496
(ADPrib_exo_Tox) 		4 ASP A 145
ILE A  34
SER A 183
TYR A 176
 None
 0.90A 3pglA-2wn4A:
undetectable		 3pglA-2wn4A:
14.69
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.
2y4l MANNOSYLGLYCERATE
SYNTHASE

(Rhodothermus
marinus) 		no annotation 4 VAL A 200
ILE A 206
SER A 157
ARG A 144
 None
 1.00A 3pglA-2y4lA:
3.4		 3pglA-2y4lA:
18.83
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.
2zy2 L-ASPARTATE
4-CARBOXYLYASE

(Pseudomonas sp.
ATCC 19121) 		PF00155
(Aminotran_1_2) 		4 PHE A 313
VAL A 326
ILE A 152
SER A 144
 None
 0.98A 3pglA-2zy2A:
undetectable		 3pglA-2zy2A:
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.
3aps DNAJ HOMOLOG
SUBFAMILY C MEMBER
10

(Mus musculus) 		PF00085
(Thioredoxin) 		4 PHE A 706
VAL A 746
ILE A 771
SER A 672
 None
 0.95A 3pglA-3apsA:
undetectable		 3pglA-3apsA:
22.51
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.
3b46 AMINOTRANSFERASE
BNA3

(Saccharomyces
cerevisiae) 		PF00155
(Aminotran_1_2) 		4 ASP A 345
PHE A 340
VAL A 360
TYR A 351
 None
 0.98A 3pglA-3b46A:
undetectable		 3pglA-3b46A:
17.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cdx SUCCINYLGLUTAMATEDES
UCCINYLASE/ASPARTOAC
YLASE

(Rhodobacter
sphaeroides) 		PF04952
(AstE_AspA) 		4 ASP A 109
VAL A  40
ILE A  42
SER A 106
 None
 0.94A 3pglA-3cdxA:
undetectable		 3pglA-3cdxA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fdd L-ASPARTATE-BETA-DEC
ARBOXYLASE

(Comamonas
testosteroni) 		PF00155
(Aminotran_1_2) 		4 PHE A 313
VAL A 326
ILE A 152
SER A 144
 None
 0.91A 3pglA-3fddA:
undetectable		 3pglA-3fddA:
17.31
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.
3fq4 INTEGRIN BETA-4

(Homo sapiens) 		PF03160
(Calx-beta) 		4 ASP A1030
VAL A1059
ILE A1010
TYR A1039
 None
 0.92A 3pglA-3fq4A:
undetectable		 3pglA-3fq4A:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gqk PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2) 		4 ASP A 692
VAL A 711
ILE A 718
SER A 732
 None
 0.99A 3pglA-3gqkA:
undetectable		 3pglA-3gqkA:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hja GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Borreliella
burgdorferi) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 ASP A 127
VAL A 119
ILE A 120
TYR A 107
 None
 0.93A 3pglA-3hjaA:
3.5		 3pglA-3hjaA:
19.44
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.
3hxj PYRROLO-QUINOLINE
QUINONE

(Methanococcus
maripaludis) 		PF01011
(PQQ)
PF13360
(PQQ_2)
PF13570
(PQQ_3) 		4 ASP A 116
ILE A 162
SER A 114
TYR A 120
 None
 0.93A 3pglA-3hxjA:
undetectable		 3pglA-3hxjA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hxj PYRROLO-QUINOLINE
QUINONE

(Methanococcus
maripaludis) 		PF01011
(PQQ)
PF13360
(PQQ_2)
PF13570
(PQQ_3) 		4 ASP A 234
ILE A 280
SER A 232
TYR A 238
 None
 0.83A 3pglA-3hxjA:
undetectable		 3pglA-3hxjA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		PF03598
(CdhC) 		4 ILE M 667
SER M 654
TYR M 651
ARG M 685
 None
 0.99A 3pglA-3i04M:
4.0		 3pglA-3i04M:
12.90
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.
3i3w PHOSPHOGLUCOSAMINE
MUTASE

(Francisella
tularensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 PHE A 188
VAL A 177
ILE A 236
TYR A 199
 None
 1.00A 3pglA-3i3wA:
undetectable		 3pglA-3i3wA:
18.23
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.
3iu6 PROTEIN POLYBROMO-1

(Homo sapiens) 		PF00439
(Bromodomain) 		4 PHE A 808
VAL A 797
ILE A 793
SER A 756
 None
 0.95A 3pglA-3iu6A:
undetectable		 3pglA-3iu6A:
24.21
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.
3j9o INTRACELLULAR GROWTH
LOCUS PROTEIN A
INTRACELLULAR GROWTH
LOCUS PROTEIN B

(Francisella
tularensis) 		PF05591
(T6SS_VipA)
PF05943
(VipB) 		4 ASP B 276
PHE B 271
VAL A 105
ILE A 112
 None
 0.96A 3pglA-3j9oB:
undetectable		 3pglA-3j9oB:
17.51
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.
3kh8 MAOC-LIKE
DEHYDRATASE

(Phytophthora
capsici) 		PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		4 PHE A 271
VAL A 245
ILE A 243
SER A 220
 None
 0.96A 3pglA-3kh8A:
undetectable		 3pglA-3kh8A:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kyl TELOMERASE REVERSE
TRANSCRIPTASE

(Tribolium
castaneum) 		PF00078
(RVT_1)
PF12009
(Telomerase_RBD) 		4 ASP A 325
VAL A 250
ILE A 248
TYR A 345
 None
 0.96A 3pglA-3kylA:
undetectable		 3pglA-3kylA:
14.99
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.
3lkl ANTISIGMA-FACTOR
ANTAGONIST STAS

(Rhodobacter
sphaeroides) 		PF01740
(STAS) 		4 PHE A  34
VAL A  18
ILE A  45
SER A  57
 None
 0.96A 3pglA-3lklA:
undetectable		 3pglA-3lklA:
20.21
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.
3mml ALLOPHANATE
HYDROLASE SUBUNIT 2

(Mycolicibacterium
smegmatis) 		PF02626
(CT_A_B) 		4 PHE A  90
VAL A  98
ILE A  74
SER A  64
 None
 1.00A 3pglA-3mmlA:
undetectable		 3pglA-3mmlA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n1k PROTEIN STWHY2

(Solanum
tuberosum) 		PF08536
(Whirly) 		4 PHE A  99
VAL A 185
ILE A 168
SER A  62
 None
 0.96A 3pglA-3n1kA:
undetectable		 3pglA-3n1kA:
19.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n7k BOTULINUM NEUROTOXIN
TYPE C1

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 ASP A1212
PHE A1216
VAL A1268
ILE A1201
 None
 0.95A 3pglA-3n7kA:
undetectable		 3pglA-3n7kA:
16.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oiz ANTISIGMA-FACTOR
ANTAGONIST, STAS

(Rhodobacter
sphaeroides) 		PF01740
(STAS) 		4 PHE A 424
VAL A 408
ILE A 435
SER A 447
 None
 0.96A 3pglA-3oizA:
undetectable		 3pglA-3oizA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1) 		PF01663
(Phosphodiest) 		4 ASP A 332
VAL A  44
ILE A 292
TYR A 338
 None
 1.00A 3pglA-3q3qA:
undetectable		 3pglA-3q3qA:
14.85
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.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1) 		PF01663
(Phosphodiest) 		4 ASP A 332
VAL A  44
ILE A 294
TYR A 338
 None
 1.01A 3pglA-3q3qA:
undetectable		 3pglA-3q3qA:
14.85
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.
3qtd PMBA PROTEIN

(Pseudomonas
aeruginosa) 		PF01523
(PmbA_TldD) 		4 ASP A 291
PHE A 256
VAL A 424
ILE A 421
 None
 0.93A 3pglA-3qtdA:
undetectable		 3pglA-3qtdA:
16.63
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.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE

(Entamoeba
histolytica) 		PF00145
(DNA_methylase) 		4 PHE A 129
VAL A 134
ILE A 138
SER A 102
 None
None
None
SAH  A 323 ( 4.2A)
 1.00A 3pglA-3qv2A:
2.6		 3pglA-3qv2A:
18.67
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.
3r44 FATTY ACYL COA
SYNTHETASE FADD13
(FATTY-ACYL-COA
SYNTHETASE)

(Mycobacterium
tuberculosis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 PHE A 476
VAL A 452
ILE A 457
SER A 425
 None
 0.99A 3pglA-3r44A:
undetectable		 3pglA-3r44A:
17.04
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.
3r9p ACKA

(Mycobacterium
avium) 		PF00871
(Acetate_kinase) 		4 PHE A 316
VAL A 366
ILE A 314
SER A 333
 None
 0.86A 3pglA-3r9pA:
undetectable		 3pglA-3r9pA:
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.
3rjl 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE

(Bacillus
licheniformis) 		PF00171
(Aldedh) 		4 PHE A 425
VAL A 341
ILE A 403
SER A 312
 None
 1.00A 3pglA-3rjlA:
2.6		 3pglA-3rjlA:
15.94
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.
3t6w LACCASE

(Steccherinum
ochraceum) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASP A  19
PHE A  32
ILE A 206
SER A 170
 None
 0.99A 3pglA-3t6wA:
undetectable		 3pglA-3t6wA:
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.
3tbf GLUCOSAMINE--FRUCTOS
E-6-PHOSPHATE
AMINOTRANSFERASE
[ISOMERIZING]

(Francisella
tularensis) 		PF01380
(SIS) 		4 PHE A 549
VAL A 520
ILE A 547
SER A 588
 None
 0.97A 3pglA-3tbfA:
undetectable		 3pglA-3tbfA:
20.16
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.
3u44 ATP-DEPENDENT
HELICASE/DEOXYRIBONU
CLEASE SUBUNIT B

(Bacillus
subtilis) 		PF12705
(PDDEXK_1) 		4 PHE B 363
VAL B 588
ILE B 347
TYR B 342
 None
 0.99A 3pglA-3u44B:
undetectable		 3pglA-3u44B:
10.61
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.
3uj1 THIOREDOXIN
DOMAIN-CONTAINING
PROTEIN 5

(Homo sapiens) 		PF00085
(Thioredoxin) 		4 PHE A 332
VAL A 379
ILE A 343
SER A 389
 None
 0.97A 3pglA-3uj1A:
undetectable		 3pglA-3uj1A:
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.
3v1v 2-METHYLISOBORNEOL
SYNTHASE

(Streptomyces
coelicolor) 		no annotation 4 ASP A 198
PHE A 161
VAL A 166
ILE A 142
 None
 0.96A 3pglA-3v1vA:
undetectable		 3pglA-3v1vA:
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.
3v4y NUCLEAR INHIBITOR OF
PROTEIN PHOSPHATASE
1
SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PP1-ALPHA CATALYTIC
SUBUNIT

(Homo sapiens) 		PF00149
(Metallophos)
PF16891
(STPPase_N)
no annotation 		4 ASP B 207
PHE B 203
VAL A 264
TYR A 255
 None
 0.91A 3pglA-3v4yB:
undetectable		 3pglA-3v4yB:
14.37
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.
4agv GALECTIN

(Cinachyrella) 		PF00337
(Gal-bind_lectin) 		4 PHE A  77
VAL A  90
ILE A  88
SER A  30
 None
 0.95A 3pglA-4agvA:
undetectable		 3pglA-4agvA:
22.58
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.
4ay2 PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		4 PHE A 853
VAL A 877
ILE A 875
TYR A 879
 None
 0.92A 3pglA-4ay2A:
undetectable		 3pglA-4ay2A:
13.77
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.
4bsq CATHEPSIN S

(Mus musculus) 		PF00112
(Peptidase_C1) 		4 VAL A 285
ILE A 261
SER A 336
TYR A 334
 QQV  A1341 (-4.2A)
None
None
QQV  A1341 (-3.5A)
 0.94A 3pglA-4bsqA:
undetectable		 3pglA-4bsqA:
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.
4c7q RNA-BINDING
GLYCINE-RICH PROTEIN

(Nicotiana
tabacum) 		PF00076
(RRM_1) 		4 ILE A  64
SER A  84
TYR A   6
ARG A  85
 None
 0.97A 3pglA-4c7qA:
undetectable		 3pglA-4c7qA:
18.29
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.
4dqk BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE

(Bacillus
megaterium) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		4 ASP A 983
PHE A 997
ILE A 999
TYR A 934
 None
 0.98A 3pglA-4dqkA:
2.7		 3pglA-4dqkA:
19.83
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.
4jcm CYCLODEXTRIN
GLUCANOTRANSFERASE

([Bacillus]
clarkii) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		4 PHE A 115
VAL A 129
ILE A 214
SER A  77
 None
 0.95A 3pglA-4jcmA:
undetectable		 3pglA-4jcmA:
13.39
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.
4mld RESPONSE REGULATOR

(Streptococcus
pneumoniae) 		PF00072
(Response_reg) 		4 PHE A  86
VAL A 102
ILE A  84
TYR A 100
 None
 0.93A 3pglA-4mldA:
3.2		 3pglA-4mldA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n7r GLUTAMYL-TRNA
REDUCTASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00745
(GlutR_dimer)
PF01488
(Shikimate_DH)
PF05201
(GlutR_N) 		4 PHE A 356
VAL A 345
ILE A 284
ARG A 330
 None
 1.00A 3pglA-4n7rA:
2.5		 3pglA-4n7rA:
17.47
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.
4o9d RIK1-ASSOCIATED
FACTOR 1

(Schizosaccharomyces
pombe) 		no annotation 4 PHE B 228
VAL B 572
ILE B 582
ARG B 576
 None
 0.93A 3pglA-4o9dB:
undetectable		 3pglA-4o9dB:
16.78
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.
4omj SEC14-LIKE PROTEIN 2

(Homo sapiens) 		PF00650
(CRAL_TRIO) 		4 ASP A 235
VAL A  98
ILE A 152
SER A 233
 None
 0.87A 3pglA-4omjA:
undetectable		 3pglA-4omjA:
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.
4q2w PUTATIVE
ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE

(Streptococcus
pneumoniae) 		PF01832
(Glucosaminidase) 		4 ASP A 119
VAL A 102
ILE A 100
SER A 117
 None
 0.95A 3pglA-4q2wA:
undetectable		 3pglA-4q2wA:
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.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		4 ASP A 745
VAL A 819
ILE A 812
SER A 782
 None
 0.96A 3pglA-4qmeA:
undetectable		 3pglA-4qmeA:
12.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qtb MITOGEN-ACTIVATED
PROTEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 185
VAL A 100
ILE A 182
SER A 159
TYR A 156
 None
 1.42A 3pglA-4qtbA:
undetectable		 3pglA-4qtbA:
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.
4tyh MITOGEN-ACTIVATED
PROTEIN KINASE 14

(Mus musculus) 		PF00069
(Pkinase) 		5 PHE B 169
VAL B  83
ILE B 166
SER B 143
TYR B 140
 None
 1.42A 3pglA-4tyhB:
undetectable		 3pglA-4tyhB:
20.69
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.
4wji PUTATIVE
CYCLOHEXADIENYL
DEHYDROGENASE AND
ADH PREPHENATE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF02153
(PDH) 		4 PHE A 165
VAL A  70
ILE A   8
SER A  19
 None
 0.89A 3pglA-4wjiA:
2.2		 3pglA-4wjiA:
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		4 PHE A 102
VAL A 114
ILE A 104
TYR A 157
 None
 0.90A 3pglA-4xhbA:
undetectable		 3pglA-4xhbA:
14.05
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.
4yd8 PROTEIN PTHB1

(Homo sapiens) 		PF14727
(PHTB1_N) 		4 ASP A 236
VAL A 260
ILE A 248
SER A 192
 None
 0.95A 3pglA-4yd8A:
undetectable		 3pglA-4yd8A:
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.
4ypj BETA GALACTOSIDASE

(Bacillus
circulans) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		4 PHE A 317
VAL A 229
ILE A 283
SER A 249
 None
 0.95A 3pglA-4ypjA:
undetectable		 3pglA-4ypjA:
11.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zlr BRAIN TUMOR PROTEIN

(Drosophila
melanogaster) 		PF01436
(NHL) 		4 ASP A1021
ILE A 794
SER A1019
TYR A1025
 None
 0.96A 3pglA-4zlrA:
undetectable		 3pglA-4zlrA:
19.69
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.
4zlr BRAIN TUMOR PROTEIN

(Drosophila
melanogaster) 		PF01436
(NHL) 		4 ASP A1021
PHE A 770
ILE A 794
TYR A1025
 None
 1.00A 3pglA-4zlrA:
undetectable		 3pglA-4zlrA:
19.69
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.
4zro 3C-LIKE PROTEINASE

(Alphacoronavirus
1) 		PF05409
(Peptidase_C30) 		4 PHE A 238
VAL A 203
ILE A 265
SER A 282
 None
 0.99A 3pglA-4zroA:
undetectable		 3pglA-4zroA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c3u L-SERINE
AMMONIA-LYASE

(Rhizomucor
miehei) 		PF00291
(PALP) 		4 ASP A 148
PHE A  59
ILE A 142
ARG A 134
 None
 1.00A 3pglA-5c3uA:
undetectable		 3pglA-5c3uA:
18.30
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.
5ew5 COLICIN-E9

(Escherichia
coli) 		PF03515
(Cloacin) 		4 PHE A 275
VAL A 284
ILE A 273
SER A 106
 None
 0.77A 3pglA-5ew5A:
undetectable		 3pglA-5ew5A:
14.41
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.
5guj DNA PRIMASE

(Bacillus
subtilis) 		PF08275
(Toprim_N)
PF10410
(DnaB_bind)
PF13155
(Toprim_2) 		4 VAL A 207
ILE A 160
SER A 147
TYR A 144
 None
 0.93A 3pglA-5gujA:
undetectable		 3pglA-5gujA:
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.
5h4r BETA-1,3-1,4-GLUCANA
SE

(Caldicellulosiruptor
sp. F32) 		PF00150
(Cellulase) 		4 PHE A  43
ILE A 182
SER A 234
ARG A 226
 None
 0.92A 3pglA-5h4rA:
1.8		 3pglA-5h4rA:
17.56
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.
5hkq CDII IMMUNITY
PROTEIN
CONTACT-DEPENDENT
INHIBITOR A

(Escherichia
coli) 		PF14436
(EndoU_bacteria)
no annotation 		4 ASP I  48
PHE A 209
VAL A 218
ILE A 220
 None
 0.99A 3pglA-5hkqI:
undetectable		 3pglA-5hkqI:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5id6 CPF1

(Lachnospiraceae
bacterium
ND2006) 		no annotation 4 PHE A 728
VAL A 680
ILE A 581
SER A 739
 None
 0.98A 3pglA-5id6A:
undetectable		 3pglA-5id6A:
9.27
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.
5k9t PROTEIN TRANSLOCASE
SUBUNIT SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07517
(SecA_DEAD) 		4 VAL A 239
ILE A 291
SER A 232
TYR A 236
 None
 0.97A 3pglA-5k9tA:
undetectable		 3pglA-5k9tA:
15.88
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.
5kqv INSULIN
RECEPTOR,INSULIN
RECEPTOR

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		4 ASP E 142
ILE E  95
SER E 116
TYR E  91
 None
 0.97A 3pglA-5kqvE:
undetectable		 3pglA-5kqvE:
14.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m23 WD REPEAT-CONTAINING
PROTEIN 5

(Homo sapiens) 		PF00400
(WD40) 		4 ASP A 280
ILE A 316
SER A 278
TYR A 284
 None
 0.84A 3pglA-5m23A:
undetectable		 3pglA-5m23A:
18.83
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.
5vi4 INTERLEUKIN-1
RECEPTOR-LIKE 1
INTERLEUKIN-33

(Mus musculus) 		PF13895
(Ig_2)
PF15095
(IL33) 		4 ASP A 225
PHE B 206
VAL B 177
ILE B 174
 None
 0.97A 3pglA-5vi4A:
undetectable		 3pglA-5vi4A:
23.32
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.
5xpz FERMITIN FAMILY
HOMOLOG 2

(Mus musculus) 		PF00373
(FERM_M) 		4 PHE A 609
ILE A 588
SER A 278
TYR A 590
 None
 0.97A 3pglA-5xpzA:
undetectable		 3pglA-5xpzA:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6byn WD REPEAT-CONTAINING
PROTEIN 5

(Homo sapiens) 		no annotation 4 ASP W 280
ILE W 316
SER W 278
TYR W 284
 None
 0.87A 3pglA-6bynW:
undetectable		 3pglA-6bynW:
21.26
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.
6c93 CYTOCHROME P450 4B1

(Oryctolagus
cuniculus) 		no annotation 4 PHE A 388
VAL A  98
ILE A  89
SER A 398
 None
 0.96A 3pglA-6c93A:
undetectable		 3pglA-6c93A:
15.00
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.
6es9 ACYL-COA
DEHYDROGENASE

(Paracoccus
denitrificans) 		no annotation 4 VAL A  69
ILE A 107
SER A  28
ARG A  32
 None
None
SO4  A 602 (-2.9A)
None
 0.93A 3pglA-6es9A:
undetectable		 3pglA-6es9A:
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.
6gh2 LAMINARIBIOSE
PHOSPHORYLASE

(Paenibacillus
sp. YM1) 		no annotation 4 ASP A 523
VAL A 660
SER A 537
TYR A 652
 None
 0.91A 3pglA-6gh2A:
undetectable		 3pglA-6gh2A:
12.64
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.
6h20 -

(-) 		no annotation 4 ASP A 250
SER A 164
TYR A 276
ARG A 169
 ASN  A 401 (-2.9A)
ASN  A 401 (-2.9A)
ASN  A 401 ( 4.9A)
ASN  A 401 (-2.9A)
 0.99A 3pglA-6h20A:
undetectable		 3pglA-6h20A:
undetectable