SIMILAR PATTERNS OF AMINO ACIDS FOR 3ASO_J_CHDJ60

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.
1flo FLP RECOMBINASE

(Saccharomyces
cerevisiae) 		PF03930
(Flp_N)
PF05202
(Flp_C) 		4 ARG A 308
MET A 311
THR A 312
LEU A 315
 None
 0.82A 3asoA-1floA:
undetectable
3asoJ-1floA:
0.0		 3asoA-1floA:
21.78
3asoJ-1floA:
9.80
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.
1har HIV-1 REVERSE
TRANSCRIPTASE
(FINGERS AND PALM
SUBDOMAINS)

(Human
immunodeficiency
virus 1) 		PF00078
(RVT_1) 		4 LEU A 109
MET A 164
THR A 165
LEU A 168
 None
 0.72A 3asoA-1harA:
undetectable
3asoJ-1harA:
0.1		 3asoA-1harA:
18.00
3asoJ-1harA:
13.37
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.
1hom ANTENNAPEDIA PROTEIN

(Drosophila
melanogaster) 		PF00046
(Homeobox) 		4 LEU A  38
ARG A  29
THR A  27
LEU A  26
 None
 0.99A 3asoA-1homA:
undetectable
3asoJ-1homA:
0.1		 3asoA-1homA:
8.24
3asoJ-1homA:
16.42
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.
1jed SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 LEU A  49
ARG A  40
THR A  38
LEU A  37
 None
 0.84A 3asoA-1jedA:
0.0
3asoJ-1jedA:
undetectable		 3asoA-1jedA:
21.17
3asoJ-1jedA:
8.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ksp PROTEIN (DNA
POLYMERASE I-KLENOW
FRAGMENT
(E.C.2.7.7.7))

(Escherichia
coli) 		PF00476
(DNA_pol_A)
PF01612
(DNA_pol_A_exo1) 		4 LEU A 676
ARG A 688
THR A 641
LEU A 644
 None
 0.99A 3asoA-1kspA:
0.0
3asoJ-1kspA:
0.0		 3asoA-1kspA:
21.86
3asoJ-1kspA:
7.68
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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1

(Paracoccus
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		4 ARG A 383
MET A 416
THR A 437
LEU A 436
 None
 0.80A 3asoA-1lrwA:
undetectable
3asoJ-1lrwA:
undetectable		 3asoA-1lrwA:
21.34
3asoJ-1lrwA:
6.95
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.
1r6x ATP:SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 LEU A  49
ARG A  40
THR A  38
LEU A  37
 None
 0.84A 3asoA-1r6xA:
0.0
3asoJ-1r6xA:
undetectable		 3asoA-1r6xA:
21.48
3asoJ-1r6xA:
11.44
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.
1sr4 CYTOLETHAL
DISTENDING TOXIN
SUBUNIT A

([Haemophilus]
ducreyi) 		PF03498
(CDtoxinA) 		4 LEU A 145
ARG A 114
THR A  79
LEU A  80
 None
 0.99A 3asoA-1sr4A:
undetectable
3asoJ-1sr4A:
undetectable		 3asoA-1sr4A:
18.06
3asoJ-1sr4A:
11.44
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.
1sxj ACTIVATOR 1 40 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF13177
(DNA_pol3_delta2) 		4 LEU E  40
MET E 158
THR E 157
LEU E 154
 None
 0.98A 3asoA-1sxjE:
0.0
3asoJ-1sxjE:
0.0		 3asoA-1sxjE:
19.27
3asoJ-1sxjE:
9.54
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.
1uso HEPATOCYTE NUCLEAR
FACTOR 1-ALPHA

(Thermus
thermophilus) 		PF01329
(Pterin_4a) 		4 LEU A  77
ARG A  50
THR A  45
LEU A  44
 None
 1.05A 3asoA-1usoA:
undetectable
3asoJ-1usoA:
undetectable		 3asoA-1usoA:
8.56
3asoJ-1usoA:
22.50
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.
1vcz RNASE NGR3

(Nicotiana
glutinosa) 		PF00445
(Ribonuclease_T2) 		4 ARG A 116
MET A  72
THR A  71
LEU A  68
 None
 1.03A 3asoA-1vczA:
undetectable
3asoJ-1vczA:
undetectable		 3asoA-1vczA:
16.25
3asoJ-1vczA:
15.54
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.
2b9b FUSION GLYCOPROTEIN
F0

(Mammalian
rubulavirus 5) 		PF00523
(Fusion_gly) 		4 LEU A 227
TYR A  72
THR A  77
LEU A  80
 None
 0.70A 3asoA-2b9bA:
0.7
3asoJ-2b9bA:
2.8		 3asoA-2b9bA:
21.63
3asoJ-2b9bA:
9.53
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.
2bap DIAPHANOUS PROTEIN
HOMOLOG 1

(Mus musculus) 		no annotation 4 LEU B 234
MET B 225
THR B 224
LEU B 179
 None
 1.02A 3asoA-2bapB:
0.0
3asoJ-2bapB:
undetectable		 3asoA-2bapB:
19.02
3asoJ-2bapB:
10.93
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.
2bnx DIAPHANOUS PROTEIN
HOMOLOG 1

(Mus musculus) 		PF06367
(Drf_FH3)
PF06371
(Drf_GBD) 		4 LEU A 234
MET A 225
THR A 224
LEU A 179
 None
 1.06A 3asoA-2bnxA:
undetectable
3asoJ-2bnxA:
undetectable		 3asoA-2bnxA:
20.88
3asoJ-2bnxA:
8.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bx7 DIHYDROOROTATE
DEHYDROGENASE

(Lactococcus
lactis) 		PF01180
(DHO_dh) 		4 LEU A 128
TYR A 168
MET A 177
LEU A 181
 None
 0.99A 3asoA-2bx7A:
0.0
3asoJ-2bx7A:
undetectable		 3asoA-2bx7A:
19.78
3asoJ-2bx7A:
10.93
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.
2c6w PENICILLIN-BINDING
PROTEIN 1A

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		4 TYR B 618
ARG B 619
MET B 622
THR B 623
 None
 0.95A 3asoA-2c6wB:
undetectable
3asoJ-2c6wB:
undetectable		 3asoA-2c6wB:
21.23
3asoJ-2c6wB:
8.29
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.
2f31 DIAPHANOUS PROTEIN
HOMOLOG 1

(Mus musculus) 		PF06367
(Drf_FH3)
PF06371
(Drf_GBD) 		4 LEU A 234
MET A 225
THR A 224
LEU A 179
 None
 1.04A 3asoA-2f31A:
undetectable
3asoJ-2f31A:
undetectable		 3asoA-2f31A:
17.22
3asoJ-2f31A:
12.45
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.
2fe8 REPLICASE
POLYPROTEIN 1AB

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF08715
(Viral_protease) 		4 ARG A 167
MET A 170
THR A 171
LEU A 174
 None
 0.71A 3asoA-2fe8A:
undetectable
3asoJ-2fe8A:
undetectable		 3asoA-2fe8A:
19.88
3asoJ-2fe8A:
10.79
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.
2hnz REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H

(Human
immunodeficiency
virus 1) 		PF00075
(RNase_H)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		4 LEU A 109
MET A 164
THR A 165
LEU A 168
 None
 0.77A 3asoA-2hnzA:
undetectable
3asoJ-2hnzA:
undetectable		 3asoA-2hnzA:
19.77
3asoJ-2hnzA:
6.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jjy ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE

(Francisella
tularensis) 		PF13561
(adh_short_C2) 		4 LEU A  73
ARG A 131
MET A 133
LEU A  84
 None
 1.07A 3asoA-2jjyA:
undetectable
3asoJ-2jjyA:
undetectable		 3asoA-2jjyA:
19.53
3asoJ-2jjyA:
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.
2la7 UNCHARACTERIZED
PROTEIN

(Paraburkholderia
xenovorans) 		PF03724
(META) 		4 LEU A 112
ARG A 117
THR A 137
LEU A 138
 None
 0.75A 3asoA-2la7A:
undetectable
3asoJ-2la7A:
undetectable		 3asoA-2la7A:
14.14
3asoJ-2la7A:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		4 LEU A 426
TYR A 592
THR A 579
LEU A 582
 None
 1.04A 3asoA-2pziA:
0.2
3asoJ-2pziA:
undetectable		 3asoA-2pziA:
21.85
3asoJ-2pziA:
6.88
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 LEU A 131
ARG A 184
MET A 189
LEU A 191
 None
 1.04A 3asoA-2qo3A:
undetectable
3asoJ-2qo3A:
undetectable		 3asoA-2qo3A:
20.35
3asoJ-2qo3A:
4.15
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.
2rcb GLUTAMATE [NMDA]
RECEPTOR SUBUNIT 3B

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 LEU A  74
TYR A 271
ARG A 270
LEU A 264
 None
 1.04A 3asoA-2rcbA:
undetectable
3asoJ-2rcbA:
undetectable		 3asoA-2rcbA:
21.58
3asoJ-2rcbA:
11.64
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.
2uw1 PLASTID DELTA4
MULTIFUNCTIONAL
ACYL-ACYL CARRIER
PROTEIN DESATURASE

(Hedera helix) 		PF03405
(FA_desaturase_2) 		4 LEU B 272
MET B 346
THR B 345
LEU B 358
 None
 1.00A 3asoA-2uw1B:
1.0
3asoJ-2uw1B:
undetectable		 3asoA-2uw1B:
20.56
3asoJ-2uw1B:
12.50
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.
2wok CLAVULANIC ACID
BIOSYNTHESIS
OLIGOPEPTIDE BINDING
PROTEIN 2

(Streptomyces
clavuligerus) 		PF00496
(SBP_bac_5) 		4 LEU A 186
TYR A 101
THR A  98
LEU A 176
 None
 1.01A 3asoA-2wokA:
3.3
3asoJ-2wokA:
undetectable		 3asoA-2wokA:
21.99
3asoJ-2wokA:
7.55
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.
2wxz ANGIOTENSINOGEN

(Rattus
norvegicus) 		PF00079
(Serpin) 		4 LEU A 309
ARG A 345
THR A 423
LEU A 424
 None
 1.06A 3asoA-2wxzA:
undetectable
3asoJ-2wxzA:
undetectable		 3asoA-2wxzA:
22.32
3asoJ-2wxzA:
7.64
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.
2wy0 ANGIOTENSINOGEN

(Mus musculus) 		PF00079
(Serpin) 		4 LEU C 309
ARG C 345
THR C 423
LEU C 424
 None
 0.81A 3asoA-2wy0C:
undetectable
3asoJ-2wy0C:
undetectable		 3asoA-2wy0C:
21.21
3asoJ-2wy0C:
8.76
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.
2y69 CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1

(Bos taurus) 		PF02238
(COX7a) 		5 TYR J  32
ARG J  33
MET J  36
THR J  37
LEU J  40
 None
 0.34A 3asoA-2y69J:
undetectable
3asoJ-2y69J:
7.9		 3asoA-2y69J:
10.31
3asoJ-2y69J:
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.
2ybq METHYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00590
(TP_methylase) 		4 LEU A  61
ARG A  36
THR A  34
LEU A  33
 None
 1.08A 3asoA-2ybqA:
undetectable
3asoJ-2ybqA:
undetectable		 3asoA-2ybqA:
21.48
3asoJ-2ybqA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z7x TOLL-LIKE RECEPTOR
1, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 LEU B 428
ARG B 441
THR B 436
LEU B 435
 None
 0.98A 3asoA-2z7xB:
undetectable
3asoJ-2z7xB:
undetectable		 3asoA-2z7xB:
23.01
3asoJ-2z7xB:
8.05
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.
2ziu MUS81 PROTEIN

(Danio rerio) 		PF02732
(ERCC4) 		4 TYR A 471
MET A 475
THR A 476
LEU A 479
 None
 0.77A 3asoA-2ziuA:
undetectable
3asoJ-2ziuA:
undetectable		 3asoA-2ziuA:
18.55
3asoJ-2ziuA:
10.29
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.
3a79 TOLL-LIKE RECEPTOR
6, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Mus musculus) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 LEU B 433
ARG B 446
THR B 441
LEU B 440
 None
 1.05A 3asoA-3a79B:
undetectable
3asoJ-3a79B:
undetectable		 3asoA-3a79B:
20.37
3asoJ-3a79B:
7.20
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.
3brc CONSERVED PROTEIN OF
UNKNOWN FUNCTION

(Methanothermobacter
thermautotrophicus) 		PF11576
(DUF3236) 		4 LEU A  96
MET A 145
THR A 146
LEU A 149
 None
 1.03A 3asoA-3brcA:
undetectable
3asoJ-3brcA:
undetectable		 3asoA-3brcA:
15.00
3asoJ-3brcA:
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.
3eg5 PROTEIN DIAPHANOUS
HOMOLOG 1

(Mus musculus) 		PF06367
(Drf_FH3)
PF06371
(Drf_GBD) 		4 LEU B 234
MET B 225
THR B 224
LEU B 179
 None
 1.03A 3asoA-3eg5B:
undetectable
3asoJ-3eg5B:
undetectable		 3asoA-3eg5B:
19.00
3asoJ-3eg5B:
11.71
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.
3hi8 PROLIFERATING CELL
NUCLEAR ANTIGEN PCNA

(Haloferax
volcanii) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		4 LEU A  15
ARG A  37
THR A  50
LEU A  51
 None
 0.83A 3asoA-3hi8A:
undetectable
3asoJ-3hi8A:
undetectable		 3asoA-3hi8A:
20.53
3asoJ-3hi8A:
20.59
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.
3ig2 PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Bacteroides
fragilis) 		no annotation 4 TYR A 593
MET A 561
THR A 531
LEU A 530
 None
 1.08A 3asoA-3ig2A:
undetectable
3asoJ-3ig2A:
undetectable		 3asoA-3ig2A:
19.33
3asoJ-3ig2A:
16.23
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.
3jbz SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom) 		4 LEU A2246
ARG A2317
THR A2321
LEU A2324
 None
 1.01A 3asoA-3jbzA:
undetectable
3asoJ-3jbzA:
undetectable		 3asoA-3jbzA:
17.21
3asoJ-3jbzA:
4.40
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		4 ARG A 407
MET A 410
THR A 411
LEU A 414
 None
 0.79A 3asoA-3k13A:
undetectable
3asoJ-3k13A:
undetectable		 3asoA-3k13A:
20.20
3asoJ-3k13A:
11.46
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.
3mt1 PUTATIVE
CARBOXYNORSPERMIDINE
DECARBOXYLASE
PROTEIN

(Sinorhizobium
meliloti) 		PF00278
(Orn_DAP_Arg_deC) 		4 LEU A  34
ARG A  20
MET A  18
LEU A  14
 None
 0.95A 3asoA-3mt1A:
undetectable
3asoJ-3mt1A:
undetectable		 3asoA-3mt1A:
21.20
3asoJ-3mt1A:
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.
3nmz APC VARIANT PROTEIN

(Homo sapiens) 		PF00514
(Arm) 		4 LEU A 572
ARG A 527
THR A 562
LEU A 563
 None
 1.01A 3asoA-3nmzA:
2.9
3asoJ-3nmzA:
undetectable		 3asoA-3nmzA:
21.23
3asoJ-3nmzA:
9.01
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.
3ozx RNASE L INHIBITOR

(Sulfolobus
solfataricus) 		PF00005
(ABC_tran) 		4 LEU A 549
ARG A 565
THR A 563
LEU A 557
 None
 1.07A 3asoA-3ozxA:
undetectable
3asoJ-3ozxA:
undetectable		 3asoA-3ozxA:
18.83
3asoJ-3ozxA:
6.64
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.
3p8c NCK-ASSOCIATED
PROTEIN 1

(Homo sapiens) 		PF09735
(Nckap1) 		4 LEU B 682
ARG B 705
THR B 709
LEU B 712
 None
 0.97A 3asoA-3p8cB:
1.3
3asoJ-3p8cB:
undetectable		 3asoA-3p8cB:
18.35
3asoJ-3p8cB:
4.26
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.
3pja TRANSLIN

(Homo sapiens) 		PF01997
(Translin) 		4 LEU A 101
ARG A 116
THR A 120
LEU A 123
 None
 1.00A 3asoA-3pjaA:
undetectable
3asoJ-3pjaA:
undetectable		 3asoA-3pjaA:
16.09
3asoJ-3pjaA:
15.35
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.
3qp9 TYPE I POLYKETIDE
SYNTHASE PIKAII

(Streptomyces
venezuelae) 		PF08659
(KR) 		4 ARG A 181
MET A 187
THR A 188
LEU A 191
 None
 1.01A 3asoA-3qp9A:
undetectable
3asoJ-3qp9A:
undetectable		 3asoA-3qp9A:
22.76
3asoJ-3qp9A:
7.05
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.
3se7 VANA

(-) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		4 TYR A 315
MET A 319
THR A 320
LEU A 324
 None
 0.93A 3asoA-3se7A:
undetectable
3asoJ-3se7A:
undetectable		 3asoA-3se7A:
21.97
3asoJ-3se7A:
10.15
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.
3sqi KLLA0E03807P

(Kluyveromyces
lactis) 		PF16787
(NDC10_II) 		4 LEU A 164
TYR A 206
MET A 202
THR A 201
 None
 1.07A 3asoA-3sqiA:
undetectable
3asoJ-3sqiA:
undetectable		 3asoA-3sqiA:
19.72
3asoJ-3sqiA:
9.60
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.
3sto SERINE PROTEASE
INHIBITOR

(Schistosoma
haematobium) 		PF00079
(Serpin) 		4 LEU A  47
MET A 392
THR A 391
LEU A 390
 None
 0.97A 3asoA-3stoA:
undetectable
3asoJ-3stoA:
undetectable		 3asoA-3stoA:
20.56
3asoJ-3stoA:
9.14
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.
3wa8 CRISPR-ASSOCIATED
PROTEIN, CSE2 FAMILY

(Meiothermus
ruber) 		PF09485
(CRISPR_Cse2) 		4 LEU A  68
ARG A 164
THR A 105
LEU A 106
 None
 0.70A 3asoA-3wa8A:
undetectable
3asoJ-3wa8A:
undetectable		 3asoA-3wa8A:
13.36
3asoJ-3wa8A:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zqj UVRABC SYSTEM
PROTEIN A

(Mycobacterium
tuberculosis) 		PF00005
(ABC_tran) 		4 LEU A 676
ARG A 688
THR A 628
LEU A 627
 None
 0.76A 3asoA-3zqjA:
undetectable
3asoJ-3zqjA:
undetectable		 3asoA-3zqjA:
18.59
3asoJ-3zqjA:
4.95
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.
3zxs CRYPTOCHROME B

(Rhodobacter
sphaeroides) 		PF04244
(DPRP) 		5 LEU A 455
TYR A 439
ARG A 343
MET A 344
LEU A 347
 None
None
None
SF4  A1510 (-4.5A)
None
 1.38A 3asoA-3zxsA:
undetectable
3asoJ-3zxsA:
undetectable		 3asoA-3zxsA:
22.32
3asoJ-3zxsA:
8.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f9l 20.1 ANTI-BTN3A1
ANTIBODY FRAGMENT

(Mus musculus) 		no annotation 4 LEU D 142
ARG D 171
THR D 218
LEU D 217
 None
 0.93A 3asoA-4f9lD:
undetectable
3asoJ-4f9lD:
undetectable		 3asoA-4f9lD:
18.81
3asoJ-4f9lD:
11.67
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.
4g6q PUTATIVE
UNCHARACTERIZED
PROTEIN

(Kribbella
flavida) 		PF12840
(HTH_20) 		4 LEU A  82
ARG A  78
THR A  36
LEU A  39
 None
 1.04A 3asoA-4g6qA:
undetectable
3asoJ-4g6qA:
undetectable		 3asoA-4g6qA:
16.97
3asoJ-4g6qA:
13.66
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.
4i9a QUINOLINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Sus scrofa) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		4 LEU A 256
MET A 271
THR A 273
LEU A 272
 None
 1.04A 3asoA-4i9aA:
undetectable
3asoJ-4i9aA:
undetectable		 3asoA-4i9aA:
20.95
3asoJ-4i9aA:
11.19
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.
4ifq NUCLEOPORIN NUP192

(Saccharomyces
cerevisiae) 		PF11894
(Nup192) 		4 LEU A 675
ARG A 693
THR A 697
LEU A 700
 None
 0.93A 3asoA-4ifqA:
undetectable
3asoJ-4ifqA:
undetectable		 3asoA-4ifqA:
17.79
3asoJ-4ifqA:
4.68
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.
4io1 RIBOSE-5-PHOSPHATE
ISOMERASE A

(Francisella
tularensis) 		PF06026
(Rib_5-P_isom_A) 		4 LEU A  41
ARG A 108
THR A  63
LEU A  66
 None
 1.05A 3asoA-4io1A:
undetectable
3asoJ-4io1A:
undetectable		 3asoA-4io1A:
18.13
3asoJ-4io1A:
13.90
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.
4k3b OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

(Neisseria
gonorrhoeae) 		PF01103
(Bac_surface_Ag)
PF07244
(POTRA) 		4 TYR A 296
MET A 301
THR A 302
LEU A 305
 None
 0.96A 3asoA-4k3bA:
undetectable
3asoJ-4k3bA:
undetectable		 3asoA-4k3bA:
19.36
3asoJ-4k3bA:
5.95
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.
4kem MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azospirillum
lipoferum) 		PF13378
(MR_MLE_C) 		4 LEU A 275
ARG A 303
MET A 307
LEU A 308
 None
 0.92A 3asoA-4kemA:
undetectable
3asoJ-4kemA:
undetectable		 3asoA-4kemA:
21.75
3asoJ-4kemA:
9.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l3f INTERNALIN K

(Listeria
monocytogenes) 		no annotation 4 LEU A 152
MET A 193
THR A 192
LEU A 190
 None
 1.06A 3asoA-4l3fA:
undetectable
3asoJ-4l3fA:
undetectable		 3asoA-4l3fA:
21.78
3asoJ-4l3fA:
11.24
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.
4mk0 BETA-ADRENERGIC
RECEPTOR KINASE 1

(Homo sapiens) 		PF00069
(Pkinase)
PF00169
(PH)
PF00615
(RGS) 		4 LEU A 583
ARG A 579
MET A 565
LEU A 632
 None
 0.95A 3asoA-4mk0A:
2.4
3asoJ-4mk0A:
undetectable		 3asoA-4mk0A:
20.70
3asoJ-4mk0A:
7.95
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.
4mni TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT

(Polaromonas sp.
JS666) 		PF03480
(DctP) 		4 LEU A  63
MET A 237
THR A 236
LEU A 140
 None
 1.07A 3asoA-4mniA:
undetectable
3asoJ-4mniA:
undetectable		 3asoA-4mniA:
20.38
3asoJ-4mniA:
10.15
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.
4mt6 RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 9

(Rattus
norvegicus) 		PF00018
(SH3_1)
PF00169
(PH)
PF00621
(RhoGEF) 		4 LEU A 209
TYR A 204
THR A 248
LEU A 247
 None
 1.01A 3asoA-4mt6A:
1.5
3asoJ-4mt6A:
undetectable		 3asoA-4mt6A:
20.44
3asoJ-4mt6A:
12.26
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.
4nz0 GENOME POLYPROTEIN

(Cardiovirus A) 		PF00680
(RdRP_1) 		4 LEU A 329
ARG A 230
THR A 373
LEU A 374
 None
 0.99A 3asoA-4nz0A:
undetectable
3asoJ-4nz0A:
undetectable		 3asoA-4nz0A:
22.41
3asoJ-4nz0A:
9.49
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.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS

(Homo sapiens) 		PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 LEU A1119
MET A 820
THR A 819
LEU A 818
 None
 0.94A 3asoA-4pj3A:
undetectable
3asoJ-4pj3A:
undetectable		 3asoA-4pj3A:
15.67
3asoJ-4pj3A:
6.22
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.
4rq9 PHOTORECEPTOR-HISTID
INE KINASE BPHP

(Stigmatella
aurantiaca) 		PF01590
(GAF)
PF08446
(PAS_2) 		4 LEU A 123
ARG A 118
THR A  46
LEU A  45
 None
 0.94A 3asoA-4rq9A:
undetectable
3asoJ-4rq9A:
undetectable		 3asoA-4rq9A:
18.92
3asoJ-4rq9A:
10.32
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.
4rwe SUGAR-BINDING
TRANSPORT PROTEIN

(Yersinia pestis) 		PF13407
(Peripla_BP_4) 		4 LEU A 259
MET A 201
THR A 202
LEU A 205
 None
 1.08A 3asoA-4rweA:
undetectable
3asoJ-4rweA:
undetectable		 3asoA-4rweA:
20.54
3asoJ-4rweA:
11.78
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.
4rwt LEIOMODIN-2

(Homo sapiens) 		no annotation 4 ARG C 309
MET C 312
THR C 313
LEU C 316
 None
 1.02A 3asoA-4rwtC:
undetectable
3asoJ-4rwtC:
undetectable		 3asoA-4rwtC:
19.44
3asoJ-4rwtC:
9.30
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.
4wsb POLYMERASE PB2

(Influenza A
virus) 		PF00604
(Flu_PB2) 		4 LEU C 207
ARG C 157
THR C 155
LEU C 154
 None
 0.79A 3asoA-4wsbC:
2.1
3asoJ-4wsbC:
undetectable		 3asoA-4wsbC:
22.62
3asoJ-4wsbC:
5.53
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.
4yb9 SOLUTE CARRIER
FAMILY 2,
FACILITATED GLUCOSE
TRANSPORTER MEMBER 5

(Bos taurus) 		PF00083
(Sugar_tr) 		4 TYR D 149
ARG D  98
THR D 101
LEU D 103
 None
 0.99A 3asoA-4yb9D:
undetectable
3asoJ-4yb9D:
undetectable		 3asoA-4yb9D:
24.01
3asoJ-4yb9D:
7.33
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.
4yk6 ADENOMATOUS
POLYPOSIS COLI
PROTEIN

(Homo sapiens) 		PF00514
(Arm)
PF16629
(Arm_APC_u3) 		4 LEU A 572
ARG A 527
THR A 562
LEU A 563
 None
 0.93A 3asoA-4yk6A:
2.1
3asoJ-4yk6A:
undetectable		 3asoA-4yk6A:
18.86
3asoJ-4yk6A:
13.62
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.
5cdi CHAPERONIN 60B1

(Chlamydomonas
reinhardtii) 		PF00118
(Cpn60_TCP1) 		4 LEU A 395
ARG A 405
MET A 178
THR A 177
 None
 0.99A 3asoA-5cdiA:
undetectable
3asoJ-5cdiA:
undetectable		 3asoA-5cdiA:
21.33
3asoJ-5cdiA:
7.83
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.
5cxw PENICILLIN-BINDING
PROTEIN 1A

(Mycobacterium
tuberculosis) 		PF00905
(Transpeptidase) 		4 LEU A 356
ARG A 505
THR A 468
LEU A 469
 None
 0.92A 3asoA-5cxwA:
undetectable
3asoJ-5cxwA:
undetectable		 3asoA-5cxwA:
23.22
3asoJ-5cxwA:
9.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dm6 50S RIBOSOMAL
PROTEIN L6

(Deinococcus
radiodurans) 		PF00347
(Ribosomal_L6) 		4 LEU E  87
ARG E  95
MET E 105
LEU E 103
 None
 1.07A 3asoA-5dm6E:
undetectable
3asoJ-5dm6E:
undetectable		 3asoA-5dm6E:
14.81
3asoJ-5dm6E:
15.79
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.
5e7p CELL DIVISION
CONTROL PROTEIN
CDC48

(Mycolicibacterium
smegmatis) 		PF00004
(AAA)
PF02359
(CDC48_N) 		4 LEU A 430
ARG A  37
THR A 464
LEU A 463
 None
 1.01A 3asoA-5e7pA:
undetectable
3asoJ-5e7pA:
undetectable		 3asoA-5e7pA:
22.32
3asoJ-5e7pA:
4.99
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.
5ezr CGMP-DEPENDENT
PROTEIN KINASE,
PUTATIVE

(Plasmodium
vivax) 		PF00027
(cNMP_binding)
PF00069
(Pkinase) 		4 ARG A 276
MET A 279
THR A 280
LEU A 283
 None
 0.99A 3asoA-5ezrA:
3.0
3asoJ-5ezrA:
undetectable		 3asoA-5ezrA:
20.35
3asoJ-5ezrA:
6.28
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.
5gnc AVH146

(Phytophthora
sojae) 		no annotation 4 TYR A 232
MET A 228
THR A 227
LEU A 224
 None
 0.93A 3asoA-5gncA:
2.1
3asoJ-5gncA:
undetectable		 3asoA-5gncA:
21.10
3asoJ-5gncA:
7.63
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.
5h2t TREHALOSE SYNTHASE

(Thermomonospora
curvata) 		no annotation 4 LEU A 203
TYR A 190
THR A 236
LEU A 240
 None
 1.06A 3asoA-5h2tA:
undetectable
3asoJ-5h2tA:
undetectable		 3asoA-5h2tA:
20.56
3asoJ-5h2tA:
6.44
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.
5hy7 PUTATIVE PRE-MRNA
SPLICING PROTEIN

(Chaetomium
thermophilum) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		4 LEU A 609
ARG A 620
THR A 643
LEU A 644
 None
 0.97A 3asoA-5hy7A:
undetectable
3asoJ-5hy7A:
undetectable		 3asoA-5hy7A:
18.40
3asoJ-5hy7A:
4.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iig VACUOLAR TRANSPORTER
CHAPERONE 4

(Saccharomyces
cerevisiae) 		PF03105
(SPX)
PF09359
(VTC) 		4 ARG A 356
MET A 382
THR A 381
LEU A 380
 None
 0.95A 3asoA-5iigA:
2.3
3asoJ-5iigA:
undetectable		 3asoA-5iigA:
20.84
3asoJ-5iigA:
9.17
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.
5k9t PROTEIN TRANSLOCASE
SUBUNIT SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07517
(SecA_DEAD) 		4 LEU A 286
ARG A 277
THR A 275
LEU A 274
 None
 0.88A 3asoA-5k9tA:
undetectable
3asoJ-5k9tA:
undetectable		 3asoA-5k9tA:
21.11
3asoJ-5k9tA:
7.95
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.
5kdx METALLOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF13402
(Peptidase_M60) 		4 LEU A 829
TYR A 887
THR A 861
LEU A 860
 None
 0.95A 3asoA-5kdxA:
undetectable
3asoJ-5kdxA:
undetectable		 3asoA-5kdxA:
20.04
3asoJ-5kdxA:
6.03
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Mus musculus) 		PF06090
(Ins_P5_2-kin) 		5 LEU A 452
TYR A 392
ARG A 393
MET A 396
THR A 397
 5MY  A 502 (-4.6A)
None
None
None
None
 1.19A 3asoA-5mwlA:
undetectable
3asoJ-5mwlA:
undetectable		 3asoA-5mwlA:
19.60
3asoJ-5mwlA:
8.96
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.
5nm7 PEPTIDOGLYCAN-BINDIN
G DOMAIN 1

(Burkholderia) 		no annotation 4 TYR G 117
ARG G 119
MET G 122
LEU G 126
 None
 0.80A 3asoA-5nm7G:
undetectable
3asoJ-5nm7G:
undetectable		 3asoA-5nm7G:
undetectable
3asoJ-5nm7G:
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.
5nqd ARSENITE OXIDASE
LARGE SUBUNIT AIOA
[3FE-4S] CLUSTER,
MO-MOLYBDOPTERIN
COFACTOR-BINDING
ACTIVE SITE

(Rhizobium sp.
NT-26) 		no annotation 4 LEU A 163
ARG A 149
MET A 604
LEU A 600
 None
 0.97A 3asoA-5nqdA:
undetectable
3asoJ-5nqdA:
undetectable		 3asoA-5nqdA:
undetectable
3asoJ-5nqdA:
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.
5nqd ARSENITE OXIDASE
LARGE SUBUNIT AIOA
[3FE-4S] CLUSTER,
MO-MOLYBDOPTERIN
COFACTOR-BINDING
ACTIVE SITE

(Rhizobium sp.
NT-26) 		no annotation 4 LEU A 163
MET A 604
THR A 603
LEU A 600
 None
 0.95A 3asoA-5nqdA:
undetectable
3asoJ-5nqdA:
undetectable		 3asoA-5nqdA:
undetectable
3asoJ-5nqdA:
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.
5tiw SULFOTRANSFERASE

(Schistosoma
haematobium) 		no annotation 4 LEU A  92
ARG A  82
MET A 113
THR A 112
 None
 1.05A 3asoA-5tiwA:
undetectable
3asoJ-5tiwA:
undetectable		 3asoA-5tiwA:
16.34
3asoJ-5tiwA:
12.65
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.
5uc2 DOMAIN OF UNKNOWN
FUNCTION DUF1849

(Brucella
abortus) 		PF08904
(DUF1849) 		5 TYR A 235
ARG A 236
MET A 252
THR A 251
LEU A 250
 None
 1.37A 3asoA-5uc2A:
undetectable
3asoJ-5uc2A:
undetectable		 3asoA-5uc2A:
18.71
3asoJ-5uc2A:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uhe DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA'

(Mycobacterium
tuberculosis) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 LEU D1034
ARG D1159
MET D1161
LEU D1207
 None
 1.03A 3asoA-5uheD:
3.7
3asoJ-5uheD:
1.2		 3asoA-5uheD:
17.15
3asoJ-5uheD:
6.64
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.
5v6b PDZ
DOMAIN-CONTAINING
PROTEIN GIPC1

(Mus musculus) 		PF00595
(PDZ) 		4 ARG A 307
MET A 287
THR A 286
LEU A 283
 None
 1.08A 3asoA-5v6bA:
undetectable
3asoJ-5v6bA:
undetectable		 3asoA-5v6bA:
17.68
3asoJ-5v6bA:
14.88
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.
5wug BETA-GLUCOSIDASE

(Paenibacillus
barengoltzii) 		no annotation 4 LEU A 243
TYR A  76
ARG A  78
LEU A 591
 None
 0.96A 3asoA-5wugA:
undetectable
3asoJ-5wugA:
undetectable		 3asoA-5wugA:
undetectable
3asoJ-5wugA:
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.
5wyp DNA POLYMERASE III
SUBUNIT BETA

(Caulobacter
vibrioides) 		no annotation 4 LEU A 289
ARG A 345
THR A 263
LEU A 264
 None
 1.08A 3asoA-5wypA:
undetectable
3asoJ-5wypA:
undetectable		 3asoA-5wypA:
undetectable
3asoJ-5wypA:
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.
5x41 COBALT TRANSPORT
PROTEIN CBIM

(Rhodobacter
capsulatus) 		no annotation 4 LEU M 176
TYR M 153
THR M 155
LEU M 158
 None
 0.85A 3asoA-5x41M:
undetectable
3asoJ-5x41M:
undetectable		 3asoA-5x41M:
19.61
3asoJ-5x41M:
13.49
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.
5xfa NAD-REDUCING
HYDROGENASE

(Hydrogenophilus
thermoluteolus) 		PF01257
(2Fe-2S_thioredx)
PF01512
(Complex1_51K)
PF10589
(NADH_4Fe-4S) 		4 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.97A 3asoA-5xfaA:
undetectable
3asoJ-5xfaA:
undetectable		 3asoA-5xfaA:
22.80
3asoJ-5xfaA:
6.90
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.
5xk8 UNDECAPRENYL
DIPHOSPHATE SYNTHASE

(Streptomyces
sp. CNH189) 		no annotation 4 TYR A  26
MET A  29
THR A  30
LEU A  33
 None
 1.02A 3asoA-5xk8A:
undetectable
3asoJ-5xk8A:
undetectable		 3asoA-5xk8A:
undetectable
3asoJ-5xk8A:
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.
5ys9 ACYL-COENZYME A
OXIDASE 3

(Yarrowia
lipolytica) 		no annotation 4 LEU A 585
MET A  41
THR A  42
LEU A  45
 None
 0.88A 3asoA-5ys9A:
1.9
3asoJ-5ys9A:
undetectable		 3asoA-5ys9A:
undetectable
3asoJ-5ys9A:
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.
5z4i UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 20

(Homo sapiens) 		no annotation 4 LEU A   7
ARG A  80
THR A  73
LEU A  72
 None
 0.97A 3asoA-5z4iA:
undetectable
3asoJ-5z4iA:
undetectable		 3asoA-5z4iA:
undetectable
3asoJ-5z4iA:
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.
6brs PUTATIVE ZINC
PROTEASE

(Pectobacterium
atrosepticum) 		no annotation 4 LEU A 141
ARG A  88
THR A  99
LEU A 101
 None
 1.04A 3asoA-6brsA:
undetectable
3asoJ-6brsA:
undetectable		 3asoA-6brsA:
undetectable
3asoJ-6brsA:
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.
6c96 TWO PORE CALCIUM
CHANNEL PROTEIN 1

(Mus musculus) 		no annotation 4 LEU A 721
TYR A 361
THR A 383
LEU A 382
 None
 0.90A 3asoA-6c96A:
1.7
3asoJ-6c96A:
1.2		 3asoA-6c96A:
undetectable
3asoJ-6c96A:
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.
6co9 PROBABLE
COA-TRANSFERASE
ALPHA SUBUNIT

(Rhodococcus
jostii) 		no annotation 4 LEU A 172
ARG A 227
THR A 211
LEU A 214
 None
 1.01A 3asoA-6co9A:
undetectable
3asoJ-6co9A:
undetectable		 3asoA-6co9A:
undetectable
3asoJ-6co9A:
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.
6con COA-TRANSFERASE
SUBUNIT ALPHA

(Mycobacterium
tuberculosis) 		no annotation 4 LEU A 169
ARG A 224
THR A 208
LEU A 211
 None
 1.07A 3asoA-6conA:
undetectable
3asoJ-6conA:
undetectable		 3asoA-6conA:
undetectable
3asoJ-6conA:
undetectable