SIMILAR PATTERNS OF AMINO ACIDS FOR 6MHT_D_SAMD328_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)

(Escherichia
coli) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLY A  94
LEU A  36
GLY A  35
ASP A 119
ASN A 274
 None
 1.13A 6mhtA-1b0aA:
undetectable		 6mhtA-1b0aA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bhe POLYGALACTURONASE

(Pectobacterium
carotovorum) 		PF00295
(Glyco_hydro_28) 		5 GLY A 250
GLY A 274
ASP A 223
ILE A 204
VAL A 304
 None
 0.88A 6mhtA-1bheA:
undetectable		 6mhtA-1bheA:
20.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dct PROTEIN
(MODIFICATION
METHYLASE HAEIII)

(Haemophilus
influenzae) 		PF00145
(DNA_methylase) 		9 PHE A   7
GLY A   9
GLY A  12
ASN A  28
ASP A  31
ASP A  50
ILE A  51
ASN A 306
VAL A 308
 None
 0.81A 6mhtA-1dctA:
29.5		 6mhtA-1dctA:
33.24
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.
1dqw OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00215
(OMPdecase) 		5 GLY A 181
LEU A 198
ASP A 170
ILE A 171
VAL A  17
 None
 1.02A 6mhtA-1dqwA:
undetectable		 6mhtA-1dqwA:
24.04
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.
1g55 DNA CYTOSINE
METHYLTRANSFERASE
DNMT2

(Homo sapiens) 		PF00145
(DNA_methylase) 		5 GLY A  12
GLY A  15
ILE A  57
ASN A 375
SER A 376
 SAH  A 392 (-3.4A)
SAH  A 392 (-3.1A)
SAH  A 392 (-4.1A)
SAH  A 392 (-4.7A)
SAH  A 392 (-2.9A)
 0.62A 6mhtA-1g55A:
25.1		 6mhtA-1g55A:
28.33
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.
1jug LYSOZYME

(Tachyglossus
aculeatus) 		PF00062
(Lys) 		5 GLY A  16
GLY A  19
ASN A  11
ASP A  87
ILE A  88
 None
 1.10A 6mhtA-1jugA:
undetectable		 6mhtA-1jugA:
18.40
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		5 GLY A 264
GLY A 242
ASP A 421
ASN A 279
VAL A 209
 None
 1.01A 6mhtA-1kb0A:
undetectable		 6mhtA-1kb0A:
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.
1lwd ISOCITRATE
DEHYDROGENASE

(Sus scrofa) 		PF00180
(Iso_dh) 		5 GLY A 105
LEU A 104
ASP A 186
ILE A 189
ASN A 102
 None
 0.83A 6mhtA-1lwdA:
undetectable		 6mhtA-1lwdA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1npc NEUTRAL PROTEASE

(Bacillus cereus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 LEU A  24
GLY A   3
TRP A  56
ASP A  58
ASP A  44
 None
None
None
CA  A 321 ( 2.2A)
None
 1.07A 6mhtA-1npcA:
undetectable		 6mhtA-1npcA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r6u TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		5 PHE A 339
GLY A  97
GLY A 345
ASP A  99
VAL A 398
 None
 1.06A 6mhtA-1r6uA:
undetectable		 6mhtA-1r6uA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s1d APYRASE

(Homo sapiens) 		PF06079
(Apyrase) 		5 PHE A 103
LEU A 100
ASP A  19
SER A 109
VAL A 110
 None
 1.09A 6mhtA-1s1dA:
undetectable		 6mhtA-1s1dA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sde D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Streptomyces
sp. R61) 		PF00144
(Beta-lactamase) 		5 GLY A  25
LEU A  19
GLY A  22
ASN A 211
VAL A 331
 None
None
GOL  A 500 ( 4.6A)
None
None
 1.03A 6mhtA-1sdeA:
undetectable		 6mhtA-1sdeA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vbf 231AA LONG
HYPOTHETICAL
PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01135
(PCMT) 		5 GLY A  78
ASP A  67
ILE A 160
SER A  97
VAL A  98
 None
 1.11A 6mhtA-1vbfA:
3.5		 6mhtA-1vbfA:
22.39
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.
1xfi UNKNOWN PROTEIN

(Arabidopsis
thaliana) 		PF01937
(DUF89) 		5 PHE A 233
GLY A 229
LEU A 228
ILE A 316
VAL A 139
 None
 1.00A 6mhtA-1xfiA:
2.7		 6mhtA-1xfiA:
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.
2ahw PUTATIVE ENZYME YDIF

(Escherichia
coli) 		PF01144
(CoA_trans) 		5 GLY A  39
LEU A 259
GLY A 261
ILE A  79
SER A 257
 None
 1.06A 6mhtA-2ahwA:
undetectable		 6mhtA-2ahwA:
20.15
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.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		5 GLY A 466
ASP A 328
ILE A 498
SER A 591
VAL A 592
 None
SIA  A1692 (-2.9A)
None
None
None
 1.11A 6mhtA-2bf6A:
undetectable		 6mhtA-2bf6A:
22.78
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 GLY A  57
LEU A  56
GLY A 286
TRP A  35
VAL A  53
 None
 0.98A 6mhtA-2eo5A:
undetectable		 6mhtA-2eo5A:
23.83
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.
2i6b ADENOSINE KINASE

(Homo sapiens) 		PF00294
(PfkB) 		5 PHE A 264
GLY A 299
ASP A 270
ILE A 244
VAL A 303
 None
 1.05A 6mhtA-2i6bA:
4.8		 6mhtA-2i6bA:
21.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		6 LEU A  21
GLY A  23
ASP A 103
ILE A 104
ASN A 304
SER A 305
 SAH  A 328 (-4.1A)
SAH  A 328 (-3.6A)
None
None
SAH  A 328 (-3.7A)
SAH  A 328 (-2.7A)
 1.37A 6mhtA-2i9kA:
44.8		 6mhtA-2i9kA:
99.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		12 PHE A  18
GLY A  20
LEU A  21
GLY A  23
ASN A  39
TRP A  41
ASP A  42
ASP A  60
ILE A  61
ASN A 304
SER A 305
VAL A 306
 SAH  A 328 (-4.9A)
SAH  A 328 (-3.3A)
SAH  A 328 (-4.1A)
SAH  A 328 (-3.6A)
SAH  A 328 (-4.3A)
SAH  A 328 (-3.4A)
None
SAH  A 328 (-3.6A)
SAH  A 328 (-4.3A)
SAH  A 328 (-3.7A)
SAH  A 328 (-2.7A)
SAH  A 328 (-4.4A)
 0.56A 6mhtA-2i9kA:
44.8		 6mhtA-2i9kA:
99.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ipc PREPROTEIN
TRANSLOCASE SECA
SUBUNIT

(Thermus
thermophilus) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 GLY A 383
LEU A  91
GLY A  94
ASP A 217
ILE A 216
 None
 1.05A 6mhtA-2ipcA:
undetectable		 6mhtA-2ipcA:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nul PEPTIDYLPROLYL
ISOMERASE

(Escherichia
coli) 		PF00160
(Pro_isomerase) 		5 GLY A 129
ASN A   7
ASP A 154
ILE A 156
VAL A 126
 None
 0.99A 6mhtA-2nulA:
undetectable		 6mhtA-2nulA:
19.25
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.
2ox1 3-DEHYDROQUINATE
DEHYDRATASE

(Archaeoglobus
fulgidus) 		PF01487
(DHquinase_I) 		5 ASP A  74
ASP A 119
ILE A  93
ASN A  72
SER A  70
 None
 1.08A 6mhtA-2ox1A:
undetectable		 6mhtA-2ox1A:
23.15
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.
2qby CELL DIVISION
CONTROL PROTEIN 6
HOMOLOG 3

(Sulfolobus
solfataricus) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		5 PHE B  60
GLY B  62
LEU B  63
GLY B  65
ILE B 178
 None
None
None
ADP  B   9 (-3.5A)
None
 1.09A 6mhtA-2qbyB:
undetectable		 6mhtA-2qbyB:
22.30
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.
2qg7 ETHANOLAMINE KINASE
PV091845

(Plasmodium
vivax) 		PF01633
(Choline_kinase) 		5 PHE A 368
LEU A 298
GLY A 373
ILE A 410
SER A 299
 None
 1.07A 6mhtA-2qg7A:
undetectable		 6mhtA-2qg7A:
23.19
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.
2zux YESW PROTEIN

(Bacillus
subtilis) 		no annotation 5 GLY A 429
GLY A 443
ASN A 425
ASP A 449
ASN A 470
 None
 1.00A 6mhtA-2zuxA:
undetectable		 6mhtA-2zuxA:
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.
3a75 GAMMA-GLUTAMYLTRANSP
EPTIDASE LARGE CHAIN

(Bacillus
subtilis) 		PF01019
(G_glu_transpept) 		5 PHE A  79
GLY A  60
ASN A  82
ILE A  91
VAL A  63
 None
 1.05A 6mhtA-3a75A:
undetectable		 6mhtA-3a75A:
23.66
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.
3av3 PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE

(Geobacillus
kaustophilus) 		PF00551
(Formyl_trans_N) 		5 PHE A   7
GLY A  88
GLY A  10
ILE A  93
VAL A  43
 None
 1.09A 6mhtA-3av3A:
4.5		 6mhtA-3av3A:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3av6 DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		6 PHE A1148
GLY A1150
GLY A1153
ASP A1193
ASN A1580
VAL A1582
 SAM  A   1 (-4.9A)
SAM  A   1 ( 3.9A)
SAM  A   1 (-3.6A)
SAM  A   1 (-3.6A)
SAM  A   1 (-4.5A)
SAM  A   1 (-3.8A)
 0.87A 6mhtA-3av6A:
16.2		 6mhtA-3av6A:
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.
3baz HYDROXYPHENYLPYRUVAT
E REDUCTASE

(Plectranthus
scutellarioides) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLY A 254
GLY A 252
ASP A 256
ASP A 106
ILE A 109
 None
None
NAP  A 500 (-3.9A)
None
None
 1.08A 6mhtA-3bazA:
4.5		 6mhtA-3bazA:
22.19
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.
3g7u CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Escherichia
coli) 		PF00145
(DNA_methylase) 		7 PHE A   7
GLY A   9
GLY A  12
ASP A  31
ASP A  51
ASN A 347
SER A 348
 None
 0.84A 6mhtA-3g7uA:
24.8		 6mhtA-3g7uA:
29.05
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.
3g7u CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Escherichia
coli) 		PF00145
(DNA_methylase) 		7 PHE A   7
GLY A   9
GLY A  12
ASP A  31
ASP A  51
ASN A 347
VAL A 349
 None
None
None
None
None
None
CL  A 401 ( 4.0A)
 0.90A 6mhtA-3g7uA:
24.8		 6mhtA-3g7uA:
29.05
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.
3gdh TRIMETHYLGUANOSINE
SYNTHASE HOMOLOG

(Homo sapiens) 		PF09445
(Methyltransf_15) 		5 PHE A 698
GLY A 700
GLY A 703
ASP A 721
ASP A 747
 SAH  A 854 (-4.3A)
SAH  A 854 (-3.3A)
SAH  A 854 (-3.0A)
None
SAH  A 854 (-3.6A)
 0.60A 6mhtA-3gdhA:
9.2		 6mhtA-3gdhA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jux PROTEIN TRANSLOCASE
SUBUNIT SECA

(Thermotoga
maritima) 		PF00271
(Helicase_C)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 GLY A 414
LEU A  87
GLY A  90
ASP A 260
ILE A 259
 None
 1.05A 6mhtA-3juxA:
undetectable		 6mhtA-3juxA:
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.
3k17 LIN0012 PROTEIN

(Listeria
innocua) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 GLY A 324
GLY A 313
TRP A 221
ASP A 322
ASP A 111
 None
 1.12A 6mhtA-3k17A:
undetectable		 6mhtA-3k17A:
22.14
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.
3kc2 UNCHARACTERIZED
PROTEIN YKR070W

(Saccharomyces
cerevisiae) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		5 GLY A 221
LEU A 225
TRP A 209
ASP A  21
VAL A 227
 None
PO4  A 354 (-4.6A)
None
PO4  A 353 ( 3.6A)
None
 1.13A 6mhtA-3kc2A:
2.3		 6mhtA-3kc2A:
21.32
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.
3ktd PREPHENATE
DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF02153
(PDH) 		5 PHE A  51
GLY A  35
ASP A  25
ASN A  37
SER A  54
 None
 1.02A 6mhtA-3ktdA:
4.2		 6mhtA-3ktdA:
20.26
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.
3lk7 UDP-N-ACETYLMURAMOYL
ALANINE--D-GLUTAMATE
LIGASE

(Streptococcus
agalactiae) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 GLY A 273
GLY A 309
ASP A 271
ILE A 287
ASN A 306
 None
 1.07A 6mhtA-3lk7A:
2.9		 6mhtA-3lk7A:
25.65
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.
3llc PUTATIVE HYDROLASE

(Agrobacterium
vitis) 		PF12697
(Abhydrolase_6) 		5 GLY A  75
GLY A  77
ASP A  85
ASP A 191
ILE A  88
 None
 1.07A 6mhtA-3llcA:
3.7		 6mhtA-3llcA:
19.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lx6 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri) 		PF00145
(DNA_methylase) 		8 PHE A  93
GLY A  95
GLY A  98
ASP A 140
ILE A 141
ASN A 436
SER A 437
VAL A 438
 None
 0.65A 6mhtA-3lx6A:
27.7		 6mhtA-3lx6A:
33.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lx6 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri) 		PF00145
(DNA_methylase) 		5 PHE A  93
GLY A  97
ILE A 141
ASN A 436
SER A 437
 None
 0.98A 6mhtA-3lx6A:
27.7		 6mhtA-3lx6A:
33.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri) 		PF00145
(DNA_methylase) 		8 PHE A  93
GLY A  95
GLY A  98
ASP A 140
ILE A 141
ASN A 436
SER A 437
VAL A 438
 None
 0.87A 6mhtA-3me5A:
25.4		 6mhtA-3me5A:
30.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3me5 CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Shigella
flexneri) 		PF00145
(DNA_methylase) 		5 PHE A  93
GLY A  97
ILE A 141
ASN A 436
SER A 437
 None
 1.06A 6mhtA-3me5A:
25.4		 6mhtA-3me5A:
30.60
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.
3n9v TYPE II
INOSITOL-1,4,5-TRISP
HOSPHATE
5-PHOSPHATASE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		5 PHE A 311
GLY A 346
LEU A 304
ASN A 379
ILE A 373
 None
 1.11A 6mhtA-3n9vA:
2.7		 6mhtA-3n9vA:
24.11
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.
3nav TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Vibrio cholerae) 		PF00290
(Trp_syntA) 		5 GLY A  51
LEU A 100
GLY A  98
ILE A  80
VAL A 126
 None
EDO  A 601 (-4.7A)
None
None
None
 1.07A 6mhtA-3navA:
undetectable		 6mhtA-3navA:
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.
3pta DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC) 		5 PHE A1145
GLY A1147
ASP A1190
ASN A1578
VAL A1580
 SAH  A1601 (-4.4A)
SAH  A1601 (-3.5A)
SAH  A1601 ( 4.7A)
SAH  A1601 (-4.2A)
SAH  A1601 (-4.4A)
 0.59A 6mhtA-3ptaA:
25.0		 6mhtA-3ptaA:
16.08
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.
3pta DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC) 		5 PHE A1145
GLY A1147
GLY A1150
ASP A1190
VAL A1580
 SAH  A1601 (-4.4A)
SAH  A1601 (-3.5A)
SAH  A1601 (-3.6A)
SAH  A1601 ( 4.7A)
SAH  A1601 (-4.4A)
 0.75A 6mhtA-3ptaA:
25.0		 6mhtA-3ptaA:
16.08
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.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE

(Entamoeba
histolytica) 		PF00145
(DNA_methylase) 		5 PHE A  12
GLY A  14
GLY A  17
ASN A 302
VAL A 304
 SAH  A 323 (-4.4A)
SAH  A 323 (-3.6A)
SAH  A 323 (-3.0A)
None
SAH  A 323 ( 4.4A)
 0.52A 6mhtA-3qv2A:
28.0		 6mhtA-3qv2A:
27.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE

(Entamoeba
histolytica) 		PF00145
(DNA_methylase) 		6 PHE A  12
GLY A  17
ASP A  60
ASN A 302
SER A 303
VAL A 304
 SAH  A 323 (-4.4A)
SAH  A 323 (-3.0A)
SAH  A 323 (-3.5A)
None
None
SAH  A 323 ( 4.4A)
 1.43A 6mhtA-3qv2A:
28.0		 6mhtA-3qv2A:
27.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rpl D-FRUCTOSE
1,6-BISPHOSPHATASE
CLASS
2/SEDOHEPTULOSE
1,7-BISPHOSPHATASE

(Synechocystis
sp. PCC 6803) 		PF03320
(FBPase_glpX) 		5 PHE A 125
GLY A 122
GLY A 287
SER A 119
VAL A 290
 None
 1.08A 6mhtA-3rplA:
undetectable		 6mhtA-3rplA:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t1i DOUBLE-STRAND BREAK
REPAIR PROTEIN
MRE11A

(Homo sapiens) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		5 LEU A  57
GLY A  59
ASP A 239
ILE A 238
SER A 124
 None
 0.86A 6mhtA-3t1iA:
undetectable		 6mhtA-3t1iA:
23.29
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.
3t1u PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Azotobacter
vinelandii) 		PF00160
(Pro_isomerase) 		5 GLY A 129
ASN A   7
ASP A 154
ILE A 156
VAL A 126
 None
 1.02A 6mhtA-3t1uA:
undetectable		 6mhtA-3t1uA:
21.18
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.
3us8 ISOCITRATE
DEHYDROGENASE [NADP]

(Sinorhizobium
meliloti) 		PF00180
(Iso_dh) 		5 GLY A 104
LEU A 103
ASP A 184
ILE A 187
ASN A 101
 None
None
None
None
SO4  A 502 (-3.0A)
 0.80A 6mhtA-3us8A:
undetectable		 6mhtA-3us8A:
21.38
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.
3v8x TRANSFERRIN-BINDING
PROTEIN 1

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 GLY A 165
LEU A 167
GLY A 169
ASP A 504
ASN A 107
 None
 0.85A 6mhtA-3v8xA:
undetectable		 6mhtA-3v8xA:
17.05
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.
4a5o BIFUNCTIONAL PROTEIN
FOLD

(Pseudomonas
aeruginosa) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLY A  94
LEU A  36
GLY A  35
ASP A 119
ASN A 274
 None
None
None
None
GOL  A1285 (-3.4A)
 1.10A 6mhtA-4a5oA:
2.5		 6mhtA-4a5oA:
21.97
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.
4b46 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		5 PHE A 167
GLY A 135
ASN A 169
ILE A 186
VAL A 228
 None
None
GDP  A1368 (-3.3A)
GDP  A1368 (-4.2A)
None
 1.10A 6mhtA-4b46A:
3.2		 6mhtA-4b46A:
21.45
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.
4c1o BETA-XYLOSIDASE

(Parageobacillus
thermoglucosidasius) 		PF03512
(Glyco_hydro_52) 		5 PHE A 185
GLY A  52
GLY A  49
ASP A  55
ILE A 215
 None
None
EDO  A1735 (-2.9A)
None
None
 1.10A 6mhtA-4c1oA:
undetectable		 6mhtA-4c1oA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cmn INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE OCRL-1

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		5 PHE A 286
GLY A 321
LEU A 279
GLY A 251
ILE A 348
 None
 0.91A 6mhtA-4cmnA:
2.4		 6mhtA-4cmnA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4csi CELLULASE

(Humicola grisea) 		PF00840
(Glyco_hydro_7) 		5 GLY A 138
LEU A 141
GLY A 143
ASN A 136
VAL A 420
 None
 1.13A 6mhtA-4csiA:
undetectable		 6mhtA-4csiA:
21.38
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.
4dkj CYTOSINE-SPECIFIC
METHYLTRANSFERASE

(Mycoplasma
penetrans) 		PF00145
(DNA_methylase) 		7 PHE A  17
GLY A  19
TRP A  46
ASP A 113
ILE A 114
ASN A 374
SER A 375
 SAH  A 501 (-4.8A)
SAH  A 501 (-3.4A)
SAH  A 501 (-4.0A)
SAH  A 501 (-3.7A)
SAH  A 501 (-4.3A)
SAH  A 501 (-4.3A)
SAH  A 501 (-3.0A)
 0.61A 6mhtA-4dkjA:
31.7		 6mhtA-4dkjA:
27.43
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.
4e6w CLBP PEPTIDASE

(Escherichia
coli) 		PF00144
(Beta-lactamase) 		5 PHE A 143
GLY A 314
ASP A 119
ILE A 120
ASN A 298
 None
 1.00A 6mhtA-4e6wA:
undetectable		 6mhtA-4e6wA:
23.24
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.
4h0n DNMT2

(Spodoptera
frugiperda) 		PF00145
(DNA_methylase) 		6 GLY A  11
GLY A  14
ILE A  56
ASN A 316
SER A 317
VAL A 318
 SAH  A 401 (-3.3A)
SAH  A 401 (-3.7A)
SAH  A 401 (-3.9A)
SAH  A 401 (-4.8A)
SAH  A 401 (-2.6A)
SAH  A 401 (-4.4A)
 0.59A 6mhtA-4h0nA:
26.4		 6mhtA-4h0nA:
28.42
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.
4h3v OXIDOREDUCTASE
DOMAIN PROTEIN

(Kribbella
flavida) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 GLY A 284
GLY A 154
ILE A 313
ASN A 280
VAL A 156
 None
 0.96A 6mhtA-4h3vA:
3.5		 6mhtA-4h3vA:
21.32
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.
4hq1 PROBABLE RECEPTOR
PROTEIN KINASE TMK1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 GLY A 376
LEU A 398
GLY A 400
ASP A 224
ASN A 397
 None
 1.13A 6mhtA-4hq1A:
undetectable		 6mhtA-4hq1A:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iig BETA-GLUCOSIDASE 1

(Aspergillus
aculeatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 PHE A 273
GLY A 753
GLY A 750
ASP A 235
ILE A 244
 None
 1.05A 6mhtA-4iigA:
undetectable		 6mhtA-4iigA:
16.17
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.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		5 GLY A  63
LEU A  64
GLY A  66
ASP A 108
ILE A 109
 SAM  A 301 ( 3.9A)
None
None
SAM  A 301 (-3.5A)
SAM  A 301 (-4.1A)
 0.55A 6mhtA-4iv8A:
7.7		 6mhtA-4iv8A:
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.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		5 GLY A  62
LEU A  63
GLY A  65
ASP A 107
ILE A 108
 SAM  A 301 ( 3.8A)
None
None
SAM  A 301 (-3.5A)
SAM  A 301 (-4.0A)
 0.58A 6mhtA-4mwzA:
8.0		 6mhtA-4mwzA:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nen INTEGRIN ALPHA-X

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLY A 139
LEU A 203
GLY A 205
ASN A 147
SER A 175
 None
 0.99A 6mhtA-4nenA:
2.8		 6mhtA-4nenA:
14.97
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.
4o1k CARBONIC ANHYDRASE

(Sordaria
macrospora) 		PF00484
(Pro_CA) 		5 PHE A 196
GLY A 111
GLY A 193
ASN A 197
VAL A 108
 None
 0.97A 6mhtA-4o1kA:
undetectable		 6mhtA-4o1kA:
20.67
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.
4o6r ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 GLY A 411
LEU A 410
GLY A 409
ILE A 436
VAL A 451
 None
 0.94A 6mhtA-4o6rA:
3.9		 6mhtA-4o6rA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4onq DNA
METHYLTRANSFERASE

(Nicotiana
tabacum) 		PF00145
(DNA_methylase) 		6 PHE A 488
GLY A 490
GLY A 493
ASP A 539
ASN A 460
SER A 461
 SFG  A 700 (-4.5A)
SFG  A 700 (-3.5A)
SFG  A 700 (-3.6A)
SFG  A 700 ( 4.4A)
None
SFG  A 700 (-2.9A)
 0.66A 6mhtA-4onqA:
6.7		 6mhtA-4onqA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pxl CYTOSOLIC ALDEHYDE
DEHYDROGENASE RF2C

(Zea mays) 		PF00171
(Aldedh) 		5 GLY A 467
LEU A 428
ASP A 477
ASP A 484
SER A 472
 None
CSO  A 303 (-4.5A)
None
None
EDO  A 604 ( 4.2A)
 1.03A 6mhtA-4pxlA:
3.9		 6mhtA-4pxlA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23

(Saccharomyces
cerevisiae) 		PF08241
(Methyltransf_11) 		5 PHE B 154
GLY B 152
GLY B 202
ASP B  53
ILE B  54
 None
None
None
SAM  B 301 ( 4.6A)
None
 0.61A 6mhtA-4qtuB:
8.6		 6mhtA-4qtuB:
19.15
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.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		5 GLY A  65
LEU A  66
GLY A  68
ASP A 110
ILE A 111
 SAH  A 302 (-3.6A)
None
None
SAH  A 302 (-3.6A)
SAH  A 302 (-4.1A)
 0.42A 6mhtA-4r6wA:
7.6		 6mhtA-4r6wA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rgy ESTERASE

(uncultured
bacterium FLS12) 		PF00756
(Esterase) 		5 GLY A  50
LEU A  51
ASP A 250
ILE A 253
VAL A  80
 None
 1.12A 6mhtA-4rgyA:
2.9		 6mhtA-4rgyA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		6 PHE A1145
GLY A1147
GLY A1150
ASP A1190
ASN A1578
VAL A1580
 SAH  A1706 (-4.8A)
SAH  A1706 (-3.2A)
SAH  A1706 (-3.2A)
SAH  A1706 (-3.3A)
SAH  A1706 (-4.5A)
SAH  A1706 (-4.4A)
 0.93A 6mhtA-4wxxA:
16.4		 6mhtA-4wxxA:
13.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xqe HOMOSPERMIDINE
SYNTHASE

(Blastochloris
viridis) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		5 GLY A 397
LEU A 398
GLY A  25
ASN A 227
SER A 401
 None
 1.11A 6mhtA-4xqeA:
2.8		 6mhtA-4xqeA:
21.95
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.
4y4r BIFUNCTIONAL
LYSINE-SPECIFIC
DEMETHYLASE AND
HISTIDYL-HYDROXYLASE
NO66

(Homo sapiens) 		PF08007
(Cupin_4) 		5 LEU A 539
GLY A 618
ASP A 598
SER A 522
VAL A 523
 None
 1.06A 6mhtA-4y4rA:
undetectable		 6mhtA-4y4rA:
21.32
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.
5aid MEP2

(Candida
albicans) 		PF00909
(Ammonium_transp) 		5 LEU A 196
GLY A 192
ASP A 407
ILE A 414
VAL A 338
 None
 1.12A 6mhtA-5aidA:
undetectable		 6mhtA-5aidA:
20.04
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.
5cb6 PROBABLE
ADENYLYL-SULFATE
KINASE

(Synechocystis
sp. PCC 6803) 		PF01583
(APS_kinase) 		5 GLY A  12
LEU A  13
GLY A  15
ILE A   8
ASN A 108
 None
None
ANP  A 302 (-3.3A)
None
None
 0.98A 6mhtA-5cb6A:
undetectable		 6mhtA-5cb6A:
19.75
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.
5ci7 SERINE/THREONINE-PRO
TEIN KINASE ULK1

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 167
LEU A  59
GLY A  61
ASP A 138
ILE A  75
 None
 1.08A 6mhtA-5ci7A:
undetectable		 6mhtA-5ci7A:
17.85
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 PHE A 187
GLY A 189
GLY A 192
ASP A 235
SER A 164
 SAM  A 400 (-4.7A)
SAM  A 400 (-3.3A)
SAM  A 400 (-3.7A)
SAM  A 400 (-3.4A)
SAM  A 400 ( 4.3A)
 0.90A 6mhtA-5e72A:
8.8		 6mhtA-5e72A:
23.75
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.
5gpr CHITINASE

(Ostrinia
furnacalis) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 GLY A 438
GLY A 468
ASP A 509
ASP A 540
VAL A 461
 GLY  A 438 ( 0.0A)
GLY  A 468 ( 0.0A)
ASP  A 509 ( 0.6A)
ASP  A 540 ( 0.5A)
VAL  A 461 ( 0.6A)
 1.09A 6mhtA-5gprA:
undetectable		 6mhtA-5gprA:
20.46
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.
5gut DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH) 		6 PHE A1148
GLY A1150
GLY A1153
ASP A1193
ASN A1580
VAL A1582
 SAH  A1701 (-4.8A)
SAH  A1701 (-3.5A)
SAH  A1701 (-3.3A)
SAH  A1701 (-3.7A)
SAH  A1701 (-3.9A)
SAH  A1701 (-4.0A)
 0.90A 6mhtA-5gutA:
24.7		 6mhtA-5gutA:
17.67
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.
5h68 CHROMOSOME PARTITION
PROTEIN SMC

(Geobacillus
stearothermophilus) 		PF02463
(SMC_N) 		5 GLY A 134
LEU A  48
GLY A  49
ILE A 160
VAL A 125
 None
 1.07A 6mhtA-5h68A:
undetectable		 6mhtA-5h68A:
21.09
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.
5ju6 BETA-GLUCOSIDASE

(Rasamsonia
emersonii) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLY A 149
LEU A 148
GLY A 146
ASP A 628
VAL A 144
 None
 1.08A 6mhtA-5ju6A:
3.1		 6mhtA-5ju6A:
16.72
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
2, MITOCHONDRIAL

(Bos taurus) 		PF00346
(Complex1_49kDa) 		5 GLY D 291
GLY D 264
ASP D 241
ASP D 413
ILE D 417
 None
 1.03A 6mhtA-5lc5D:
undetectable		 6mhtA-5lc5D:
21.89
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.
5m0o TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE

(Jeotgalicoccus
sp. ATCC 8456) 		PF00067
(p450) 		5 LEU A  22
GLY A  20
TRP A 330
ASP A 350
ILE A 352
 None
 0.96A 6mhtA-5m0oA:
undetectable		 6mhtA-5m0oA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mqc VP1
VP2

(Black queen
cell virus;
Black queen
cell virus) 		PF08762
(CRPV_capsid)
PF00073
(Rhv) 		5 PHE B 133
GLY B 131
LEU B 130
GLY B 196
ILE A 226
 None
 1.07A 6mhtA-5mqcB:
undetectable		 6mhtA-5mqcB:
21.45
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.
5nfg PROCARDOSIN-B,PROCAR
DOSIN-B

(Cynara
cardunculus) 		no annotation 5 PHE A 313
GLY A 246
GLY A 316
ILE A 311
VAL A 233
 None
 1.05A 6mhtA-5nfgA:
undetectable		 6mhtA-5nfgA:
22.74
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.
5nv5 FIC FAMILY PROTEIN

(Enterococcus
faecalis) 		no annotation 5 LEU A  60
GLY A 123
ASN A  11
ASP A  63
ASN A  58
 None
 1.07A 6mhtA-5nv5A:
undetectable		 6mhtA-5nv5A:
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.
5swj PROBABLE ATP
SYNTHASE SPAL/MXIB

(Shigella
flexneri) 		PF00006
(ATP-synt_ab) 		5 GLY A 150
ASP A 249
ILE A 248
SER A 349
VAL A 351
 None
 1.12A 6mhtA-5swjA:
undetectable		 6mhtA-5swjA:
22.11
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.
5tum TETRACYCLINE
DESTRUCTASE TET(56)

(Legionella
longbeachae) 		PF01494
(FAD_binding_3) 		5 LEU A 304
GLY A 308
ASP A 107
ILE A 111
VAL A 287
 None
 1.12A 6mhtA-5tumA:
2.9		 6mhtA-5tumA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v38 HCHA

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		5 PHE A1047
GLY A 893
ASP A1050
ILE A1045
SER A 907
 ACY  A1302 (-3.8A)
None
None
None
None
 0.87A 6mhtA-5v38A:
undetectable		 6mhtA-5v38A:
25.00
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.
5vpu 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Acinetobacter
baumannii) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 LEU A 121
GLY A 120
ASP A 264
ILE A 302
SER A 129
 None
None
3PG  A 603 ( 4.9A)
None
None
 1.13A 6mhtA-5vpuA:
undetectable		 6mhtA-5vpuA:
20.97
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.
5x4s SPIKE GLYCOPROTEIN

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF16451
(Spike_NTD) 		5 PHE A 253
GLY A 255
ASP A  77
ASN A  65
SER A  64
 None
 1.02A 6mhtA-5x4sA:
undetectable		 6mhtA-5x4sA:
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.
5xcy GLUCANASE

(Phanerochaete
chrysosporium) 		PF01341
(Glyco_hydro_6) 		5 GLY A 178
ASP A 170
ILE A 182
SER A 132
VAL A 133
 None
 1.02A 6mhtA-5xcyA:
undetectable		 6mhtA-5xcyA:
21.63
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.
6f42 DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC1
DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC2

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		no annotation
no annotation 		5 GLY B 764
GLY A 706
ILE B 925
ASN B 945
SER B 761
 None
 1.07A 6mhtA-6f42B:
undetectable		 6mhtA-6f42B:
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.
6fdf TRNA
(CYTOSINE(38)-C(5))-
METHYLTRANSFERASE

(Schizosaccharomyces
pombe) 		no annotation 5 GLY A  15
GLY A  18
ASP A  58
ASN A 310
SER A 311
 SAH  A 401 (-3.4A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.8A)
None
SAH  A 401 (-2.8A)
 0.44A 6mhtA-6fdfA:
26.9		 6mhtA-6fdfA:
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.
6fdf TRNA
(CYTOSINE(38)-C(5))-
METHYLTRANSFERASE

(Schizosaccharomyces
pombe) 		no annotation 5 GLY A  15
GLY A  18
ASP A  58
ILE A  59
ASN A 310
 SAH  A 401 (-3.4A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.8A)
SAH  A 401 (-3.7A)
None
 0.73A 6mhtA-6fdfA:
26.9		 6mhtA-6fdfA:
undetectable