SIMILAR PATTERNS OF AMINO ACIDS FOR 5TWJ_D_SAMD201

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.
1cj2 PROTEIN
(P-HYDROXYBENZOATE
HYDROXYLASE)

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		5 ILE A 164
GLY A 163
GLY A 160
LEU A  31
VAL A 127
 FAD  A 395 (-4.0A)
FAD  A 395 (-3.6A)
FAD  A 395 (-3.5A)
None
FAD  A 395 (-4.6A)
 0.91A 5twjD-1cj2A:
undetectable		 5twjD-1cj2A:
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.
1d5y ROB TRANSCRIPTION
FACTOR

(Escherichia
coli) 		PF06445
(GyrI-like)
PF12833
(HTH_18) 		5 LEU A  10
ASP A   9
ILE A  12
ILE A   7
LEU A  14
 None
 0.85A 5twjD-1d5yA:
undetectable		 5twjD-1d5yA:
18.79
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.
1dgs DNA LIGASE

(Thermus
filiformis) 		PF01653
(DNA_ligase_aden)
PF03120
(DNA_ligase_OB)
PF12826
(HHH_2)
PF14520
(HHH_5) 		5 LEU A 147
ILE A 153
LEU A 203
SER A 202
LEU A 216
 None
 0.90A 5twjD-1dgsA:
undetectable		 5twjD-1dgsA:
13.96
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.
1e1k ADRENODOXIN
REDUCTASE

(Bos taurus) 		PF07992
(Pyr_redox_2) 		6 LEU A 394
ASP A 393
ILE A 389
GLY A 361
LEU A 391
THR A 386
 None
 1.23A 5twjD-1e1kA:
undetectable		 5twjD-1e1kA:
17.26
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.
1fiz BETA-ACROSIN HEAVY
CHAIN

(Sus scrofa) 		PF00089
(Trypsin) 		6 LEU A  53
ILE A  45
GLY A  44
GLY A  43
SER A 230
VAL A 209
 None
 1.40A 5twjD-1fizA:
undetectable		 5twjD-1fizA:
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.
1gcy GLUCAN
1,4-ALPHA-MALTOTETRA
HYDROLASE

(Pseudomonas
stutzeri) 		PF00128
(Alpha-amylase)
PF09081
(DUF1921) 		5 ASP A  49
ILE A  46
ILE A 345
GLY A 342
VAL A 331
 None
 0.79A 5twjD-1gcyA:
undetectable		 5twjD-1gcyA:
13.40
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.
1j2b ARCHAEOSINE
TRNA-GUANINE
TRANSGLYCOSYLASE

(Pyrococcus
horikoshii) 		PF01472
(PUA)
PF01702
(TGT)
PF14809
(TGT_C1)
PF14810
(TGT_C2) 		6 ASP A 130
ILE A 131
ILE A 168
GLY A 195
GLY A 196
LEU A 150
 G  D 915 ( 3.0A)
None
None
G  D 915 ( 4.2A)
G  D 915 ( 4.2A)
None
 1.23A 5twjD-1j2bA:
undetectable		 5twjD-1j2bA:
15.12
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.
1jcn INOSINE
MONOPHOSPHATE
DEHYDROGENASE I

(Homo sapiens) 		PF00478
(IMPDH)
PF00571
(CBS) 		5 LEU A 389
ILE A 367
GLY A 366
GLY A 328
LEU A 390
 None
None
CPR  A 631 (-3.8A)
CPR  A 631 (-3.0A)
None
 0.86A 5twjD-1jcnA:
undetectable		 5twjD-1jcnA:
15.20
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.
1jr1 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE 2

(Cricetulus
griseus) 		PF00478
(IMPDH)
PF00571
(CBS) 		5 LEU A 389
ILE A 367
GLY A 366
GLY A 328
LEU A 390
 None
None
IMP  A1331 (-3.7A)
IMP  A1331 ( 3.0A)
None
 0.92A 5twjD-1jr1A:
undetectable		 5twjD-1jr1A:
17.45
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.
1k0g P-AMINOBENZOATE
SYNTHASE COMPONENT I

(Escherichia
coli) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		6 ILE A 379
ILE A 427
GLY A 425
GLY A 424
LEU A 382
VAL A 200
 PO4  A 701 (-4.8A)
None
None
None
None
None
 1.31A 5twjD-1k0gA:
undetectable		 5twjD-1k0gA:
14.82
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 LEU A 202
ILE A  14
GLY A  15
GLY A  20
LEU A 370
 None
FAD  A 800 (-4.6A)
FAD  A 800 (-3.1A)
None
None
 0.84A 5twjD-1knrA:
undetectable		 5twjD-1knrA:
15.23
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.
1mld MALATE DEHYDROGENASE

(Sus scrofa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A   6
ILE A  34
ILE A  74
GLY A  77
LEU A  62
 None
 0.93A 5twjD-1mldA:
2.1		 5twjD-1mldA:
19.22
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ILE A 640
GLY A 642
GLY A 781
SER A 809
VAL A 654
 None
 0.84A 5twjD-1n5xA:
undetectable		 5twjD-1n5xA:
8.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns5 HYPOTHETICAL PROTEIN
YBEA

(Escherichia
coli) 		PF02590
(SPOUT_MTase) 		8 ILE A  74
GLY A 104
GLY A 107
LEU A 122
SER A 123
THR A 126
LEU A 127
VAL A 132
 None
 1.08A 5twjD-1ns5A:
29.1		 5twjD-1ns5A:
95.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns5 HYPOTHETICAL PROTEIN
YBEA

(Escherichia
coli) 		PF02590
(SPOUT_MTase) 		11 LEU A  72
ASP A  73
ILE A  74
ILE A 102
GLY A 103
GLY A 107
LEU A 122
SER A 123
THR A 126
LEU A 127
VAL A 132
 None
 0.39A 5twjD-1ns5A:
29.1		 5twjD-1ns5A:
95.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns5 HYPOTHETICAL PROTEIN
YBEA

(Escherichia
coli) 		PF02590
(SPOUT_MTase) 		8 LEU A  72
ILE A 102
GLY A 103
GLY A 104
LEU A 122
SER A 123
THR A 126
LEU A 127
 None
 1.18A 5twjD-1ns5A:
29.1		 5twjD-1ns5A:
95.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1o6d HYPOTHETICAL UPF0247
PROTEIN TM0844

(Thermotoga
maritima) 		PF02590
(SPOUT_MTase) 		7 ASP A  70
ILE A  99
GLY A 100
GLY A 104
LEU A 119
SER A 120
THR A 123
 None
 0.54A 5twjD-1o6dA:
22.1		 5twjD-1o6dA:
32.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1o6d HYPOTHETICAL UPF0247
PROTEIN TM0844

(Thermotoga
maritima) 		PF02590
(SPOUT_MTase) 		6 ILE A  99
GLY A 100
GLY A 101
LEU A 119
SER A 120
THR A 123
 None
 1.16A 5twjD-1o6dA:
22.1		 5twjD-1o6dA:
32.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p1m HYPOTHETICAL PROTEIN
TM0936

(Thermotoga
maritima) 		PF01979
(Amidohydro_1) 		5 LEU A  51
ILE A 108
GLY A 110
THR A 275
LEU A 276
 None
 0.70A 5twjD-1p1mA:
undetectable		 5twjD-1p1mA:
18.14
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.
1pu7 3-METHYLADENINE DNA
GLYCOSYLASE

(Helicobacter
pylori) 		PF00633
(HHH)
PF00730
(HhH-GPD) 		6 LEU A 100
ASP A  99
ILE A  98
ILE A 129
GLY A 128
VAL A  38
 None
 1.28A 5twjD-1pu7A:
undetectable		 5twjD-1pu7A:
19.27
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.
1q8y SR PROTEIN KINASE

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase) 		5 LEU A 278
ILE A 715
GLY A 280
GLY A 221
LEU A 706
 None
 0.94A 5twjD-1q8yA:
undetectable		 5twjD-1q8yA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qz9 KYNURENINASE

(Pseudomonas
fluorescens) 		PF00266
(Aminotran_5) 		5 LEU A 316
ASP A 315
ILE A 318
LEU A 320
VAL A 388
 None
 0.93A 5twjD-1qz9A:
undetectable		 5twjD-1qz9A:
19.09
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.
1sq7 TRIOSEPHOSPHATE
ISOMERASE

(Gallus gallus) 		PF00121
(TIM) 		5 LEU A  48
ASP A  49
GLY A  87
LEU A  55
VAL A  61
 None
 0.93A 5twjD-1sq7A:
undetectable		 5twjD-1sq7A:
24.60
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.
1tlq HYPOTHETICAL PROTEIN
YPJQ

(Bacillus
subtilis) 		PF04608
(PgpA) 		6 LEU A 132
ASP A 133
ILE A 128
GLY A 127
LEU A 143
VAL A 147
 None
 1.44A 5twjD-1tlqA:
undetectable		 5twjD-1tlqA:
21.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1to0 HYPOTHETICAL UPF0247
PROTEIN YYDA

(Bacillus
subtilis) 		PF02590
(SPOUT_MTase) 		7 LEU A  76
ILE A  78
ILE A 107
GLY A 108
GLY A 112
SER A 128
THR A 131
 None
 0.55A 5twjD-1to0A:
23.5		 5twjD-1to0A:
30.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1to0 HYPOTHETICAL UPF0247
PROTEIN YYDA

(Bacillus
subtilis) 		PF02590
(SPOUT_MTase) 		6 LEU A  76
ILE A 107
GLY A 108
GLY A 109
SER A 128
THR A 131
 None
 1.25A 5twjD-1to0A:
23.5		 5twjD-1to0A:
30.95
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.
1ukc ESTA

(Aspergillus
niger) 		PF00135
(COesterase) 		5 LEU A 220
ILE A 326
GLY A 225
GLY A 224
SER A 215
 None
 0.87A 5twjD-1ukcA:
1.4		 5twjD-1ukcA:
16.04
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.
1v9p DNA LIGASE

(Thermus
filiformis) 		PF01653
(DNA_ligase_aden)
PF03120
(DNA_ligase_OB)
PF12826
(HHH_2)
PF14520
(HHH_5) 		5 LEU A 152
ILE A 158
LEU A 208
SER A 207
LEU A 221
 None
 0.90A 5twjD-1v9pA:
undetectable		 5twjD-1v9pA:
14.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vh0 HYPOTHETICAL UPF0247
PROTEIN
SAV0024/SA0023

(Staphylococcus
aureus) 		PF02590
(SPOUT_MTase) 		7 LEU A  76
ILE A  78
ILE A 107
GLY A 108
GLY A 112
SER A 128
THR A 131
 None
 0.56A 5twjD-1vh0A:
23.4		 5twjD-1vh0A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vh0 HYPOTHETICAL UPF0247
PROTEIN
SAV0024/SA0023

(Staphylococcus
aureus) 		PF02590
(SPOUT_MTase) 		6 LEU A  76
ILE A 107
GLY A 108
GLY A 109
SER A 128
THR A 131
 None
 1.27A 5twjD-1vh0A:
23.4		 5twjD-1vh0A:
32.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wg8 PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01795
(Methyltransf_5) 		5 LEU A 177
ILE A 171
LEU A 201
THR A 129
VAL A 134
 None
 0.92A 5twjD-1wg8A:
undetectable		 5twjD-1wg8A:
20.14
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.
1wh4 INTERLEUKIN-1
RECEPTOR-ASSOCIATED
KINASE 4

(Mus musculus) 		no annotation 5 LEU A  91
ILE A  18
LEU A 107
THR A  13
LEU A  12
 None
 0.95A 5twjD-1wh4A:
undetectable		 5twjD-1wh4A:
21.12
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.
1x7p RRNA
METHYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF00588
(SpoU_methylase) 		5 ASP A 211
ILE A 231
GLY A 232
GLY A 237
LEU A 261
 None
SAM  A 301 (-4.2A)
SAM  A 301 (-3.2A)
SAM  A 301 (-3.4A)
SAM  A 301 (-4.1A)
 0.56A 5twjD-1x7pA:
8.2		 5twjD-1x7pA:
20.49
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.
1yrw PROTEIN ARNA

(Escherichia
coli) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		5 LEU A 266
ILE A 276
ILE A 260
SER A 245
LEU A 274
 None
 0.95A 5twjD-1yrwA:
undetectable		 5twjD-1yrwA:
21.40
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.
2a35 HYPOTHETICAL PROTEIN
PA4017

(Pseudomonas
aeruginosa) 		PF08732
(HIM1) 		5 LEU A 185
ASP A 184
GLY A 179
LEU A 189
LEU A  21
 None
 0.86A 5twjD-2a35A:
undetectable		 5twjD-2a35A:
23.35
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.
2aeq FAB HEAVY CHAIN

(Mus musculus) 		PF07686
(V-set) 		5 LEU H  18
SER H  93
THR H  89
LEU H  88
VAL H  12
 None
 0.95A 5twjD-2aeqH:
undetectable		 5twjD-2aeqH:
23.85
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.
2amg 1,4-ALPHA-D-GLUCAN
MALTOTETRAHYDROLASE

(Pseudomonas
stutzeri) 		PF00128
(Alpha-amylase)
PF09081
(DUF1921) 		5 ASP A  49
ILE A  46
ILE A 345
GLY A 342
VAL A 331
 None
 0.81A 5twjD-2amgA:
undetectable		 5twjD-2amgA:
16.99
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.
2axq SACCHAROPINE
DEHYDROGENASE

(Saccharomyces
cerevisiae) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		5 LEU A   8
ILE A  75
GLY A  11
LEU A  53
SER A  52
 None
 0.86A 5twjD-2axqA:
undetectable		 5twjD-2axqA:
16.20
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.
2bws XAA-PRO
AMINOPEPTIDASE P

(Escherichia
coli) 		PF00557
(Peptidase_M24)
PF05195
(AMP_N) 		5 LEU A 301
ILE A 409
LEU A 297
SER A 296
VAL A 382
 None
 0.89A 5twjD-2bwsA:
undetectable		 5twjD-2bwsA:
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.
2c3o PYRUVATE-FERREDOXIN
OXIDOREDUCTASE

(Desulfovibrio
africanus) 		PF01558
(POR)
PF01855
(POR_N)
PF02775
(TPP_enzyme_C)
PF10371
(EKR)
PF13484
(Fer4_16)
PF17147
(PFOR_II) 		5 LEU A 501
ASP A 499
ILE A 504
GLY A 503
VAL A 487
 None
 0.78A 5twjD-2c3oA:
undetectable		 5twjD-2c3oA:
10.26
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.
2egw UPF0088 PROTEIN
AQ_165

(Aquifex
aeolicus) 		PF04452
(Methyltrans_RNA) 		6 ASP A 162
GLY A 185
GLY A 189
LEU A 208
THR A 212
LEU A 213
 None
SAH  A 300 ( 3.6A)
SAH  A 300 ( 3.6A)
SAH  A 300 ( 3.6A)
SAH  A 300 ( 4.0A)
SAH  A 300 ( 4.0A)
 0.73A 5twjD-2egwA:
7.8		 5twjD-2egwA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2egw UPF0088 PROTEIN
AQ_165

(Aquifex
aeolicus) 		PF04452
(Methyltrans_RNA) 		6 LEU A 161
ASP A 162
GLY A 185
GLY A 189
LEU A 208
LEU A 213
 SAH  A 300 ( 3.7A)
None
SAH  A 300 ( 3.6A)
SAH  A 300 ( 3.6A)
SAH  A 300 ( 3.6A)
SAH  A 300 ( 4.0A)
 0.68A 5twjD-2egwA:
7.8		 5twjD-2egwA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fja ADENYLYLSULFATE
REDUCTASE, SUBUNIT A

(Archaeoglobus
fulgidus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 LEU A 212
ILE A  28
GLY A  29
GLY A  34
LEU A 434
 None
None
FAD  A1000 (-3.3A)
None
None
 0.93A 5twjD-2fjaA:
undetectable		 5twjD-2fjaA:
14.73
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.
2fyw CONSERVED
HYPOTHETICAL PROTEIN

(Streptococcus
pneumoniae) 		PF01784
(NIF3) 		6 LEU A 221
ILE A 201
GLY A 182
LEU A 161
SER A 160
VAL A 152
 None
 1.29A 5twjD-2fywA:
undetectable		 5twjD-2fywA:
21.40
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.
2g7s TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Agrobacterium
fabrum) 		PF00440
(TetR_N) 		5 ILE A  19
GLY A  23
LEU A  53
SER A  49
VAL A  54
 None
 0.92A 5twjD-2g7sA:
undetectable		 5twjD-2g7sA:
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.
2h6r TRIOSEPHOSPHATE
ISOMERASE

(Methanocaldococcus
jannaschii) 		PF00121
(TIM) 		5 LEU A 198
ILE A 179
GLY A 178
LEU A 174
VAL A 196
 None
 0.95A 5twjD-2h6rA:
undetectable		 5twjD-2h6rA:
23.11
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.
2hcb CHROMOSOMAL
REPLICATION
INITIATOR PROTEIN
DNAA

(Aquifex
aeolicus) 		PF00308
(Bac_DnaA)
PF08299
(Bac_DnaA_C) 		5 LEU A 177
ILE A 144
GLY A 133
LEU A 202
VAL A 174
 None
 0.93A 5twjD-2hcbA:
undetectable		 5twjD-2hcbA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hmc DIHYDRODIPICOLINATE
SYNTHASE

(Agrobacterium
fabrum) 		PF00701
(DHDPS) 		5 ILE A 190
GLY A 207
GLY A   8
LEU A 223
VAL A 196
 None
 0.91A 5twjD-2hmcA:
undetectable		 5twjD-2hmcA:
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.
2hnk SAM-DEPENDENT
O-METHYLTRANSFERASE

(Leptospira
interrogans) 		PF01596
(Methyltransf_3) 		5 LEU A 153
ASP A 180
ILE A  67
GLY A  68
LEU A 177
 None
None
None
SAH  A2001 (-3.3A)
None
 0.94A 5twjD-2hnkA:
undetectable		 5twjD-2hnkA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i0z NAD(FAD)-UTILIZING
DEHYDROGENASES

(Bacillus cereus) 		PF03486
(HI0933_like) 		6 LEU A  31
ILE A   8
GLY A   9
GLY A  10
LEU A 148
VAL A 133
 None
None
FAD  A 501 (-3.3A)
FAD  A 501 ( 4.5A)
None
FAD  A 501 (-3.9A)
 1.42A 5twjD-2i0zA:
undetectable		 5twjD-2i0zA:
16.96
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.
2j3t TRAFFICKING PROTEIN
PARTICLE COMPLEX
SUBUNIT 6A

(Homo sapiens) 		PF04051
(TRAPP) 		5 LEU B 131
ILE B 136
GLY B 135
LEU B  69
VAL B  65
 None
 0.95A 5twjD-2j3tB:
undetectable		 5twjD-2j3tB:
21.39
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.
2p2c CASPASE-2

(Homo sapiens) 		PF12796
(Ank_2)
PF13637
(Ank_4) 		6 ASP P  89
ILE P 128
GLY P  91
LEU P  84
LEU P  99
VAL P  96
 None
 1.35A 5twjD-2p2cP:
undetectable		 5twjD-2p2cP:
25.28
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.
2pwz MALATE DEHYDROGENASE

(Escherichia
coli) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A   6
ASP A  34
ILE A  35
ILE A  75
GLY A  78
 None
 0.81A 5twjD-2pwzA:
undetectable		 5twjD-2pwzA:
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.
2qmm UPF0217 PROTEIN
AF_1056

(Archaeoglobus
fulgidus) 		PF04013
(Methyltrn_RNA_2) 		7 LEU A 221
ILE A 241
GLY A 242
GLY A 246
LEU A 265
SER A 266
LEU A 270
 SAM  A 301 (-4.3A)
SAM  A 301 ( 4.8A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.3A)
SAM  A 301 (-4.4A)
SAM  A 301 (-4.2A)
SAM  A 301 (-4.5A)
 0.66A 5twjD-2qmmA:
7.4		 5twjD-2qmmA:
25.24
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.
2qvg TWO COMPONENT
RESPONSE REGULATOR

(Legionella
pneumophila) 		PF00072
(Response_reg) 		5 ILE A 117
GLY A 114
LEU A 120
THR A  96
LEU A  95
 None
 0.77A 5twjD-2qvgA:
undetectable		 5twjD-2qvgA:
27.17
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.
2qvx 4-CHLOROBENZOATE COA
LIGASE

(Alcaligenes sp.
AL3007) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		6 LEU X 353
ASP X 385
ILE X 334
LEU X 313
THR X 322
VAL X 395
 None
 1.26A 5twjD-2qvxX:
undetectable		 5twjD-2qvxX:
17.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r5u REPLICATIVE DNA
HELICASE

(Mycobacterium
tuberculosis) 		PF00772
(DnaB) 		5 ILE A 107
ILE A  97
GLY A  99
LEU A  35
VAL A  65
 None
 0.87A 5twjD-2r5uA:
undetectable		 5twjD-2r5uA:
25.62
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.
2tbv TOMATO BUSHY STUNT
VIRUS

(Tomato bushy
stunt virus) 		PF00729
(Viral_coat) 		5 LEU A 293
GLY A 291
GLY A 289
LEU A 314
SER A 315
 None
 0.86A 5twjD-2tbvA:
undetectable		 5twjD-2tbvA:
18.93
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.
2vdv TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF02390
(Methyltransf_4) 		5 LEU E 109
ILE E 111
GLY E 105
LEU E 113
SER E 114
 None
None
SAM  E1287 (-3.6A)
None
None
 0.93A 5twjD-2vdvE:
undetectable		 5twjD-2vdvE:
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 ILE A 671
GLY A 670
GLY A 669
SER A 680
LEU A 714
 None
 0.88A 5twjD-2wtbA:
undetectable		 5twjD-2wtbA:
12.19
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.
2wu5 SUCCINATE
DEHYDROGENASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 LEU A 200
ILE A  13
GLY A  14
GLY A  19
LEU A 383
 None
FAD  A 601 ( 4.9A)
FAD  A 601 (-3.1A)
None
None
 0.94A 5twjD-2wu5A:
undetectable		 5twjD-2wu5A:
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.
2x2i ALPHA-1,4-GLUCAN
LYASE ISOZYME 1

(Gracilariopsis
lemaneiformis) 		PF01055
(Glyco_hydro_31) 		5 ILE A 460
ILE A 631
GLY A 630
GLY A 536
LEU A 547
 None
 0.88A 5twjD-2x2iA:
undetectable		 5twjD-2x2iA:
10.63
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.
3ai9 UPF0217 PROTEIN
MJ1640

(Methanocaldococcus
jannaschii) 		PF04013
(Methyltrn_RNA_2) 		7 LEU X 136
ILE X 155
GLY X 156
GLY X 160
LEU X 179
SER X 180
LEU X 184
 SAM  X 501 (-4.3A)
SAM  X 501 ( 4.8A)
SAM  X 501 (-3.2A)
SAM  X 501 ( 4.2A)
SAM  X 501 (-4.4A)
SAM  X 501 (-4.2A)
SAM  X 501 (-4.3A)
 0.72A 5twjD-3ai9X:
7.2		 5twjD-3ai9X:
18.48
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.
3aw8 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Thermus
thermophilus) 		PF02222
(ATP-grasp) 		5 LEU A 305
GLY A 307
GLY A 333
LEU A 363
VAL A 360
 None
 0.79A 5twjD-3aw8A:
undetectable		 5twjD-3aw8A:
18.65
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.
3cmv PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		6 LEU A2223
ASP A2224
ILE A2064
GLY A2066
LEU A2047
THR A2242
 None
 1.11A 5twjD-3cmvA:
undetectable		 5twjD-3cmvA:
8.25
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.
3cqy ANHYDRO-N-ACETYLMURA
MIC ACID KINASE

(Shewanella
oneidensis) 		PF03702
(AnmK) 		5 LEU A  22
ILE A   7
GLY A   8
GLY A 332
THR A  37
 None
 0.81A 5twjD-3cqyA:
undetectable		 5twjD-3cqyA:
19.78
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.
3d1r FRUCTOSE-1,6-BISPHOS
PHATASE CLASS II
GLPX

(Escherichia
coli) 		PF03320
(FBPase_glpX) 		5 LEU A 233
ILE A 208
GLY A 209
GLY A 210
VAL A 238
 None
None
FBP  A3499 ( 4.0A)
FBP  A3499 (-3.7A)
None
 0.84A 5twjD-3d1rA:
undetectable		 5twjD-3d1rA:
19.28
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.
3da1 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Bacillus
halodurans) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 ILE A  28
GLY A  27
GLY A  26
LEU A 405
LEU A  35
 FAD  A 609 (-4.3A)
FAD  A 609 (-3.4A)
None
None
None
 0.86A 5twjD-3da1A:
undetectable		 5twjD-3da1A:
16.04
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.
3dj4 BIFUNCTIONAL PROTEIN
GLMU

(Mycobacterium
tuberculosis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		6 ASP A 114
GLY A  15
GLY A  17
LEU A  37
SER A  35
LEU A  28
 MG  A 496 ( 2.6A)
UD1  A4000 (-3.6A)
None
None
None
None
 1.34A 5twjD-3dj4A:
undetectable		 5twjD-3dj4A:
18.51
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.
3enp TP53RK-BINDING
PROTEIN

(Homo sapiens) 		PF08617
(CGI-121) 		5 LEU A 161
ASP A 163
ILE A 166
ILE A 158
VAL A  49
 None
 0.92A 5twjD-3enpA:
undetectable		 5twjD-3enpA:
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.
3euh CHROMOSOME PARTITION
PROTEIN MUKF

(Escherichia
coli) 		PF03882
(KicB)
PF17192
(MukF_M)
PF17193
(MukF_C) 		6 ASP A 112
ILE A 115
ILE A 110
GLY A 107
THR A  37
LEU A  33
 None
 1.44A 5twjD-3euhA:
undetectable		 5twjD-3euhA:
17.27
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.
3f7l COPPER,ZINC
SUPEROXIDE DISMUTASE

(Alvinella
pompejana) 		PF00080
(Sod_Cu) 		6 LEU A  20
ILE A   2
ILE A 147
GLY A 148
THR A 105
VAL A 110
 None
 1.50A 5twjD-3f7lA:
undetectable		 5twjD-3f7lA:
23.76
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.
3fet ELECTRON TRANSFER
FLAVOPROTEIN SUBUNIT
ALPHA RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF01012
(ETF) 		5 ILE A  30
ILE A  81
GLY A  78
LEU A 150
VAL A  56
 None
 0.89A 5twjD-3fetA:
undetectable		 5twjD-3fetA:
22.35
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.
3fgb UNCHARACTERIZED
PROTEIN Q89ZH8_BACTN

(Bacteroides
thetaiotaomicron) 		PF10282
(Lactonase) 		5 LEU A 191
ILE A 205
ILE A 184
GLY A 188
LEU A 219
 None
 0.89A 5twjD-3fgbA:
undetectable		 5twjD-3fgbA:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fjy PROBABLE MUTT1
PROTEIN

(Bifidobacterium
adolescentis) 		PF00293
(NUDIX)
PF00300
(His_Phos_1) 		5 ILE A  15
GLY A  14
GLY A  13
LEU A 165
SER A 166
 None
 0.89A 5twjD-3fjyA:
undetectable		 5twjD-3fjyA:
18.13
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.
3gqc DNA REPAIR PROTEIN
REV1

(Homo sapiens) 		PF00817
(IMS)
PF11799
(IMS_C) 		5 ASP A 345
ILE A 720
LEU A 735
SER A 736
VAL A 817
 None
 0.91A 5twjD-3gqcA:
undetectable		 5twjD-3gqcA:
15.77
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.
3hag CAPSID PROTEIN

(Orthohepevirus
A) 		PF03014
(SP2) 		5 ASP A 430
GLY A 334
LEU A 433
THR A 342
LEU A 341
 None
 0.84A 5twjD-3hagA:
undetectable		 5twjD-3hagA:
14.54
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.
3i9s INTEGRON CASSETTE
PROTEIN

(Vibrio cholerae) 		PF00583
(Acetyltransf_1) 		6 LEU A  38
ASP A  37
LEU A  42
SER A  43
LEU A  14
VAL A  17
 None
 1.26A 5twjD-3i9sA:
undetectable		 5twjD-3i9sA:
23.79
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.
3jb9 SMALL NUCLEAR
RIBONUCLEOPROTEIN-AS
SOCIATED PROTEIN B

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		5 LEU E  37
ILE E  69
ILE E  75
GLY E  72
LEU E  39
 None
None
None
U  C  99 ( 3.5A)
None
 0.88A 5twjD-3jb9E:
undetectable		 5twjD-3jb9E:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kb6 D-LACTATE
DEHYDROGENASE

(Aquifex
aeolicus) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A 200
ILE A 147
GLY A 148
GLY A 153
LEU A 226
 None
None
NAD  A 400 ( 3.9A)
None
None
 0.91A 5twjD-3kb6A:
undetectable		 5twjD-3kb6A:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kfu ASPARTYL/GLUTAMYL-TR
NA(ASN/GLN)
AMIDOTRANSFERASE
SUBUNIT B

(Thermus
thermophilus) 		PF02637
(GatB_Yqey)
PF02934
(GatB_N) 		6 LEU F  64
GLY F  67
GLY F 103
LEU F  60
LEU F  99
VAL F  70
 None
 1.44A 5twjD-3kfuF:
undetectable		 5twjD-3kfuF:
19.08
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.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1

(Staphylococcus
aureus) 		no annotation 5 LEU Q 228
ILE Q 217
GLY Q 212
LEU Q 245
THR Q 176
 None
 0.94A 5twjD-3ksdQ:
undetectable		 5twjD-3ksdQ:
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.
3ktb ARSENICAL RESISTANCE
OPERON TRANS-ACTING
REPRESSOR

(Bacteroides
vulgatus) 		PF06953
(ArsD) 		5 LEU A  36
ILE A  41
GLY A  40
LEU A 102
VAL A 100
 None
 0.91A 5twjD-3ktbA:
undetectable		 5twjD-3ktbA:
19.51
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.
3m6a ATP-DEPENDENT
PROTEASE LA 1

(Bacillus
subtilis) 		PF00004
(AAA)
PF05362
(Lon_C) 		5 LEU A 442
ASP A 443
ILE A 349
GLY A 347
LEU A 461
 None
 0.88A 5twjD-3m6aA:
undetectable		 5twjD-3m6aA:
15.47
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.
3nk7 23S RRNA
METHYLTRANSFERASE

(Streptomyces
actuosus) 		PF00588
(SpoU_methylase)
PF04705
(TSNR_N) 		5 LEU A 195
ASP A 196
GLY A 218
GLY A 223
LEU A 247
 SAM  A 770 (-3.8A)
None
SAM  A 770 (-3.0A)
SAM  A 770 (-3.4A)
SAM  A 770 (-4.5A)
 0.63A 5twjD-3nk7A:
8.8		 5twjD-3nk7A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oet ERYTHRONATE-4-PHOSPH
ATE DEHYDROGENASE

(Salmonella
enterica) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
PF11890
(DUF3410) 		5 ILE A 119
GLY A 123
GLY A 128
THR A 142
LEU A 143
 None
NAD  A 379 (-3.3A)
None
None
None
 0.89A 5twjD-3oetA:
2.0		 5twjD-3oetA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p1v METALLO-ENDOPEPTIDAS
E

(Bacteroides
ovatus) 		PF09471
(Peptidase_M64)
PF16217
(M64_N) 		6 LEU A 269
ILE A 272
GLY A 271
GLY A 156
LEU A 181
VAL A 222
 None
 1.20A 5twjD-3p1vA:
undetectable		 5twjD-3p1vA:
17.33
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.
3pzr ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Vibrio cholerae) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		6 LEU A 252
LEU A 140
SER A 137
THR A 109
LEU A 110
VAL A 113
 None
 1.36A 5twjD-3pzrA:
undetectable		 5twjD-3pzrA:
18.43
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.
3q1t ENOYL-COA HYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 LEU A 211
ILE A 207
GLY A 206
THR A  28
VAL A 113
 None
 0.91A 5twjD-3q1tA:
undetectable		 5twjD-3q1tA:
19.92
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.
3r4t 4-AMINOBUTYRATE
AMINOTRANSFERASE
GABT

(Mycobacterium
marinum) 		PF00202
(Aminotran_3) 		6 LEU A 421
ILE A 378
LEU A 436
SER A 433
LEU A 353
VAL A 354
 None
 1.08A 5twjD-3r4tA:
undetectable		 5twjD-3r4tA:
15.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sr6 XANTHINE
DEHYDROGENASE/OXIDAS
E

(Bos taurus) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ILE C 640
GLY C 642
GLY C 781
SER C 809
VAL C 654
 None
 0.95A 5twjD-3sr6C:
undetectable		 5twjD-3sr6C:
13.47
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.
3ta6 TRIOSEPHOSPHATE
ISOMERASE

(Mycobacterium
tuberculosis) 		PF00121
(TIM) 		6 LEU A  56
ASP A  58
LEU A  62
THR A  65
LEU A  64
VAL A  24
 None
 1.35A 5twjD-3ta6A:
undetectable		 5twjD-3ta6A:
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.
3tvi ASPARTOKINASE

(Clostridium
acetobutylicum) 		PF00696
(AA_kinase)
PF01842
(ACT) 		5 LEU A 274
GLY A 272
GLY A 211
LEU A 276
SER A 230
 None
 0.92A 5twjD-3tviA:
undetectable		 5twjD-3tviA:
15.47
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.
3vis ESTERASE

(Thermobifida
alba) 		PF12740
(Chlorophyllase2) 		6 LEU A 178
ILE A 203
GLY A 172
LEU A 185
THR A 207
VAL A 165
 None
 1.32A 5twjD-3visA:
undetectable		 5twjD-3visA:
23.49
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.
3vis ESTERASE

(Thermobifida
alba) 		PF12740
(Chlorophyllase2) 		6 LEU A 178
ILE A 203
GLY A 174
LEU A 185
THR A 207
VAL A 165
 None
 1.00A 5twjD-3visA:
undetectable		 5twjD-3visA:
23.49
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.
3zif PENTON PROTEIN

(Bovine
mastadenovirus
B) 		PF01686
(Adeno_Penton_B) 		5 ILE M 170
ILE M 250
GLY M 249
GLY M 339
THR M 201
 None
 0.87A 5twjD-3zifM:
undetectable		 5twjD-3zifM:
15.91
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.
3zok 3-DEHYDROQUINATE
SYNTHASE

(Actinidia
chinensis) 		PF01761
(DHQ_synthase) 		6 GLY A 126
GLY A 122
LEU A  50
SER A  80
THR A  53
VAL A  98
 None
 1.42A 5twjD-3zokA:
undetectable		 5twjD-3zokA:
18.72
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.
3zu7 DESIGNED ANKYRIN
REPEAT PROTEIN

(synthetic
construct) 		PF00023
(Ank)
PF12796
(Ank_2) 		6 ASP B  89
ILE B 128
GLY B  91
LEU B  84
LEU B  99
VAL B  96
 None
 1.44A 5twjD-3zu7B:
undetectable		 5twjD-3zu7B:
25.42
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.
4a0k DNA DAMAGE-BINDING
PROTEIN 2

(Danio rerio) 		PF00400
(WD40) 		5 ILE D 195
GLY D 170
GLY D 188
LEU D 208
VAL D 210
 None
 0.92A 5twjD-4a0kD:
undetectable		 5twjD-4a0kD:
19.18
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.
4a5n UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR YYBR

(Bacillus
subtilis) 		PF01638
(HxlR) 		5 ILE A  30
ILE A  23
GLY A  24
GLY A  25
VAL A  97
 None
 0.90A 5twjD-4a5nA:
undetectable		 5twjD-4a5nA:
22.86