SIMILAR PATTERNS OF AMINO ACIDS FOR 1MJQ_B_SAMB200_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.
1akm ORNITHINE
TRANSCARBAMYLASE

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 GLY A 180
GLU A 174
LEU A 197
GLU A 200
LEU A 204
 None
 1.19A 1mjqA-1akmA:
undetectable
1mjqB-1akmA:
undetectable		 1mjqA-1akmA:
15.02
1mjqB-1akmA:
15.02
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.
1brw PROTEIN (PYRIMIDINE
NUCLEOSIDE
PHOSPHORYLASE)

(Geobacillus
stearothermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 GLU A 297
ARG A 293
LEU A 273
GLU A 270
HIS A 266
 None
 0.77A 1mjqA-1brwA:
undetectable
1mjqB-1brwA:
undetectable		 1mjqA-1brwA:
15.40
1mjqB-1brwA:
15.40
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.
1e1k ADRENODOXIN
REDUCTASE

(Bos taurus) 		PF07992
(Pyr_redox_2) 		5 HIS A 460
GLU A 433
ARG A 437
LEU A 448
GLU A 453
 None
 1.45A 1mjqA-1e1kA:
undetectable
1mjqB-1e1kA:
undetectable		 1mjqA-1e1kA:
11.83
1mjqB-1e1kA:
11.83
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.
1eqw CU,ZN SUPEROXIDE
DISMUTASE

(Salmonella
enterica) 		PF00080
(Sod_Cu) 		5 HIS A 118
GLY A 138
LEU A  97
HIS A  44
PRO A  72
 CU  A 502 (-3.1A)
None
None
CU  A 502 (-3.3A)
None
 1.27A 1mjqA-1eqwA:
undetectable
1mjqB-1eqwA:
undetectable		 1mjqA-1eqwA:
20.41
1mjqB-1eqwA:
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.
1ge7 PEPTIDYL-LYS
METALLOENDOPEPTIDASE

(Grifola
frondosa) 		PF14521
(Aspzincin_M35) 		5 HIS A  59
GLY A 126
GLU A 118
GLU A 157
HIS A 156
 None
None
ZN  A 200 ( 4.2A)
None
None
 1.05A 1mjqA-1ge7A:
undetectable
1mjqB-1ge7A:
undetectable		 1mjqA-1ge7A:
20.00
1mjqB-1ge7A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h3g CYCLOMALTODEXTRINASE

(Flavobacterium
sp. 92) 		PF00128
(Alpha-amylase)
PF09087
(Cyc-maltodext_N)
PF10438
(Cyc-maltodext_C) 		5 GLU A 341
GLY A 314
LEU A 328
LEU A 366
PRO A 367
 None
 1.22A 1mjqA-1h3gA:
undetectable
1mjqB-1h3gA:
undetectable		 1mjqA-1h3gA:
10.50
1mjqB-1h3gA:
10.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mjl METHIONINE REPRESSOR
PROTEIN METJ

(Escherichia
coli) 		PF01340
(MetJ) 		7 GLU A  39
ARG A  43
LEU A  56
GLU A  59
HIS A  63
LEU A  70
PRO A  71
 None
None
None
None
SAM  A 200 ( 2.9A)
None
None
 0.28A 1mjqA-1mjlA:
14.0
1mjqB-1mjlA:
15.4		 1mjqA-1mjlA:
100.00
1mjqB-1mjlA:
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.
1r76 PECTATE LYASE

(Niveispirillum
irakense) 		PF09492
(Pec_lyase) 		5 GLY A  77
ARG A 135
LEU A  70
GLU A  73
PRO A 137
 None
 1.40A 1mjqA-1r76A:
undetectable
1mjqB-1r76A:
undetectable		 1mjqA-1r76A:
12.25
1mjqB-1r76A:
12.25
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.
1sdd COAGULATION FACTOR V
COAGULATION FACTOR V

(Bos taurus;
Bos taurus) 		PF07732
(Cu-oxidase_3)
PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3) 		5 GLU B1846
HIS A  85
HIS B1804
LEU B1842
PRO B1858
 CU  B2190 ( 4.9A)
None
CU  B2190 (-3.7A)
None
None
 1.08A 1mjqA-1sddB:
undetectable
1mjqB-1sddB:
undetectable		 1mjqA-1sddB:
10.24
1mjqB-1sddB:
10.24
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.
1uio ADENOSINE DEAMINASE

(Mus musculus) 		PF00962
(A_deaminase) 		5 GLU A 260
HIS A 214
GLY A 237
HIS A  17
PRO A 297
 None
ZN  A 400 ( 3.3A)
None
HPR  A 353 ( 3.1A)
None
 1.47A 1mjqA-1uioA:
undetectable
1mjqB-1uioA:
undetectable		 1mjqA-1uioA:
15.03
1mjqB-1uioA:
15.03
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.
1xpg 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 GLU A 200
GLY A 149
LEU A 188
LEU A 227
PRO A 226
 None
 1.14A 1mjqA-1xpgA:
undetectable
1mjqB-1xpgA:
undetectable		 1mjqA-1xpgA:
11.29
1mjqB-1xpgA:
11.29
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.
1yb3 HYPOTHETICAL PROTEIN

(Pyrococcus
furiosus) 		PF11447
(DUF3201) 		5 GLU A 134
PHE A 139
GLY A 105
LEU A 166
GLU A  85
 None
 1.43A 1mjqA-1yb3A:
undetectable
1mjqB-1yb3A:
undetectable		 1mjqA-1yb3A:
20.22
1mjqB-1yb3A:
20.22
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.
1yem CONSERVED
HYPOTHETICAL PROTEIN
PFU-838710-001

(Pyrococcus
furiosus) 		PF01928
(CYTH) 		5 GLU A   2
GLU A 161
ARG A 157
LEU A 162
GLU A 155
 None
 1.48A 1mjqA-1yemA:
undetectable
1mjqB-1yemA:
undetectable		 1mjqA-1yemA:
20.57
1mjqB-1yemA:
20.57
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.
1z5a TYPE II DNA
TOPOISOMERASE VI
SUBUNIT B

(Sulfolobus
shibatae) 		PF02518
(HATPase_c)
PF05833
(FbpA)
PF09239
(Topo-VIb_trans) 		5 GLY A 318
ARG A 193
LEU A 371
HIS A 414
PRO A 378
 None
 1.31A 1mjqA-1z5aA:
undetectable
1mjqB-1z5aA:
undetectable		 1mjqA-1z5aA:
13.50
1mjqB-1z5aA:
13.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2amx ADENOSINE DEAMINASE

(Plasmodium
yoelii) 		PF00962
(A_deaminase) 		5 GLU A 288
HIS A 239
GLY A 265
HIS A  57
PRO A 325
 None
CO  A1000 (-3.4A)
None
CO  A1000 (-3.2A)
None
 1.47A 1mjqA-2amxA:
undetectable
1mjqB-2amxA:
undetectable		 1mjqA-2amxA:
15.69
1mjqB-2amxA:
15.69
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.
2b24 NAPHTHALENE
DIOXYGENASE SMALL
SUBUNIT

(Rhodococcus sp.
NCIMB 12038) 		PF00866
(Ring_hydroxyl_B) 		5 GLU B 529
GLU B 589
LEU B 586
GLU B 582
LEU B 542
 None
 1.40A 1mjqA-2b24B:
undetectable
1mjqB-2b24B:
undetectable		 1mjqA-2b24B:
21.39
1mjqB-2b24B:
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.
2bf4 NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		5 GLU A 120
GLY A 121
GLU A 184
LEU A 182
GLU A 168
 None
 1.40A 1mjqA-2bf4A:
undetectable
1mjqB-2bf4A:
undetectable		 1mjqA-2bf4A:
10.63
1mjqB-2bf4A:
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.
2ghs AGR_C_1268P

(Agrobacterium
fabrum) 		PF08450
(SGL) 		5 GLU A 238
GLY A 239
GLU A  40
LEU A  38
GLU A 281
 None
None
EDO  A 317 (-3.9A)
None
None
 1.16A 1mjqA-2ghsA:
undetectable
1mjqB-2ghsA:
undetectable		 1mjqA-2ghsA:
16.13
1mjqB-2ghsA:
16.13
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.
2ghs AGR_C_1268P

(Agrobacterium
fabrum) 		PF08450
(SGL) 		5 GLY A 237
GLU A 281
LEU A  37
HIS A 294
LEU A 283
 None
 1.24A 1mjqA-2ghsA:
undetectable
1mjqB-2ghsA:
undetectable		 1mjqA-2ghsA:
16.13
1mjqB-2ghsA:
16.13
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.
2gou OXIDOREDUCTASE,
FMN-BINDING

(Shewanella
oneidensis) 		PF00724
(Oxidored_FMN) 		5 GLY A 322
ARG A  29
LEU A 357
HIS A 344
LEU A 349
 FMN  A4401 (-3.4A)
None
None
None
FMN  A4401 ( 3.8A)
 1.04A 1mjqA-2gouA:
undetectable
1mjqB-2gouA:
undetectable		 1mjqA-2gouA:
14.25
1mjqB-2gouA:
14.25
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.
2ie8 PHOSPHOGLYCERATE
KINASE

(Thermus
caldophilus) 		PF00162
(PGK) 		5 GLU A  75
GLY A  74
GLU A  99
LEU A 103
GLU A 107
 None
 1.37A 1mjqA-2ie8A:
undetectable
1mjqB-2ie8A:
undetectable		 1mjqA-2ie8A:
15.12
1mjqB-2ie8A:
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.
2krk 26S PROTEASE
REGULATORY SUBUNIT 8

(Homo sapiens) 		no annotation 5 HIS A  10
GLY A  44
ARG A  36
LEU A  17
GLU A  14
 None
 1.45A 1mjqA-2krkA:
undetectable
1mjqB-2krkA:
undetectable		 1mjqA-2krkA:
20.91
1mjqB-2krkA:
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.
2liw CURA

(Lyngbya
majuscula) 		PF00550
(PP-binding) 		5 GLU A1994
PHE A1982
GLY A1992
GLU A1975
LEU A1969
 None
 1.46A 1mjqA-2liwA:
undetectable
1mjqB-2liwA:
undetectable		 1mjqA-2liwA:
25.22
1mjqB-2liwA:
25.22
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.
2peb PUTATIVE DIOXYGENASE

(Nostoc
punctiforme) 		PF08883
(DOPA_dioxygen) 		5 HIS A  51
GLY A  49
GLU A 110
HIS A  94
LEU A 112
 UNL  A 201 (-4.0A)
None
None
UNL  A 201 (-3.9A)
None
 1.38A 1mjqA-2pebA:
undetectable
1mjqB-2pebA:
undetectable		 1mjqA-2pebA:
17.19
1mjqB-2pebA:
17.19
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.
2w3n CARBONIC ANHYDRASE 2

(Cryptococcus
neoformans) 		PF00484
(Pro_CA) 		5 GLU A 141
GLU A 154
HIS A 161
LEU A 138
PRO A 139
 None
 1.45A 1mjqA-2w3nA:
undetectable
1mjqB-2w3nA:
undetectable		 1mjqA-2w3nA:
20.35
1mjqB-2w3nA:
20.35
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.
2x0q ALCALIGIN
BIOSYNTHESIS PROTEIN

(Bordetella
bronchiseptica) 		PF04183
(IucA_IucC)
PF06276
(FhuF) 		5 HIS A 514
PHE A 512
GLY A 510
LEU A 519
HIS A  79
 None
 1.44A 1mjqA-2x0qA:
undetectable
1mjqB-2x0qA:
undetectable		 1mjqA-2x0qA:
11.84
1mjqB-2x0qA:
11.84
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.
2x60 MANNOSE-1-PHOSPHATE
GUANYLYLTRANSFERASE

(Thermotoga
maritima) 		PF00483
(NTP_transferase) 		5 GLU A  47
ARG A  38
LEU A  69
GLU A  71
LEU A  45
 None
 1.31A 1mjqA-2x60A:
undetectable
1mjqB-2x60A:
undetectable		 1mjqA-2x60A:
15.92
1mjqB-2x60A:
15.92
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.
2y3a PHOSPHATIDYLINOSITOL
-4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT BETA ISOFORM

(Mus musculus) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B) 		5 GLY A 619
GLU A 599
GLU A 602
LEU A 603
PRO A 568
 None
 1.31A 1mjqA-2y3aA:
undetectable
1mjqB-2y3aA:
undetectable		 1mjqA-2y3aA:
7.52
1mjqB-2y3aA:
7.52
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.
2yp2 HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 PHE A  87
GLY A 116
GLU A  89
ARG A 269
GLU A 396
 None
 1.18A 1mjqA-2yp2A:
undetectable
1mjqB-2yp2A:
undetectable		 1mjqA-2yp2A:
11.02
1mjqB-2yp2A:
11.02
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.
3aeu LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Rhodobacter
capsulatus) 		PF00148
(Oxidored_nitro) 		5 HIS A 330
PHE A 225
GLU A 154
LEU A 158
LEU A 221
 None
 1.32A 1mjqA-3aeuA:
undetectable
1mjqB-3aeuA:
undetectable		 1mjqA-3aeuA:
14.11
1mjqB-3aeuA:
14.11
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.
3aw8 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Thermus
thermophilus) 		PF02222
(ATP-grasp) 		5 GLU A 172
GLY A 173
GLU A 253
LEU A 255
PRO A 110
 AMP  A 370 (-4.4A)
None
None
None
None
 1.36A 1mjqA-3aw8A:
undetectable
1mjqB-3aw8A:
undetectable		 1mjqA-3aw8A:
14.16
1mjqB-3aw8A:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bru REGULATORY PROTEIN,
TETR FAMILY

(Rhodobacter
sphaeroides) 		PF00440
(TetR_N)
PF16925
(TetR_C_13) 		5 HIS A 212
GLY A 210
LEU A 159
HIS A 173
LEU A 169
 None
 1.41A 1mjqA-3bruA:
1.2
1mjqB-3bruA:
undetectable		 1mjqA-3bruA:
25.42
1mjqB-3bruA:
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.
3bxw CHITINASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		no annotation 5 GLY B 363
ARG B  26
LEU B  28
GLU B  41
HIS B  42
 None
 1.41A 1mjqA-3bxwB:
undetectable
1mjqB-3bxwB:
undetectable		 1mjqA-3bxwB:
14.51
1mjqB-3bxwB:
14.51
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.
3byr CZRB PROTEIN

(Thermus
thermophilus) 		PF16916
(ZT_dimer) 		5 GLU A  67
PHE A  43
ARG A  37
GLU A  11
LEU A  77
 None
 1.18A 1mjqA-3byrA:
undetectable
1mjqB-3byrA:
undetectable		 1mjqA-3byrA:
28.07
1mjqB-3byrA:
28.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cvw RE11660P

(Drosophila
melanogaster) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 GLU A 108
GLY A  15
LEU A  78
HIS A  10
LEU A  24
 None
 1.26A 1mjqA-3cvwA:
undetectable
1mjqB-3cvwA:
undetectable		 1mjqA-3cvwA:
11.99
1mjqB-3cvwA:
11.99
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.
3dcp HISTIDINOL-PHOSPHATA
SE

(Listeria
monocytogenes) 		PF02811
(PHP)
PF13263
(PHP_C) 		5 HIS A 123
PHE A 136
GLU A  56
HIS A  40
PRO A  13
 FE  A 310 (-3.3A)
None
None
ZN  A 301 (-3.5A)
None
 0.89A 1mjqA-3dcpA:
undetectable
1mjqB-3dcpA:
undetectable		 1mjqA-3dcpA:
16.86
1mjqB-3dcpA:
16.86
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.
3dmy PROTEIN FDRA

(Escherichia
coli) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 GLY A 182
LEU A 169
HIS A 222
LEU A 508
PRO A 505
 None
 1.46A 1mjqA-3dmyA:
undetectable
1mjqB-3dmyA:
undetectable		 1mjqA-3dmyA:
13.02
1mjqB-3dmyA:
13.02
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.
3dy5 ALLENE OXIDE
SYNTHASE-LIPOXYGENAS
E PROTEIN

(Plexaura
homomalla) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 GLU A1019
PHE A 486
GLY A 488
GLU A 508
ARG A 512
 None
 1.40A 1mjqA-3dy5A:
undetectable
1mjqB-3dy5A:
undetectable		 1mjqA-3dy5A:
7.13
1mjqB-3dy5A:
7.13
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.
3ewd ADENOSINE DEAMINASE

(Plasmodium
vivax) 		PF00962
(A_deaminase) 		5 GLU A 274
HIS A 225
GLY A 251
HIS A  44
PRO A 311
 None
ZN  A 371 ( 3.4A)
None
MCF  A 372 ( 3.3A)
None
 1.47A 1mjqA-3ewdA:
undetectable
1mjqB-3ewdA:
undetectable		 1mjqA-3ewdA:
14.40
1mjqB-3ewdA:
14.40
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.
3fjo NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		5 GLU A 120
GLY A 121
GLU A 184
LEU A 182
GLU A 168
 None
 1.35A 1mjqA-3fjoA:
undetectable
1mjqB-3fjoA:
undetectable		 1mjqA-3fjoA:
11.25
1mjqB-3fjoA:
11.25
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.
3gkb PUTATIVE ENOYL-COA
HYDRATASE

(Streptomyces
avermitilis) 		PF00378
(ECH_1) 		5 GLU A 234
GLY A 150
ARG A  39
LEU A  82
PRO A  87
 None
 1.47A 1mjqA-3gkbA:
undetectable
1mjqB-3gkbA:
undetectable		 1mjqA-3gkbA:
16.37
1mjqB-3gkbA:
16.37
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.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT BETA

(Moorella
thermoacetica) 		PF03063
(Prismane) 		5 GLU A 533
GLY A 534
LEU A 436
LEU A 541
PRO A 542
 None
 1.42A 1mjqA-3i04A:
undetectable
1mjqB-3i04A:
undetectable		 1mjqA-3i04A:
10.24
1mjqB-3i04A:
10.24
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.
3j9e VP5

(Bluetongue
virus) 		PF00901
(Orbi_VP5) 		5 GLU D 427
ARG D 423
GLU D 405
HIS D 380
LEU D 407
 None
 1.43A 1mjqA-3j9eD:
0.9
1mjqB-3j9eD:
undetectable		 1mjqA-3j9eD:
13.66
1mjqB-3j9eD:
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.
3l84 TRANSKETOLASE

(Campylobacter
jejuni) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLU A 291
PHE A  75
GLY A  80
LEU A  71
HIS A  77
 GOL  A2002 (-2.6A)
None
GOL  A2002 ( 4.1A)
None
GOL  A2002 (-4.4A)
 1.32A 1mjqA-3l84A:
undetectable
1mjqB-3l84A:
undetectable		 1mjqA-3l84A:
10.19
1mjqB-3l84A:
10.19
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.
3lj0 SERINE/THREONINE-PRO
TEIN
KINASE/ENDORIBONUCLE
ASE IRE1

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase)
PF06479
(Ribonuc_2-5A) 		5 HIS A 725
GLY A 784
LEU A 718
GLU A 721
LEU A 791
 None
 1.28A 1mjqA-3lj0A:
undetectable
1mjqB-3lj0A:
undetectable		 1mjqA-3lj0A:
13.23
1mjqB-3lj0A:
13.23
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.
3loq UNIVERSAL STRESS
PROTEIN

(Archaeoglobus
fulgidus) 		PF00582
(Usp) 		5 GLU A  27
PHE A  -4
GLY A  25
ARG A 161
LEU A  -6
 None
 1.40A 1mjqA-3loqA:
undetectable
1mjqB-3loqA:
undetectable		 1mjqA-3loqA:
20.55
1mjqB-3loqA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n0u PROBABLE
N-GLYCOSYLASE/DNA
LYASE

(Thermotoga
maritima) 		no annotation 5 GLY A  64
GLU A  74
HIS A  69
LEU A  70
PRO A  71
 None
 1.43A 1mjqA-3n0uA:
undetectable
1mjqB-3n0uA:
undetectable		 1mjqA-3n0uA:
21.33
1mjqB-3n0uA:
21.33
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.
3pbk FATTY ACYL-ADENYLATE
LIGASE

(Escherichia
coli) 		PF00501
(AMP-binding) 		5 GLY A 489
ARG A 514
LEU A 518
GLU A 483
PRO A 484
 None
 1.47A 1mjqA-3pbkA:
undetectable
1mjqB-3pbkA:
undetectable		 1mjqA-3pbkA:
13.59
1mjqB-3pbkA:
13.59
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.
3pie 5'->3'
EXORIBONUCLEASE
(XRN1)

(Kluyveromyces
lactis) 		PF03159
(XRN_N) 		5 GLU A 370
ARG A  13
LEU A 750
LEU A 364
PRO A 307
 None
 1.40A 1mjqA-3pieA:
1.4
1mjqB-3pieA:
1.0		 1mjqA-3pieA:
7.44
1mjqB-3pieA:
7.44
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.
3qde CELLOBIOSE
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 PHE A 627
GLY A 643
ARG A 564
LEU A 485
LEU A 622
 None
 1.48A 1mjqA-3qdeA:
0.0
1mjqB-3qdeA:
undetectable		 1mjqA-3qdeA:
9.46
1mjqB-3qdeA:
9.46
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.
3rac HISTIDINE-TRNA
LIGASE

(Alicyclobacillus
acidocaldarius) 		PF13393
(tRNA-synt_His) 		5 GLU A 354
GLU A 307
LEU A 308
GLU A  95
PRO A  94
 GOL  A 371 ( 4.8A)
None
None
LMR  A 401 (-3.4A)
None
 1.39A 1mjqA-3racA:
undetectable
1mjqB-3racA:
undetectable		 1mjqA-3racA:
13.48
1mjqB-3racA:
13.48
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.
3s51 FANCONI ANEMIA GROUP
I PROTEIN HOMOLOG

(Mus musculus) 		PF14674
(FANCI_S1-cap)
PF14675
(FANCI_S1)
PF14676
(FANCI_S2)
PF14677
(FANCI_S3)
PF14678
(FANCI_S4)
PF14679
(FANCI_HD1)
PF14680
(FANCI_HD2) 		5 GLU A 909
PHE A 915
GLY A 910
ARG A 990
LEU A 919
 None
 1.28A 1mjqA-3s51A:
undetectable
1mjqB-3s51A:
undetectable		 1mjqA-3s51A:
6.57
1mjqB-3s51A:
6.57
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.
3sdo NITRILOTRIACETATE
MONOOXYGENASE

(Burkholderia
pseudomallei) 		PF00296
(Bac_luciferase) 		5 GLU A 279
GLY A 274
ARG A  41
LEU A 401
HIS A 407
 None
 1.35A 1mjqA-3sdoA:
0.7
1mjqB-3sdoA:
undetectable		 1mjqA-3sdoA:
15.66
1mjqB-3sdoA:
15.66
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.
3twk FORMAMIDOPYRIMIDINE-
DNA GLYCOSYLASE 1

(Arabidopsis
thaliana) 		PF01149
(Fapy_DNA_glyco)
PF06831
(H2TH) 		5 HIS A  36
PHE A  43
GLY A  37
LEU A 134
PRO A 137
 None
 1.39A 1mjqA-3twkA:
undetectable
1mjqB-3twkA:
undetectable		 1mjqA-3twkA:
18.73
1mjqB-3twkA:
18.73
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.
3txx PUTRESCINE
CARBAMOYLTRANSFERASE

(Enterococcus
faecalis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 GLU A  71
PHE A  59
GLY A  70
LEU A 304
PRO A 120
 None
 1.22A 1mjqA-3txxA:
0.5
1mjqB-3txxA:
0.6		 1mjqA-3txxA:
14.48
1mjqB-3txxA:
14.48
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.
3unv ADMH

(Pantoea
agglomerans) 		PF00221
(Lyase_aromatic) 		5 GLU A 276
GLY A 273
ARG A 395
LEU A 391
LEU A 244
 None
 1.20A 1mjqA-3unvA:
undetectable
1mjqB-3unvA:
undetectable		 1mjqA-3unvA:
12.39
1mjqB-3unvA:
12.39
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.
3vex O-CARBAMOYLTRANSFERA
SE TOBZ

(Streptoalloteichus
tenebrarius) 		PF02543
(Carbam_trans_N)
PF16861
(Carbam_trans_C) 		5 GLY A 407
GLU A 393
GLU A 395
LEU A 563
PRO A 389
 None
 1.42A 1mjqA-3vexA:
undetectable
1mjqB-3vexA:
undetectable		 1mjqA-3vexA:
11.99
1mjqB-3vexA:
11.99
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.
3vi1 ALKALINE
METALLOPROTEINASE

(Pseudomonas
aeruginosa) 		PF08548
(Peptidase_M10_C)
PF13583
(Reprolysin_4) 		5 HIS A 186
LEU A  40
HIS A 180
LEU A 139
PRO A 140
 ZN  A 500 (-3.2A)
None
ZN  A 500 (-3.3A)
None
None
 1.46A 1mjqA-3vi1A:
undetectable
1mjqB-3vi1A:
undetectable		 1mjqA-3vi1A:
11.55
1mjqB-3vi1A:
11.55
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.
3w53 BETA-GLUCOSIDASE

(Micrococcus
antarcticus) 		PF00232
(Glyco_hydro_1) 		5 GLY A 206
GLU A 214
LEU A 215
GLU A 152
LEU A 148
 None
 1.39A 1mjqA-3w53A:
undetectable
1mjqB-3w53A:
undetectable		 1mjqA-3w53A:
12.69
1mjqB-3w53A:
12.69
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.
3w9v PHOSPHATE-BINDING
PROTEIN

(unidentified
prokaryotic
organism) 		PF12849
(PBP_like_2) 		5 GLU A 142
GLY A  31
GLU A  68
LEU A  40
GLU A  41
 None
PO4  A 401 (-3.5A)
None
None
None
 1.33A 1mjqA-3w9vA:
undetectable
1mjqB-3w9vA:
undetectable		 1mjqA-3w9vA:
13.00
1mjqB-3w9vA:
13.00
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.
3whe HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 PHE A  87
GLY A 116
GLU A  89
ARG A 269
GLU A 396
 None
 1.17A 1mjqA-3wheA:
undetectable
1mjqB-3wheA:
undetectable		 1mjqA-3wheA:
12.03
1mjqB-3wheA:
12.03
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.
3wqy ALANINE--TRNA LIGASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF02272
(DHHA1)
PF07973
(tRNA_SAD) 		5 GLY A 615
ARG A 418
LEU A 414
GLU A 415
PRO A 357
 None
 1.37A 1mjqA-3wqyA:
undetectable
1mjqB-3wqyA:
undetectable		 1mjqA-3wqyA:
8.01
1mjqB-3wqyA:
8.01
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.
3zwf ZINC
PHOSPHODIESTERASE
ELAC PROTEIN 1

(Homo sapiens) 		PF00753
(Lactamase_B)
PF12706
(Lactamase_B_2) 		5 GLU A 275
HIS A  67
LEU A 123
HIS A  62
PRO A 185
 None
ZN  A1363 (-3.4A)
None
ZN  A1364 (-3.5A)
None
 1.45A 1mjqA-3zwfA:
undetectable
1mjqB-3zwfA:
undetectable		 1mjqA-3zwfA:
13.20
1mjqB-3zwfA:
13.20
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.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		5 GLU A  37
PHE A  40
GLY A  35
ARG A 299
LEU A 335
 None
 1.48A 1mjqA-4c9mA:
undetectable
1mjqB-4c9mA:
undetectable		 1mjqA-4c9mA:
12.77
1mjqB-4c9mA:
12.77
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.
4glf RSFP

(uncultured
bacterium) 		PF01048
(PNP_UDP_1) 		5 GLY A  23
ARG A  34
LEU A  51
GLU A  53
LEU A  30
 None
 1.28A 1mjqA-4glfA:
undetectable
1mjqB-4glfA:
undetectable		 1mjqA-4glfA:
16.49
1mjqB-4glfA:
16.49
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.
4hh8 BUTYROPHILIN
SUBFAMILY 1 MEMBER
A1

(Bos taurus) 		PF07686
(V-set)
PF08205
(C2-set_2) 		5 PHE A  99
GLU A  36
ARG A  52
LEU A  50
GLU A  60
 None
 1.12A 1mjqA-4hh8A:
undetectable
1mjqB-4hh8A:
undetectable		 1mjqA-4hh8A:
18.26
1mjqB-4hh8A:
18.26
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.
4hvt POST-PROLINE
CLEAVING ENZYME

(Rickettsia
typhi) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 GLY A 151
GLU A  31
LEU A  36
GLU A 676
PRO A 654
 None
 1.40A 1mjqA-4hvtA:
undetectable
1mjqB-4hvtA:
undetectable		 1mjqA-4hvtA:
8.93
1mjqB-4hvtA:
8.93
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.
4joi CST COMPLEX SUBUNIT
TEN1

(Homo sapiens) 		no annotation 5 GLU D  78
GLY D  77
ARG D 113
LEU D  11
GLU D  14
 None
 1.45A 1mjqA-4joiD:
undetectable
1mjqB-4joiD:
undetectable		 1mjqA-4joiD:
22.50
1mjqB-4joiD:
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		5 HIS A 415
GLY A 414
GLU A 505
LEU A 419
HIS A 464
 ZN  A 801 (-3.2A)
None
None
None
ZN  A 801 (-3.3A)
 1.45A 1mjqA-4ojzA:
undetectable
1mjqB-4ojzA:
undetectable		 1mjqA-4ojzA:
9.36
1mjqB-4ojzA:
9.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oo2 CHLOROPHENOL-4-MONOO
XYGENASE

(Streptomyces
globisporus) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		5 GLU A 266
HIS A 458
LEU A 323
LEU A 260
PRO A 259
 None
 1.46A 1mjqA-4oo2A:
undetectable
1mjqB-4oo2A:
undetectable		 1mjqA-4oo2A:
12.24
1mjqB-4oo2A:
12.24
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.
4r81 NADH DEHYDROGENASE

(Methanothermobacter
marburgensis) 		PF02525
(Flavodoxin_2) 		5 GLY A 108
ARG A 103
GLU A  52
LEU A  65
PRO A  66
 None
 1.30A 1mjqA-4r81A:
undetectable
1mjqB-4r81A:
undetectable		 1mjqA-4r81A:
18.18
1mjqB-4r81A:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u8h CRYPTOCHROME-2

(Mus musculus) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		5 GLU A 401
GLY A  66
GLU A 215
LEU A 216
PRO A  57
 None
 1.42A 1mjqA-4u8hA:
undetectable
1mjqB-4u8hA:
undetectable		 1mjqA-4u8hA:
12.08
1mjqB-4u8hA:
12.08
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.
4x2d FIC FAMILY PROTEIN
PUTATIVE
FILAMENTATION
INDUCED BY CAMP
PROTEIN

(Clostridioides
difficile) 		PF02661
(Fic) 		5 PHE A 165
ARG A 171
LEU A  95
GLU A  64
LEU A 101
 None
ATP  A 302 (-4.0A)
None
None
None
 1.43A 1mjqA-4x2dA:
undetectable
1mjqB-4x2dA:
undetectable		 1mjqA-4x2dA:
15.51
1mjqB-4x2dA:
15.51
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.
4x4j PUTATIVE OXYGENASE

(Amycolatopsis
orientalis) 		PF01494
(FAD_binding_3) 		5 GLY A 108
GLU A  32
GLU A 100
LEU A  15
PRO A  12
 None
FAD  A 503 (-2.5A)
FAD  A 503 ( 4.9A)
None
FAD  A 503 (-3.9A)
 1.31A 1mjqA-4x4jA:
undetectable
1mjqB-4x4jA:
undetectable		 1mjqA-4x4jA:
10.54
1mjqB-4x4jA:
10.54
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.
4xac EVDO2

(Micromonospora
carbonacea) 		PF05721
(PhyH) 		5 GLU A  79
GLY A 113
ARG A  93
GLU A  34
PRO A  89
 None
 1.28A 1mjqA-4xacA:
undetectable
1mjqB-4xacA:
undetectable		 1mjqA-4xacA:
18.07
1mjqB-4xacA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xyd NITRIC-OXIDE
REDUCTASE SUBUNIT B
NORC-LIKE PROTEIN

(Roseobacter
denitrificans;
Roseobacter
denitrificans) 		PF00115
(COX1)
PF00034
(Cytochrom_C) 		5 GLU A 119
GLY A 120
LEU B 121
GLU B 125
HIS B  55
 None
 1.21A 1mjqA-4xydA:
undetectable
1mjqB-4xydA:
undetectable		 1mjqA-4xydA:
12.72
1mjqB-4xydA:
12.72
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.
4zu9 ELONGATION FACTOR
SELB

(Aquifex
aeolicus) 		PF00009
(GTP_EFTU)
PF09107
(SelB-wing_3) 		5 HIS A  14
GLY A  91
GLU A 140
LEU A 100
HIS A  11
 None
 1.46A 1mjqA-4zu9A:
undetectable
1mjqB-4zu9A:
undetectable		 1mjqA-4zu9A:
10.24
1mjqB-4zu9A:
10.24
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.
5anb ELONGATION FACTOR TU
GTP-BINDING
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF14492
(EFG_II) 		5 GLU K 904
GLY K 924
LEU K 865
LEU K 748
PRO K 745
 None
 1.46A 1mjqA-5anbK:
undetectable
1mjqB-5anbK:
undetectable		 1mjqA-5anbK:
8.47
1mjqB-5anbK:
8.47
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.
5anb ELONGATION FACTOR TU
GTP-BINDING
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF14492
(EFG_II) 		5 GLU K 926
GLY K 924
LEU K 865
LEU K 748
PRO K 745
 None
 1.29A 1mjqA-5anbK:
undetectable
1mjqB-5anbK:
undetectable		 1mjqA-5anbK:
8.47
1mjqB-5anbK:
8.47
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.
5cfi BIS(5'-NUCLEOSYL)-TE
TRAPHOSPHATASE
(DIADENOSINE
TETRAPHOSPHATASE),
PUTATIVE

(Plasmodium
falciparum) 		PF00293
(NUDIX) 		5 GLU A 126
GLY A 123
LEU A  85
LEU A 132
PRO A 133
 None
 1.26A 1mjqA-5cfiA:
undetectable
1mjqB-5cfiA:
undetectable		 1mjqA-5cfiA:
18.54
1mjqB-5cfiA:
18.54
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.
5doi TELOMERASE-ASSOCIATE
D PROTEIN 19
TELOMERASE
ASSOCIATED PROTEIN
P45

(Tetrahymena
thermophila;
Tetrahymena
thermophila) 		no annotation
no annotation 		5 PHE E  76
ARG A  38
LEU E  27
GLU E 112
HIS E 107
 None
 1.39A 1mjqA-5doiE:
undetectable
1mjqB-5doiE:
undetectable		 1mjqA-5doiE:
17.56
1mjqB-5doiE:
17.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e5u RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA

(Mus musculus) 		PF00194
(Carb_anhydrase) 		5 GLU A 149
PHE A 178
ARG A 251
LEU A 139
GLU A 266
 None
 1.47A 1mjqA-5e5uA:
undetectable
1mjqB-5e5uA:
undetectable		 1mjqA-5e5uA:
19.11
1mjqB-5e5uA:
19.11
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.
5ej1 PUTATIVE CELLULOSE
SYNTHASE

(Rhodobacter
sphaeroides) 		PF00535
(Glycos_transf_2)
PF03552
(Cellulose_synt)
PF07238
(PilZ) 		5 HIS A 224
PHE A 335
GLY A 337
ARG A 326
LEU A 234
 None
 1.25A 1mjqA-5ej1A:
undetectable
1mjqB-5ej1A:
undetectable		 1mjqA-5ej1A:
9.13
1mjqB-5ej1A:
9.13
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.
5esr HALOALKANE
DEHALOGENASE

(Caulobacter
vibrioides) 		PF00561
(Abhydrolase_1) 		5 GLU A 206
GLY A 207
LEU A 179
LEU A 173
PRO A 174
 None
 1.34A 1mjqA-5esrA:
undetectable
1mjqB-5esrA:
undetectable		 1mjqA-5esrA:
18.03
1mjqB-5esrA:
18.03
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.
5fcd MCCD

(Escherichia
coli) 		PF13649
(Methyltransf_25) 		5 PHE A 119
GLY A 149
LEU A 112
GLU A 140
HIS A 142
 None
 1.38A 1mjqA-5fcdA:
undetectable
1mjqB-5fcdA:
undetectable		 1mjqA-5fcdA:
17.62
1mjqB-5fcdA:
17.62
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.
5fnp IRON-SULFUR CLUSTER
REPAIR PROTEIN YTFE

(Escherichia
coli) 		PF01814
(Hemerythrin)
PF04405
(ScdA_N) 		5 HIS A 160
GLU A 165
LEU A 166
GLU A 125
HIS A 129
 ZN  A1221 (-3.3A)
None
None
None
ZN  A1221 ( 3.2A)
 1.41A 1mjqA-5fnpA:
undetectable
1mjqB-5fnpA:
undetectable		 1mjqA-5fnpA:
16.43
1mjqB-5fnpA:
16.43
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.
5fqd DNA DAMAGE-BINDING
PROTEIN 1

(Homo sapiens) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		5 HIS A  22
PHE A  23
ARG A 103
LEU A  76
GLU A  72
 None
 1.23A 1mjqA-5fqdA:
undetectable
1mjqB-5fqdA:
undetectable		 1mjqA-5fqdA:
8.62
1mjqB-5fqdA:
8.62
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT

(Escherichia
coli) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 HIS C 109
GLY C  55
GLU C 106
LEU C 311
GLU C 345
 None
 1.43A 1mjqA-5g5gC:
undetectable
1mjqB-5g5gC:
undetectable		 1mjqA-5g5gC:
9.15
1mjqB-5g5gC:
9.15
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.
5h5j FERREDOXIN--NADP
REDUCTASE

(Zea mays) 		PF00175
(NAD_binding_1) 		5 GLY A  63
ARG A 187
GLU A  19
HIS A  17
LEU A  18
 None
 1.43A 1mjqA-5h5jA:
undetectable
1mjqB-5h5jA:
undetectable		 1mjqA-5h5jA:
16.99
1mjqB-5h5jA:
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.
5hcc COMPLEMENT C5

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF07677
(A2M_recep)
PF07678
(A2M_comp) 		5 GLY A1283
GLU A1009
HIS A1002
LEU A1003
PRO A1004
 None
 1.44A 1mjqA-5hccA:
undetectable
1mjqB-5hccA:
undetectable		 1mjqA-5hccA:
7.62
1mjqB-5hccA:
7.62
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.
5i2g DIOL DEHYDRATASE

(Roseburia
inulinivorans) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 GLU A 440
GLY A 437
GLU A 527
LEU A 276
HIS A 283
 PGO  A 901 (-2.8A)
PGO  A 901 (-3.3A)
None
None
PGO  A 901 (-4.0A)
 1.46A 1mjqA-5i2gA:
0.1
1mjqB-5i2gA:
undetectable		 1mjqA-5i2gA:
10.49
1mjqB-5i2gA:
10.49
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.
5ikp GLYCOGEN
PHOSPHORYLASE, BRAIN
FORM

(Homo sapiens) 		PF00343
(Phosphorylase) 		5 GLU A 730
PHE A 774
GLU A 737
LEU A 735
PRO A 736
 None
 1.35A 1mjqA-5ikpA:
undetectable
1mjqB-5ikpA:
undetectable		 1mjqA-5ikpA:
9.05
1mjqB-5ikpA:
9.05
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.
5iq0 ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 GLY A  21
GLU A 301
ARG A 306
GLU A 249
PRO A  10
 None
 1.47A 1mjqA-5iq0A:
undetectable
1mjqB-5iq0A:
undetectable		 1mjqA-5iq0A:
19.17
1mjqB-5iq0A:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iud DNA POLYMERASE ALPHA
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 GLY A 782
GLU A 789
ARG A 966
LEU A 793
GLU A 485
 None
 1.47A 1mjqA-5iudA:
undetectable
1mjqB-5iudA:
undetectable		 1mjqA-5iudA:
8.50
1mjqB-5iudA:
8.50
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.
5oie -

(-) 		no annotation 5 GLY A 220
LEU A 229
GLU A 230
LEU A 199
PRO A 200
 None
 0.90A 1mjqA-5oieA:
undetectable
1mjqB-5oieA:
undetectable		 1mjqA-5oieA:
undetectable
1mjqB-5oieA:
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.
5op0 DNA POLYMERASE LIGD,
POLYMERASE DOMAIN

(Mycolicibacterium
smegmatis) 		no annotation 5 GLY B 299
GLU B 206
ARG B 210
LEU B 163
GLU B 166
 None
 1.15A 1mjqA-5op0B:
undetectable
1mjqB-5op0B:
undetectable		 1mjqA-5op0B:
17.30
1mjqB-5op0B:
17.30
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.
5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE

(Mycobacterium
tuberculosis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		5 GLY A 507
GLU A 500
ARG A 496
LEU A 521
GLU A 514
 None
 1.45A 1mjqA-5w25A:
undetectable
1mjqB-5w25A:
undetectable		 1mjqA-5w25A:
10.52
1mjqB-5w25A:
10.52
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.
5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE

(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		PF01257
(2Fe-2S_thioredx)
PF01512
(Complex1_51K)
PF10589
(NADH_4Fe-4S)
PF10588
(NADH-G_4Fe-4S_3)
PF13459
(Fer4_15)
PF13510
(Fer2_4) 		5 GLY A 328
LEU B 164
GLU B 169
LEU A  41
PRO A  42
 None
 1.14A 1mjqA-5xfaA:
undetectable
1mjqB-5xfaA:
undetectable		 1mjqA-5xfaA:
9.86
1mjqB-5xfaA:
9.86
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.
5xrw FLIN
FLIY

(Helicobacter
pylori;
Helicobacter
pylori) 		no annotation
no annotation 		5 GLU A  51
PHE C 268
GLY A  53
GLU C 260
LEU C 247
 None
 1.39A 1mjqA-5xrwA:
undetectable
1mjqB-5xrwA:
undetectable		 1mjqA-5xrwA:
undetectable
1mjqB-5xrwA:
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.
6c9m N-ALPHA-ACETYLTRANSF
ERASE 15, NATA
AUXILIARY SUBUNIT

(Homo sapiens) 		no annotation 5 LEU A  13
GLU A  10
HIS A  45
LEU A   6
PRO A   7
 None
 1.43A 1mjqA-6c9mA:
undetectable
1mjqB-6c9mA:
undetectable		 1mjqA-6c9mA:
undetectable
1mjqB-6c9mA:
undetectable