SIMILAR PATTERNS OF AMINO ACIDS FOR 1M4I_A_KANA500_1

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.
1ava BARLEY
ALPHA-AMYLASE/SUBTIL
ISIN INHIBITOR

(Hordeum vulgare) 		PF00197
(Kunitz_legume) 		4 GLY C 159
SER C  48
ASP C  50
THR C  34
 None
 0.89A 1m4iA-1avaC:
0.0		 1m4iA-1avaC:
24.75
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.
1b43 PROTEIN (FEN-1)

(Pyrococcus
furiosus) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 ASP A 174
GLU A 151
GLY A 152
ASP A 235
 None
 0.89A 1m4iA-1b43A:
0.0		 1m4iA-1b43A:
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.
1fw3 OUTER MEMBRANE
PHOSPHOLIPASE A

(Escherichia
coli) 		PF02253
(PLA1) 		4 GLU A 137
GLY A 139
ASP A  36
THR A  93
 None
 0.77A 1m4iA-1fw3A:
0.0		 1m4iA-1fw3A:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gyd ARABINAN
ENDO-1,5-ALPHA-L-ARA
BINOSIDASE A

(Cellvibrio
japonicus) 		PF04616
(Glyco_hydro_43) 		4 GLY B  56
SER B 110
ASP B 158
ASP B  38
 None
 0.89A 1m4iA-1gydB:
0.0		 1m4iA-1gydB:
21.15
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.
1huj INORGANIC
PYROPHOSPHATASE

(Saccharomyces
cerevisiae) 		PF00719
(Pyrophosphatase) 		5 ASP A 120
ASP A 152
GLU A 150
GLY A 114
ASP A  71
 MG  A 282 (-2.6A)
MG  A 282 (-2.8A)
None
None
None
 1.41A 1m4iA-1hujA:
0.0		 1m4iA-1hujA:
21.83
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.
1ig8 HEXOKINASE PII

(Saccharomyces
cerevisiae) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		5 ASP A 417
GLY A 235
SER A 158
ASP A  86
THR A 156
 None
 1.31A 1m4iA-1ig8A:
0.0		 1m4iA-1ig8A:
16.91
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.
1jyl CTP:PHOSPHOCHOLINE
CYTIDYLYLTRANSFERASE

(Streptococcus
pneumoniae) 		PF00483
(NTP_transferase) 		5 ASP A 218
ASP A 107
GLY A  14
ASP A 192
ASP A 105
 MG  A1996 ( 2.8A)
MG  A1996 ( 2.4A)
CDC  A1991 (-3.4A)
CDC  A1991 (-3.3A)
CDC  A1991 ( 4.0A)
 1.39A 1m4iA-1jylA:
0.0		 1m4iA-1jylA:
21.21
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.
1mj8 IMMUNOGLOBULIN
MS6-126

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 GLU H  10
GLY H   8
SER H  21
THR H  77
 None
 0.83A 1m4iA-1mj8H:
0.1		 1m4iA-1mj8H:
19.74
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.
1nbw GLYCEROL DEHYDRATASE
REACTIVASE ALPHA
SUBUNIT
GLYCEROL DEHYDRATASE
REACTIVASE BETA
SUBUNIT

(Klebsiella
pneumoniae) 		PF02288
(Dehydratase_MU)
PF08841
(DDR) 		4 ASP B  95
GLY B 101
ASP A 185
ASP A 169
 None
 0.80A 1m4iA-1nbwB:
undetectable		 1m4iA-1nbwB:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nlq NUCLEOPLASMIN-LIKE
PROTEIN

(Drosophila
melanogaster) 		PF03066
(Nucleoplasmin) 		4 GLY A  29
SER A  84
ASP A  58
THR A  55
 None
 0.90A 1m4iA-1nlqA:
undetectable		 1m4iA-1nlqA:
19.37
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.
1p43 ENOLASE 1

(Saccharomyces
cerevisiae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLU A 211
GLY A 398
SER A 372
ASP A 320
ASP A 246
 2PG  A 441 (-2.9A)
None
2PG  A 441 ( 4.1A)
MG  A 438 ( 3.1A)
MG  A 438 ( 2.6A)
 1.50A 1m4iA-1p43A:
undetectable		 1m4iA-1p43A:
16.93
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.
1poj ISOASPARTYL
DIPEPTIDASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		4 ASP A 204
ASP A 167
ASP A 285
THR A 254
 None
None
AE1  A 401 ( 2.6A)
None
 0.83A 1m4iA-1pojA:
undetectable		 1m4iA-1pojA:
19.33
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.
1q5a EP-CADHERIN

(Mus musculus) 		PF00028
(Cadherin) 		4 ASP A 325
SER A 418
ASP A 414
ASP A 360
 CA  A 915 (-2.6A)
None
CA  A 912 (-2.5A)
CA  A 912 ( 3.6A)
 0.78A 1m4iA-1q5aA:
undetectable		 1m4iA-1q5aA:
11.59
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.
1qd6 PROTEIN (OUTER
MEMBRANE
PHOSPHOLIPASE
(OMPLA))

(Escherichia
coli) 		PF02253
(PLA1) 		4 GLU C 137
GLY C 139
ASP C  36
THR C  93
 None
 0.79A 1m4iA-1qd6C:
undetectable		 1m4iA-1qd6C:
20.08
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.
1tza APAG PROTEIN

(Shewanella
oneidensis) 		PF04379
(DUF525) 		4 ASP A   5
GLU A  41
GLY A  40
SER A 104
 ASP  A   5 ( 0.6A)
GLU  A  41 ( 0.6A)
GLY  A  40 ( 0.0A)
SER  A 104 ( 0.0A)
 0.89A 1m4iA-1tzaA:
undetectable		 1m4iA-1tzaA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1umg 385AA LONG CONSERVED
HYPOTHETICAL PROTEIN

(Sulfurisphaera
tokodaii) 		PF01950
(FBPase_3) 		4 ASP A  96
GLY A  94
SER A  15
ASP A  54
 MG  A 402 ( 4.2A)
None
MG  A 404 ( 4.3A)
MG  A 403 (-2.6A)
 0.90A 1m4iA-1umgA:
undetectable		 1m4iA-1umgA:
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.
1umg 385AA LONG CONSERVED
HYPOTHETICAL PROTEIN

(Sulfurisphaera
tokodaii) 		PF01950
(FBPase_3) 		4 ASP A 132
ASP A 233
GLU A 347
GLY A 267
 MG  A 403 ( 2.7A)
MG  A 401 (-2.5A)
MG  A 401 ( 4.0A)
2FP  A 400 (-4.4A)
 0.78A 1m4iA-1umgA:
undetectable		 1m4iA-1umgA:
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.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		4 ASP A 108
ASP A  29
SER A 232
THR A 204
 None
 0.79A 1m4iA-1ur4A:
undetectable		 1m4iA-1ur4A:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uv4 ARABINAN-ENDO
1,5-ALPHA-L-ARABINAS
E

(Bacillus
subtilis) 		PF04616
(Glyco_hydro_43) 		4 GLY A  36
SER A  90
ASP A 133
ASP A  14
 None
 0.83A 1m4iA-1uv4A:
undetectable		 1m4iA-1uv4A:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uyp BETA-FRUCTOSIDASE

(Thermotoga
maritima) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 GLY A  47
ASP A 138
THR A  90
ASP A  17
 None
GOL  A1437 (-2.9A)
None
GOL  A1437 (-2.8A)
 0.84A 1m4iA-1uypA:
undetectable		 1m4iA-1uypA:
14.78
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.
1wl7 ARABINANASE-TS

(Geobacillus
thermodenitrificans) 		PF04616
(Glyco_hydro_43) 		4 GLY A  45
SER A 100
ASP A 147
ASP A  27
 None
 0.83A 1m4iA-1wl7A:
undetectable		 1m4iA-1wl7A:
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.
1xbt THYMIDINE KINASE,
CYTOSOLIC

(Homo sapiens) 		PF00265
(TK) 		4 ASP A  58
ASP A  97
GLY A  99
THR A 163
 TTP  A1195 (-3.2A)
MG  A1194 ( 4.3A)
None
TTP  A1195 ( 3.8A)
 0.82A 1m4iA-1xbtA:
undetectable		 1m4iA-1xbtA:
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.
1y9g EXO-INULINASE

(Aspergillus
awamori) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 GLY A  71
ASP A 189
THR A 129
ASP A  41
 None
FRU  A 801 (-2.7A)
None
FRU  A 801 (-2.7A)
 0.85A 1m4iA-1y9gA:
undetectable		 1m4iA-1y9gA:
15.58
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.
1yfo RECEPTOR PROTEIN
TYROSINE PHOSPHATASE
ALPHA

(Mus musculus) 		PF00102
(Y_phosphatase) 		4 ASP A 451
GLU A 297
GLY A 294
THR A 326
 None
 0.71A 1m4iA-1yfoA:
undetectable		 1m4iA-1yfoA:
20.13
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.
1yiq QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Pseudomonas
putida) 		PF01011
(PQQ)
PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		4 ASP A 390
ASP A 297
THR A 294
ASP A 300
 PQQ  A 801 (-3.2A)
None
None
CA  A 802 (-3.1A)
 0.89A 1m4iA-1yiqA:
undetectable		 1m4iA-1yiqA:
15.05
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.
1yve ACETOHYDROXY ACID
ISOMEROREDUCTASE

(Spinacia
oleracea) 		PF01450
(IlvC)
PF07991
(IlvN) 		4 GLY I 255
SER I 518
ASP I 202
THR I 520
 NDP  I 600 (-3.9A)
HIO  I 603 ( 2.6A)
NDP  I 600 (-2.8A)
None
 0.86A 1m4iA-1yveI:
undetectable		 1m4iA-1yveI:
17.21
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.
2akz GAMMA ENOLASE

(Homo sapiens) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLU A 209
GLY A 395
SER A 369
ASP A 317
ASP A 244
 PO4  A 442 ( 4.5A)
None
F  A 445 ( 4.4A)
MG  A 440 (-3.0A)
MG  A 440 (-2.5A)
 1.49A 1m4iA-2akzA:
undetectable		 1m4iA-2akzA:
17.32
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.
2fbv WERNER SYNDROME
HELICASE

(Homo sapiens) 		PF01612
(DNA_pol_A_exo1) 		4 ASP A 143
ASP A  82
GLY A  80
THR A 162
 MN  A 237 ( 4.2A)
MN  A 238 ( 2.8A)
None
None
 0.86A 1m4iA-2fbvA:
undetectable		 1m4iA-2fbvA:
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.
2l3j DOUBLE-STRANDED
RNA-SPECIFIC EDITASE
1

(Rattus
norvegicus) 		PF00035
(dsrm) 		4 GLU A  48
GLY A  49
SER A  26
THR A  28
 None
 0.84A 1m4iA-2l3jA:
undetectable		 1m4iA-2l3jA:
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.
2o6s VARIABLE LYMPHOCYTE
RECEPTOR B

(Eptatretus
burgeri) 		PF11921
(DUF3439)
PF12799
(LRR_4)
PF13855
(LRR_8) 		4 ASP A  57
GLU A 127
SER A 107
THR A 108
 None
 0.77A 1m4iA-2o6sA:
undetectable		 1m4iA-2o6sA:
19.47
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.
2orv THYMIDINE KINASE

(Homo sapiens) 		PF00265
(TK) 		4 ASP A  58
ASP A  97
GLY A  99
THR A 163
 4TA  A 801 (-3.5A)
4TA  A 801 (-2.7A)
None
4TA  A 801 ( 4.2A)
 0.87A 1m4iA-2orvA:
undetectable		 1m4iA-2orvA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pa4 UTP-GLUCOSE-1-PHOSPH
ATE
URIDYLYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF00483
(NTP_transferase) 		4 ASP A 266
GLY A 271
THR A  30
ASP A 142
 MG  A 325 ( 4.6A)
None
None
MG  A 325 ( 2.6A)
 0.86A 1m4iA-2pa4A:
undetectable		 1m4iA-2pa4A:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ptz ENOLASE

(Trypanosoma
brucei) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLU A 208
GLY A 396
SER A 370
ASP A 318
ASP A 243
 PAH  A 600 ( 4.8A)
None
PAH  A 600 ( 4.2A)
ZN  A 500 ( 3.0A)
ZN  A 500 ( 2.4A)
 1.50A 1m4iA-2ptzA:
undetectable		 1m4iA-2ptzA:
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.
2q0f RNA URIDYLYL
TRANSFERASE

(Trypanosoma
brucei) 		PF03828
(PAP_assoc) 		4 ASP A  68
GLY A 144
THR A 120
ASP A 136
 MG  A 401 (-2.6A)
UTP  A 501 (-3.6A)
None
U5P  A 502 (-4.0A)
 0.78A 1m4iA-2q0fA:
undetectable		 1m4iA-2q0fA:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rex RHO-RELATED
GTP-BINDING PROTEIN
RHO6

(Homo sapiens) 		PF00071
(Ras) 		4 ASP B  93
GLY B 124
SER B 168
THR B 171
 None
None
GNP  B 500 (-3.6A)
None
 0.86A 1m4iA-2rexB:
undetectable		 1m4iA-2rexB:
20.83
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.
2v40 ADENYLOSUCCINATE
SYNTHETASE ISOZYME 2

(Homo sapiens) 		PF00709
(Adenylsucc_synt) 		4 GLU A 214
GLY A 215
SER A 192
ASP A 189
 None
 0.77A 1m4iA-2v40A:
undetectable		 1m4iA-2v40A:
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.
2vef DIHYDROPTEROATE
SYNTHASE

(Streptococcus
pneumoniae) 		PF00809
(Pterin_bind) 		4 GLU A  45
GLY A  46
SER A 288
ASP A 263
 None
PO4  A1304 (-3.8A)
None
None
 0.81A 1m4iA-2vefA:
undetectable		 1m4iA-2vefA:
18.41
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.
2vz5 TAX1-BINDING PROTEIN
3

(Homo sapiens) 		PF00595
(PDZ) 		4 ASP A  40
GLY A  34
SER A  47
ASP A  49
 None
 0.82A 1m4iA-2vz5A:
undetectable		 1m4iA-2vz5A:
21.08
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.
2w6r IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
SUBUNIT HISF

(Thermotoga
maritima) 		PF00977
(His_biosynth) 		4 ASP A   9
SER A 206
ASP A 181
THR A 176
 None
 0.83A 1m4iA-2w6rA:
undetectable		 1m4iA-2w6rA:
24.52
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		4 GLY A 333
SER A 460
THR A 413
ASP A 404
 None
None
None
CD  A1904 (-2.1A)
 0.86A 1m4iA-2x05A:
undetectable		 1m4iA-2x05A:
10.47
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.
2xax RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
SUBUNIT ALPHA

(Escherichia
coli) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		4 ASP A 586
GLY A 683
ASP A 418
THR A 422
 None
 0.75A 1m4iA-2xaxA:
undetectable		 1m4iA-2xaxA:
14.33
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.
2xla SLL1785 PROTEIN

(Synechocystis
sp. PCC 6803) 		no annotation 4 ASP A 202
GLY A 208
SER A  95
THR A 295
 None
 0.78A 1m4iA-2xlaA:
undetectable		 1m4iA-2xlaA:
22.08
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.
2xsx BETA-ENOLASE

(Homo sapiens) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLU A 210
GLY A 396
SER A 370
ASP A 318
ASP A 245
 PO4  A 501 (-4.0A)
None
None
MG  A 500 (-3.2A)
MG  A 500 (-2.6A)
 1.50A 1m4iA-2xsxA:
undetectable		 1m4iA-2xsxA:
18.12
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.
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) 		4 ASP A 827
ASP A 818
GLY A 901
THR A 924
 None
 0.79A 1m4iA-2y3aA:
undetectable		 1m4iA-2y3aA:
10.21
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.
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) 		4 ASP A 913
ASP A 807
THR A 810
ASP A 931
 None
GD9  A2058 (-3.7A)
None
GD9  A2058 (-3.2A)
 0.80A 1m4iA-2y3aA:
undetectable		 1m4iA-2y3aA:
10.21
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.
3d37 TAIL PROTEIN, 43 KDA

(Neisseria
meningitidis) 		no annotation 5 ASP A 327
GLU A 201
GLY A 285
ASP A 204
THR A 281
 None
 1.31A 1m4iA-3d37A:
undetectable		 1m4iA-3d37A:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fds DNA POLYMERASE
SLIDING CLAMP C

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		4 GLU D  61
GLY D  59
SER D  92
THR D  99
 None
 0.80A 1m4iA-3fdsD:
undetectable		 1m4iA-3fdsD:
20.08
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.
3hfw PROTEIN
ADP-RIBOSYLARGININE
HYDROLASE

(Homo sapiens) 		PF03747
(ADP_ribosyl_GH) 		4 ASP A  55
ASP A 304
GLY A  22
ASP A 302
 MG  A 361 (-2.9A)
MG  A 361 (-2.7A)
None
None
 0.80A 1m4iA-3hfwA:
undetectable		 1m4iA-3hfwA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hp7 HEMOLYSIN, PUTATIVE

(Streptococcus
thermophilus) 		PF01479
(S4)
PF01728
(FtsJ) 		4 ASP A 174
GLY A 176
SER A 222
ASP A 248
 None
 0.76A 1m4iA-3hp7A:
undetectable		 1m4iA-3hp7A:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3juu PORPHYRANASE B

(Zobellia
galactanivorans) 		PF00722
(Glyco_hydro_16) 		4 GLU A  51
GLY A  52
SER A  86
THR A 279
 None
SO4  A   5 (-3.3A)
None
None
 0.76A 1m4iA-3juuA:
undetectable		 1m4iA-3juuA:
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.
3kf3 INVERTASE

(Schwanniomyces
occidentalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 GLY A  83
ASP A 179
THR A 140
ASP A  50
 None
FRU  A 600 (-2.5A)
None
FRU  A 600 (-2.8A)
 0.89A 1m4iA-3kf3A:
undetectable		 1m4iA-3kf3A:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3koy D-ORNITHINE
AMINOMUTASE E
COMPONENT

(Acetoanaerobium
sticklandii) 		PF02310
(B12-binding)
PF09043
(Lys-AminoMut_A)
PF16554
(OAM_dimer) 		4 GLY A 720
SER A 667
ASP A 616
THR A 612
 None
B12  A1801 (-2.5A)
None
None
 0.72A 1m4iA-3koyA:
undetectable		 1m4iA-3koyA:
12.67
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.
3kst ENDO-1,4-BETA-XYLANA
SE

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		4 GLY A  73
SER A 122
ASP A 154
ASP A  50
 None
 0.78A 1m4iA-3kstA:
undetectable		 1m4iA-3kstA:
19.60
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.
3mos TRANSKETOLASE

(Homo sapiens) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ASP A 424
GLY A 418
SER A 415
THR A 346
 None
 0.88A 1m4iA-3mosA:
undetectable		 1m4iA-3mosA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3on6 UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF06824
(Glyco_hydro_125) 		4 ASP A 346
GLY A 391
SER A 440
THR A 450
 None
 0.88A 1m4iA-3on6A:
undetectable		 1m4iA-3on6A:
17.36
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.
3p2c PUTATIVE GLYCOSYL
HYDROLASE

(Bacteroides
ovatus) 		PF06824
(Glyco_hydro_125) 		4 ASP A 352
GLY A 397
SER A 446
THR A 456
 None
 0.90A 1m4iA-3p2cA:
undetectable		 1m4iA-3p2cA:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qa8 MGC80376 PROTEIN

(Xenopus laevis) 		PF00069
(Pkinase) 		4 GLY A 384
SER A 313
THR A 324
ASP A 373
 None
 0.87A 1m4iA-3qa8A:
undetectable		 1m4iA-3qa8A:
13.41
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.
3qc2 GLYCOSYL HYDROLASE

(Bacteroides
ovatus) 		PF04041
(Glyco_hydro_130) 		4 GLU A 349
GLY A 273
ASP A 366
THR A 345
 None
 0.90A 1m4iA-3qc2A:
undetectable		 1m4iA-3qc2A:
17.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qgh RNA-DIRECTED RNA
POLYMERASE

(Hepacivirus C) 		PF00998
(RdRP_3) 		4 GLU A 481
GLY A 480
THR A 364
ASP A 387
 None
 0.90A 1m4iA-3qghA:
undetectable		 1m4iA-3qghA:
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.
3rmj 2-ISOPROPYLMALATE
SYNTHASE

(Neisseria
meningitidis) 		PF00682
(HMGL-like) 		4 ASP A 208
GLY A 210
ASP A  16
THR A 230
 None
None
MN  A 365 (-2.6A)
None
 0.87A 1m4iA-3rmjA:
undetectable		 1m4iA-3rmjA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sxf CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Toxoplasma
gondii) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ASP A 453
GLY A 456
SER A 459
THR A 461
 None
 0.88A 1m4iA-3sxfA:
undetectable		 1m4iA-3sxfA:
14.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus) 		PF02113
(Peptidase_S13) 		4 GLY A 352
SER A 370
ASP A 318
ASP A 327
 None
 0.74A 1m4iA-3v39A:
undetectable		 1m4iA-3v39A:
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 ASP A2399
GLY A2276
ASP A2307
ASP A2358
 None
 0.84A 1m4iA-3vkgA:
undetectable		 1m4iA-3vkgA:
4.17
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.
4a01 PROTON
PYROPHOSPHATASE

(Vigna radiata) 		PF03030
(H_PPase) 		5 ASP A 691
ASP A 530
GLY A 503
ASP A 279
THR A 249
 MG  A1771 ( 2.7A)
MG  A1771 ( 4.1A)
K  A1772 ( 4.5A)
MG  A1768 ( 4.3A)
None
 1.22A 1m4iA-4a01A:
undetectable		 1m4iA-4a01A:
13.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a5q CHI1

(Yersinia
entomophaga) 		PF00704
(Glyco_hydro_18) 		5 ASP A  81
GLU A  30
GLY A  27
ASP A 421
THR A 420
 None
 1.45A 1m4iA-4a5qA:
undetectable		 1m4iA-4a5qA:
15.07
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.
4bfr PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC S
SUBUNIT BETA ISOFORM

(Mus musculus) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd) 		4 ASP A 827
ASP A 818
GLY A 901
THR A 924
 None
 0.76A 1m4iA-4bfrA:
undetectable		 1m4iA-4bfrA:
11.49
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.
4crn ERF1 IN
RIBOSOME-BOUND
ERF1-ERF3-GDPNP
COMPLEX

(Saccharomyces
cerevisiae) 		PF03463
(eRF1_1)
PF03464
(eRF1_2)
PF03465
(eRF1_3) 		4 GLY X 220
SER X 159
THR X 162
ASP X 140
 None
 0.90A 1m4iA-4crnX:
undetectable		 1m4iA-4crnX:
15.72
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.
4cvu BETA-MANNOSIDASE

(Trichoderma
harzianum) 		PF00703
(Glyco_hydro_2) 		4 GLY A 126
SER A 153
THR A  90
ASP A 122
 MAN  A1950 ( 3.7A)
None
None
None
 0.90A 1m4iA-4cvuA:
undetectable		 1m4iA-4cvuA:
10.99
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.
4e54 DNA DAMAGE-BINDING
PROTEIN 2

(Homo sapiens) 		PF00400
(WD40) 		4 ASP B 135
GLY B 130
SER B 176
THR B 180
 None
 0.85A 1m4iA-4e54B:
undetectable		 1m4iA-4e54B:
18.00
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.
4eqv INVERTASE 2

(Saccharomyces
cerevisiae) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 GLY A  55
ASP A 151
THR A 112
ASP A  22
 None
 0.83A 1m4iA-4eqvA:
undetectable		 1m4iA-4eqvA:
12.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ewg BETA-KETOACYL
SYNTHASE

(Paraburkholderia
phymatum) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 ASP A 306
GLY A 302
SER A 313
ASP A 367
 None
 0.90A 1m4iA-4ewgA:
undetectable		 1m4iA-4ewgA:
20.29
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.
4ewj ENOLASE 2

(Streptococcus
suis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		4 ASP A 320
GLU A 292
GLY A 318
SER A 371
 None
 0.87A 1m4iA-4ewjA:
undetectable		 1m4iA-4ewjA:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ida RIPENING-INDUCED
PROTEIN

(Fragaria vesca) 		PF08240
(ADH_N)
PF13602
(ADH_zinc_N_2) 		4 ASP A  42
GLY A  88
THR A 122
ASP A 125
 None
 0.76A 1m4iA-4idaA:
undetectable		 1m4iA-4idaA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lla LEUKOCYTE
IMMUNOGLOBULIN-LIKE
RECEPTOR SUBFAMILY B
MEMBER 2

(Homo sapiens) 		PF13895
(Ig_2) 		4 GLY A 101
SER A 181
THR A 135
ASP A 185
 None
 0.78A 1m4iA-4llaA:
undetectable		 1m4iA-4llaA:
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.
4lyp EXO-BETA-1,4-MANNOSI
DASE

(Rhizomucor
miehei) 		no annotation 4 ASP A 391
GLY A 375
SER A 362
THR A 363
 None
 0.90A 1m4iA-4lypA:
undetectable		 1m4iA-4lypA:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m7f FIBRINOGEN C
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 ASP A 304
GLY A 316
ASP A 391
ASP A 300
 None
 0.84A 1m4iA-4m7fA:
undetectable		 1m4iA-4m7fA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mks ENOLASE 2

(Lactobacillus
gasseri) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLU A 205
GLY A 392
SER A 366
ASP A 314
ASP A 242
 None
None
None
MG  A 502 (-3.1A)
MG  A 502 (-2.7A)
 1.50A 1m4iA-4mksA:
undetectable		 1m4iA-4mksA:
17.78
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.
4nnm TAX1-BINDING PROTEIN
3

(Homo sapiens) 		PF00595
(PDZ) 		4 ASP A  41
GLY A  35
SER A  48
ASP A  50
 None
 0.86A 1m4iA-4nnmA:
undetectable		 1m4iA-4nnmA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4onz PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
ovatus) 		PF04041
(Glyco_hydro_130) 		4 GLU A 347
GLY A 271
ASP A 364
THR A 343
 None
None
UNL  A 400 ( 3.0A)
UNL  A 400 ( 4.8A)
 0.77A 1m4iA-4onzA:
undetectable		 1m4iA-4onzA:
18.99
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.
4p08 COCAINE ESTERASE

(Rhodococcus sp.
MB1) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 ASP A  73
GLY A  76
THR A 176
ASP A  45
 None
 0.87A 1m4iA-4p08A:
undetectable		 1m4iA-4p08A:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qlo HOMOSERINE
O-ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF00561
(Abhydrolase_1) 		4 GLY A 190
SER A 164
ASP A 237
THR A 160
 None
 0.89A 1m4iA-4qloA:
undetectable		 1m4iA-4qloA:
18.36
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.
4qqs GLYCOSIDE HYDROLASE
FAMILY 43

(Halothermothrix
orenii) 		PF04616
(Glyco_hydro_43) 		4 GLY A  38
SER A  88
ASP A 126
ASP A  17
 None
None
EPE  A 401 (-2.7A)
EPE  A 401 (-3.5A)
 0.73A 1m4iA-4qqsA:
undetectable		 1m4iA-4qqsA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qt8 MACROPHAGE-STIMULATI
NG PROTEIN RECEPTOR

(Homo sapiens) 		no annotation 4 GLY B 113
SER B 137
ASP B 119
ASP B 117
 None
 0.90A 1m4iA-4qt8B:
undetectable		 1m4iA-4qt8B:
15.46
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.
4qyr AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 ASP A2560
GLU A2776
GLY A2777
ASP A2609
 None
None
None
GOL  A3201 (-3.8A)
 0.70A 1m4iA-4qyrA:
undetectable		 1m4iA-4qyrA:
17.69
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.
4uf4 CARBOXYPEPTIDASE A1

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 ASP A  44
GLU A  46
SER A 272
THR A 274
 None
 0.88A 1m4iA-4uf4A:
undetectable		 1m4iA-4uf4A:
19.56
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.
4wd2 AROMATIC-AMINO-ACID
TRANSAMINASE TYRB

(Burkholderia
cenocepacia) 		PF00155
(Aminotran_1_2) 		4 GLU A 310
GLY A  47
SER A 249
ASP A  38
 None
 0.86A 1m4iA-4wd2A:
undetectable		 1m4iA-4wd2A:
18.66
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.
5c2w HYPOTHETICAL (DI
HEME) PROTEIN

(Candidatus
Kuenenia
stuttgartiensis) 		PF00034
(Cytochrom_C) 		5 GLU C 275
GLY C 274
SER C 269
ASP C 320
THR C 325
 None
 1.28A 1m4iA-5c2wC:
undetectable		 1m4iA-5c2wC:
20.70
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.
5dz2 GERMACRADIENOL/GEOSM
IN SYNTHASE

(Streptomyces
coelicolor) 		no annotation 4 ASP A  86
GLU A 241
SER A 233
ASP A 230
 MG  A 401 (-2.5A)
MG  A 403 ( 4.3A)
MG  A 402 ( 2.5A)
None
 0.87A 1m4iA-5dz2A:
undetectable		 1m4iA-5dz2A:
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.
5esv CH03 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ASP A 100
GLY A 100
ASP A  56
THR A 100
 None
None
BMA  E 417 (-3.1A)
NAG  E 416 ( 4.7A)
 0.90A 1m4iA-5esvA:
undetectable		 1m4iA-5esvA:
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.
5evl BETA-LACTAMASE

(Chromobacterium
violaceum) 		PF00144
(Beta-lactamase) 		4 ASP A 172
GLY A 160
SER A  67
ASP A 219
 None
 0.83A 1m4iA-5evlA:
undetectable		 1m4iA-5evlA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ey5 LBCA-B

(synthetic
construct) 		PF00291
(PALP) 		4 ASP B 302
ASP B 135
GLY B 110
THR B 382
 None
 0.88A 1m4iA-5ey5B:
undetectable		 1m4iA-5ey5B:
19.02
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.
5f64 POSITIVE
TRANSCRIPTION
REGULATOR EVGA

(Shigella
flexneri) 		PF00072
(Response_reg)
PF00196
(GerE) 		4 ASP A   8
ASP A  52
GLY A  60
ASP A 157
 None
 0.68A 1m4iA-5f64A:
undetectable		 1m4iA-5f64A:
18.10
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 GLY A2012
SER A1969
THR A1917
ASP A2003
 None
 0.90A 1m4iA-5i6hA:
undetectable		 1m4iA-5i6hA:
9.12
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.
5l0z PROBABLE RNA
METHYLTRANSFERASE,
TRMH FAMILY

(Sinorhizobium
meliloti) 		PF00588
(SpoU_methylase)
PF08032
(SpoU_sub_bind) 		4 GLU A 168
GLY A 167
ASP A  42
ASP A 171
 None
 0.88A 1m4iA-5l0zA:
undetectable		 1m4iA-5l0zA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n0c TETANUS TOXIN

(Clostridium
tetani) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 ASP A 406
GLY A 413
THR A 217
ASP A 894
 None
 0.91A 1m4iA-5n0cA:
undetectable		 1m4iA-5n0cA:
8.26
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.
5oh6 INTERAPTIN

(Legionella
pneumophila) 		no annotation 4 ASP A  47
GLU A 155
GLY A 156
SER A 162
 None
 0.79A 1m4iA-5oh6A:
undetectable		 1m4iA-5oh6A:
16.40
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.
5tey N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT
N6-ADENOSINE-METHYLT
RANSFERASE SUBUNIT
METTL14

(Homo sapiens) 		PF05063
(MT-A70) 		5 ASP A 453
GLU B 197
GLY B 236
THR B 272
ASP B 276
 None
 1.39A 1m4iA-5teyA:
undetectable		 1m4iA-5teyA:
14.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5us1 AMINOGLYCOSIDE
2'-N-ACETYLTRANSFERA
SE

(Providencia
stuartii) 		PF13673
(Acetyltransf_10) 		5 ASP A  32
ASP A  37
GLU A  79
SER A 114
ASP A 176
 8MM  A 201 ( 4.5A)
8MM  A 201 (-3.3A)
8MM  A 201 (-4.5A)
8MM  A 201 (-3.3A)
8MM  A 201 (-4.4A)
 0.51A 1m4iA-5us1A:
27.9		 1m4iA-5us1A:
33.52
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.
5xgw ISOASPARTYL
DIPEPTIDASE

(Colwellia
psychrerythraea) 		no annotation 4 ASP A 208
ASP A 171
ASP A 293
THR A 258
 None
None
ZN  A 401 (-2.6A)
None
 0.88A 1m4iA-5xgwA:
undetectable		 1m4iA-5xgwA:
18.23