SIMILAR PATTERNS OF AMINO ACIDS FOR 3IJX_B_HCZB800_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.
1b5f PROTEIN (CARDOSIN A)

(Cynara
cardunculus) 		PF00026
(Asp) 		5 SER A  61
LEU A  38
ILE A  18
SER A  88
GLY A  19
 None
 1.41A 3ijxB-1b5fA:
undetectable
3ijxD-1b5fA:
undetectable		 3ijxB-1b5fA:
21.35
3ijxD-1b5fA:
21.35
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.
1bh6 SUBTILISIN DY

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		5 LEU A 126
ILE A  31
SER A 109
SER A 105
GLY A 110
 1BH  A 300 (-4.0A)
None
None
None
None
 1.39A 3ijxB-1bh6A:
undetectable
3ijxD-1bh6A:
undetectable		 3ijxB-1bh6A:
22.45
3ijxD-1bh6A:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 SER A 169
LEU A 304
ILE A 306
SER A 291
GLY A 313
 FAD  A 600 ( 3.9A)
None
None
FAD  A 600 ( 4.2A)
None
 1.39A 3ijxB-1bhyA:
undetectable
3ijxD-1bhyA:
0.0		 3ijxB-1bhyA:
21.78
3ijxD-1bhyA:
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.
1c3l SUBTILISIN-CARLSBERG

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		5 LEU A 267
ILE A  11
PRO A   9
SER A 182
GLY A   7
 None
 1.41A 3ijxB-1c3lA:
0.0
3ijxD-1c3lA:
0.3		 3ijxB-1c3lA:
22.53
3ijxD-1c3lA:
22.53
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.
1euf DUODENASE

(Bos taurus) 		PF00089
(Trypsin) 		5 LEU A  53
ILE A 231
PRO A 124
SER A 126
SER A 236
 None
None
None
PO4  A 600 (-2.5A)
None
 1.41A 3ijxB-1eufA:
undetectable
3ijxD-1eufA:
undetectable		 3ijxB-1eufA:
21.01
3ijxD-1eufA:
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.
1gk2 HISTIDINE
AMMONIA-LYASE

(Pseudomonas
putida) 		PF00221
(Lyase_aromatic) 		5 LEU A  27
ILE A  35
SER A 112
SER A 106
GLY A 110
 None
 1.30A 3ijxB-1gk2A:
undetectable
3ijxD-1gk2A:
undetectable		 3ijxB-1gk2A:
19.77
3ijxD-1gk2A:
19.77
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.
1hww ALPHA-MANNOSIDASE II

(Drosophila
melanogaster) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		5 PRO A 197
SER A 200
LEU A1017
SER A 219
GLY A 164
 None
 1.24A 3ijxB-1hwwA:
undetectable
3ijxD-1hwwA:
undetectable		 3ijxB-1hwwA:
13.99
3ijxD-1hwwA:
13.99
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.
1iz1 LYSR-TYPE REGULATORY
PROTEIN

(Cupriavidus
necator) 		PF00126
(HTH_1)
PF03466
(LysR_substrate) 		5 SER A 269
LEU A 124
ILE A 102
PRO A 101
GLY A  99
 None
 1.24A 3ijxB-1iz1A:
11.2
3ijxD-1iz1A:
11.4		 3ijxB-1iz1A:
20.85
3ijxD-1iz1A:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1juh QUERCETIN
2,3-DIOXYGENASE

(Aspergillus
japonicus) 		no annotation 5 PRO A 304
SER A 269
ILE A 287
PRO A  16
GLY A 288
 None
 1.26A 3ijxB-1juhA:
undetectable
3ijxD-1juhA:
undetectable		 3ijxB-1juhA:
22.04
3ijxD-1juhA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 LEU A 238
ILE A 225
SER A 220
SER A 208
GLY A 222
 None
 1.22A 3ijxB-1knrA:
undetectable
3ijxD-1knrA:
undetectable		 3ijxB-1knrA:
18.38
3ijxD-1knrA:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ldn L-LACTATE
DEHYDROGENASE

(Geobacillus
stearothermophilus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A 198
SER A 317
ILE A 190
SER A 273
GLY A 288
 None
 1.16A 3ijxB-1ldnA:
undetectable
3ijxD-1ldnA:
undetectable		 3ijxB-1ldnA:
20.92
3ijxD-1ldnA:
20.92
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.
1lq2 BETA-D-GLUCAN
GLUCOHYDROLASE
ISOENZYME EXO1

(Hordeum vulgare) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		5 SER A 255
LEU A 312
ILE A 289
SER A 252
GLY A 288
 NAG  A 610 ( 4.1A)
None
None
None
None
 1.28A 3ijxB-1lq2A:
undetectable
3ijxD-1lq2A:
undetectable		 3ijxB-1lq2A:
18.39
3ijxD-1lq2A:
18.39
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.
1lvl DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 LYS A 192
LEU A 225
ILE A 188
SER A 198
GLY A 187
 None
 1.26A 3ijxB-1lvlA:
undetectable
3ijxD-1lvlA:
undetectable		 3ijxB-1lvlA:
20.71
3ijxD-1lvlA:
20.71
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.
1ou0 PRECORRIN-8X
METHYLMUTASE RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF02570
(CbiC) 		5 PRO A 138
SER A 116
ILE A 134
PRO A 162
GLY A 135
 None
 1.24A 3ijxB-1ou0A:
undetectable
3ijxD-1ou0A:
undetectable		 3ijxB-1ou0A:
22.85
3ijxD-1ou0A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1smr RENIN

(Mus musculus) 		PF00026
(Asp) 		5 SER A  61
LEU A  38
ILE A  18
SER A  88
GLY A  19
 None
 1.39A 3ijxB-1smrA:
undetectable
3ijxD-1smrA:
undetectable		 3ijxB-1smrA:
20.00
3ijxD-1smrA:
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.
1wh3 59 KDA
2'-5'-OLIGOADENYLATE
SYNTHETASE LIKE
PROTEIN

(Homo sapiens) 		PF00240
(ubiquitin) 		5 LEU A  63
SER A  28
ILE A   8
SER A   6
GLY A   7
 None
 1.37A 3ijxB-1wh3A:
undetectable
3ijxD-1wh3A:
undetectable		 3ijxB-1wh3A:
16.74
3ijxD-1wh3A:
16.74
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.
1yrg GTPASE-ACTIVATING
PROTEIN RNA1_SCHPO

(Schizosaccharomyces
pombe) 		no annotation 5 SER A 257
LEU A 223
ILE A 204
PRO A 201
GLY A 232
 None
 1.39A 3ijxB-1yrgA:
undetectable
3ijxD-1yrgA:
undetectable		 3ijxB-1yrgA:
21.26
3ijxD-1yrgA:
21.26
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.
2ag8 PYRROLINE-5-CARBOXYL
ATE REDUCTASE

(Neisseria
meningitidis) 		PF03807
(F420_oxidored)
PF14748
(P5CR_dimer) 		5 PRO A 114
PRO A 168
SER A 164
SER A 122
GLY A 165
 None
None
None
None
NAP  A 311 (-4.2A)
 1.28A 3ijxB-2ag8A:
undetectable
3ijxD-2ag8A:
undetectable		 3ijxB-2ag8A:
22.53
3ijxD-2ag8A:
22.53
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.
2e0n PRECORRIN-2
C20-METHYLTRANSFERAS
E

(Chlorobaculum
tepidum) 		PF00590
(TP_methylase) 		5 PRO A  37
SER A 111
LEU A  54
SER A   9
SER A  11
 None
 1.41A 3ijxB-2e0nA:
undetectable
3ijxD-2e0nA:
undetectable		 3ijxB-2e0nA:
21.99
3ijxD-2e0nA:
21.99
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.
2e0w GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Escherichia
coli) 		PF01019
(G_glu_transpept) 		5 LEU A 492
ILE A 300
SER A 295
SER A 485
GLY A 296
 None
 1.27A 3ijxB-2e0wA:
undetectable
3ijxD-2e0wA:
undetectable		 3ijxB-2e0wA:
19.38
3ijxD-2e0wA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e0x GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Escherichia
coli) 		PF01019
(G_glu_transpept) 		5 LEU B 492
ILE A 300
SER A 295
SER B 485
GLY A 296
 None
 1.28A 3ijxB-2e0xB:
undetectable
3ijxD-2e0xB:
undetectable		 3ijxB-2e0xB:
21.05
3ijxD-2e0xB:
21.05
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.
2gmh ELECTRON TRANSFER
FLAVOPROTEIN-UBIQUIN
ONE OXIDOREDUCTASE

(Sus scrofa) 		PF05187
(ETF_QO)
PF13450
(NAD_binding_8) 		5 LEU A 406
SER A 373
ILE A 341
PRO A 342
GLY A 357
 None
 1.39A 3ijxB-2gmhA:
undetectable
3ijxD-2gmhA:
undetectable		 3ijxB-2gmhA:
19.31
3ijxD-2gmhA:
19.31
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.
2mwm PUTATIVE TRP
REPRESSOR BINDING
PROTEIN

(Lactobacillus
acidophilus) 		PF12682
(Flavodoxin_4) 		5 PRO A  94
LEU A  98
ILE A  82
SER A  12
GLY A  83
 None
 1.41A 3ijxB-2mwmA:
undetectable
3ijxD-2mwmA:
undetectable		 3ijxB-2mwmA:
22.39
3ijxD-2mwmA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pw9 PUTATIVE FORMATE
DEHYDROGENASE
ACCESSORY PROTEIN

(Desulfotalea
psychrophila) 		PF02634
(FdhD-NarQ) 		5 LEU A 158
SER A 190
ILE A 214
PRO A 215
GLY A 213
 None
 1.40A 3ijxB-2pw9A:
undetectable
3ijxD-2pw9A:
undetectable		 3ijxB-2pw9A:
21.83
3ijxD-2pw9A:
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.
2py0 FIMBRIAL PROTEIN

(Pseudomonas
aeruginosa) 		PF00114
(Pilin) 		5 SER A  39
ILE A 116
PRO A 139
SER A  31
GLY A  33
 None
 1.30A 3ijxB-2py0A:
undetectable
3ijxD-2py0A:
undetectable		 3ijxB-2py0A:
19.75
3ijxD-2py0A:
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.
2q3s PROTEIN AT5G06450

(Arabidopsis
thaliana) 		no annotation 5 PRO A  32
SER A   1
LEU A  85
ILE A  22
SER A   3
 None
 1.27A 3ijxB-2q3sA:
undetectable
3ijxD-2q3sA:
undetectable		 3ijxB-2q3sA:
23.16
3ijxD-2q3sA:
23.16
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.
2uyd HEMOPHORE HASA

(Serratia
marcescens) 		PF06438
(HasA) 		5 SER X  91
LEU X 155
ILE X  16
SER X 114
SER X   4
 None
 1.26A 3ijxB-2uydX:
undetectable
3ijxD-2uydX:
undetectable		 3ijxB-2uydX:
20.07
3ijxD-2uydX:
20.07
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.
2xd4 PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Bacillus
subtilis) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 PRO A  73
LEU A  54
ILE A   6
PRO A  70
GLY A   7
 None
 1.24A 3ijxB-2xd4A:
undetectable
3ijxD-2xd4A:
undetectable		 3ijxB-2xd4A:
20.38
3ijxD-2xd4A:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1

(Aspergillus
fumigatus) 		PF00704
(Glyco_hydro_18) 		5 PRO A 160
SER A  98
LEU A 119
ILE A  61
GLY A  74
 None
 1.24A 3ijxB-2xvnA:
undetectable
3ijxD-2xvnA:
undetectable		 3ijxB-2xvnA:
20.36
3ijxD-2xvnA:
20.36
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.
3a79 TOLL-LIKE RECEPTOR
6, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Mus musculus) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		5 LEU B 281
SER B 306
ILE B 283
SER B 339
SER B 337
 None
None
None
NAG  B 951 (-3.3A)
NAG  B 951 ( 4.9A)
 1.38A 3ijxB-3a79B:
undetectable
3ijxD-3a79B:
undetectable		 3ijxB-3a79B:
17.45
3ijxD-3a79B:
17.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aqp PROBABLE SECDF
PROTEIN-EXPORT
MEMBRANE PROTEIN

(Thermus
thermophilus) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG) 		5 SER A 711
LEU A 680
SER A 676
SER A 634
GLY A 704
 None
 1.39A 3ijxB-3aqpA:
undetectable
3ijxD-3aqpA:
undetectable		 3ijxB-3aqpA:
16.42
3ijxD-3aqpA:
16.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fds DNA POLYMERASE
SLIDING CLAMP C

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 PRO D 122
ILE D  40
SER D  38
SER D 119
GLY D  39
 None
 1.10A 3ijxB-3fdsD:
undetectable
3ijxD-3fdsD:
undetectable		 3ijxB-3fdsD:
24.04
3ijxD-3fdsD:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3get HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF00155
(Aminotran_1_2) 		5 SER A 225
LEU A  73
ILE A  86
SER A  90
GLY A  87
 LLP  A 226 ( 2.4A)
None
None
LLP  A 226 ( 2.9A)
None
 1.20A 3ijxB-3getA:
undetectable
3ijxD-3getA:
undetectable		 3ijxB-3getA:
22.58
3ijxD-3getA:
22.58
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.
3glq ADENOSYLHOMOCYSTEINA
SE

(Burkholderia
pseudomallei) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 LEU A 275
SER A 274
ILE A 246
SER A 241
GLY A 245
 None
 1.30A 3ijxB-3glqA:
undetectable
3ijxD-3glqA:
undetectable		 3ijxB-3glqA:
18.38
3ijxD-3glqA:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gqj CELL INHIBITING
FACTOR (CIF)

(Photorhabdus
laumondii) 		PF16374
(CIF) 		5 LEU A 278
SER A 160
ILE A 276
SER A 235
GLY A 154
 None
 1.14A 3ijxB-3gqjA:
undetectable
3ijxD-3gqjA:
undetectable		 3ijxB-3gqjA:
21.00
3ijxD-3gqjA:
21.00
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.
3h3j L-LACTATE
DEHYDROGENASE 1

(Staphylococcus
aureus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A 184
SER A 302
ILE A 176
SER A 258
GLY A 273
 None
 1.27A 3ijxB-3h3jA:
undetectable
3ijxD-3h3jA:
undetectable		 3ijxB-3h3jA:
22.35
3ijxD-3h3jA:
22.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3h6t GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		5 ILE A  92
PRO A 105
SER A 108
SER A 217
GLY A 219
 None
CYZ  A 265 (-3.9A)
CYZ  A 265 (-2.8A)
GOL  A 270 ( 3.0A)
None
 0.64A 3ijxB-3h6tA:
42.8
3ijxD-3h6tA:
42.7		 3ijxB-3h6tA:
100.00
3ijxD-3h6tA:
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.
3i8b XYLULOSE KINASE

(Bifidobacterium
adolescentis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 SER A 295
LEU A 407
ILE A 439
SER A 291
GLY A 433
 None
 1.33A 3ijxB-3i8bA:
undetectable
3ijxD-3i8bA:
undetectable		 3ijxB-3i8bA:
20.66
3ijxD-3i8bA:
20.66
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.
3ihj ALANINE
AMINOTRANSFERASE 2

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		5 LYS A  85
PRO A  86
LEU A  79
ILE A  75
GLY A 475
 None
 1.23A 3ijxB-3ihjA:
undetectable
3ijxD-3ihjA:
undetectable		 3ijxB-3ihjA:
18.90
3ijxD-3ihjA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mog PROBABLE
3-HYDROXYBUTYRYL-COA
DEHYDROGENASE

(Escherichia
coli) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 SER A  37
LEU A  82
ILE A  11
SER A  13
GLY A  12
 None
 1.12A 3ijxB-3mogA:
undetectable
3ijxD-3mogA:
undetectable		 3ijxB-3mogA:
20.04
3ijxD-3mogA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mos TRANSKETOLASE

(Homo sapiens) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 LEU A 262
ILE A 248
SER A  43
SER A  40
GLY A 245
 None
None
TPP  A 700 ( 4.3A)
TPP  A 700 (-2.5A)
None
 1.19A 3ijxB-3mosA:
undetectable
3ijxD-3mosA:
undetectable		 3ijxB-3mosA:
20.36
3ijxD-3mosA:
20.36
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.
3n58 ADENOSYLHOMOCYSTEINA
SE

(Brucella
abortus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 LEU A 268
SER A 267
ILE A 239
SER A 234
GLY A 238
 None
 1.05A 3ijxB-3n58A:
undetectable
3ijxD-3n58A:
undetectable		 3ijxB-3n58A:
22.51
3ijxD-3n58A:
22.51
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.
3nd0 SLL0855 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00654
(Voltage_CLC) 		5 SER A 134
LEU A 297
SER A 298
ILE A 293
GLY A 291
 None
 1.38A 3ijxB-3nd0A:
undetectable
3ijxD-3nd0A:
undetectable		 3ijxB-3nd0A:
17.20
3ijxD-3nd0A:
17.20
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.
3odg XANTHOSINE
PHOSPHORYLASE

(Yersinia
pseudotuberculosis) 		PF01048
(PNP_UDP_1) 		5 PRO A 108
SER A 231
ILE A 104
PRO A  66
GLY A  94
 None
 1.27A 3ijxB-3odgA:
undetectable
3ijxD-3odgA:
undetectable		 3ijxB-3odgA:
23.12
3ijxD-3odgA:
23.12
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.
3pqd L-LACTATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A 183
SER A 302
ILE A 175
SER A 258
GLY A 273
 None
 1.22A 3ijxB-3pqdA:
undetectable
3ijxD-3pqdA:
undetectable		 3ijxB-3pqdA:
22.85
3ijxD-3pqdA:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qqi HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 LEU A  61
ILE A 267
SER A 265
SER A  85
GLY A 266
 None
 1.29A 3ijxB-3qqiA:
undetectable
3ijxD-3qqiA:
undetectable		 3ijxB-3qqiA:
19.00
3ijxD-3qqiA:
19.00
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.
3qyf CRISPR-ASSOCIATED
PROTEIN

(Sulfolobus
solfataricus) 		PF09651
(Cas_APE2256) 		5 LEU A 113
SER A 120
ILE A 109
SER A  96
GLY A 106
 None
 1.23A 3ijxB-3qyfA:
1.2
3ijxD-3qyfA:
undetectable		 3ijxB-3qyfA:
20.43
3ijxD-3qyfA:
20.43
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.
3ru6 OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF00215
(OMPdecase) 		5 PRO A 178
LEU A   3
ILE A 209
PRO A 208
GLY A 206
 IOD  A 287 ( 4.1A)
None
None
IOD  A 282 ( 4.1A)
IOD  A 284 ( 4.5A)
 1.19A 3ijxB-3ru6A:
undetectable
3ijxD-3ru6A:
undetectable		 3ijxB-3ru6A:
21.63
3ijxD-3ru6A:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s0x PEPTIDASE A24B, FLAK
DOMAIN PROTEIN

(Methanococcus
maripaludis) 		PF01478
(Peptidase_A24)
PF06847
(Arc_PepC_II) 		5 PRO A 614
ILE A 562
PRO A 611
SER A 556
GLY A 559
 None
 1.32A 3ijxB-3s0xA:
undetectable
3ijxD-3s0xA:
undetectable		 3ijxB-3s0xA:
19.03
3ijxD-3s0xA:
19.03
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.
3tmg GLYCINE BETAINE,
L-PROLINE ABC
TRANSPORTER,
GLYCINE/BETAINE/L-PR
OLINE-BINDING
PROTEIN (PROX)

(Borreliella
burgdorferi) 		PF04069
(OpuAC) 		5 LEU A 191
ILE A 203
PRO A 115
SER A 180
SER A 176
 None
 1.41A 3ijxB-3tmgA:
13.3
3ijxD-3tmgA:
13.2		 3ijxB-3tmgA:
23.82
3ijxD-3tmgA:
23.82
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.
3uf6 LMO1369 PROTEIN

(Listeria
monocytogenes) 		PF01515
(PTA_PTB) 		5 SER A 199
LEU A 204
ILE A 208
SER A 222
GLY A 224
 None
 1.10A 3ijxB-3uf6A:
undetectable
3ijxD-3uf6A:
undetectable		 3ijxB-3uf6A:
21.22
3ijxD-3uf6A:
21.22
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.
3vxi DYP

(Bjerkandera
adusta) 		PF04261
(Dyp_perox) 		5 SER A 330
LEU A 198
SER A 216
ILE A  11
GLY A  13
 None
 1.25A 3ijxB-3vxiA:
undetectable
3ijxD-3vxiA:
undetectable		 3ijxB-3vxiA:
19.73
3ijxD-3vxiA:
19.73
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.
4aio LIMIT DEXTRINASE

(Hordeum vulgare) 		PF02922
(CBM_48)
PF11852
(DUF3372) 		5 LEU A 676
SER A 672
ILE A 764
SER A 853
SER A 757
 None
None
None
IOD  A1893 ( 4.5A)
None
 1.37A 3ijxB-4aioA:
undetectable
3ijxD-4aioA:
undetectable		 3ijxB-4aioA:
14.89
3ijxD-4aioA:
14.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4am6 ACTIN-LIKE PROTEIN
ARP8

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		5 SER A 407
LEU A 428
ILE A 278
PRO A 273
GLY A 274
 None
None
None
None
SO4  A1882 (-3.1A)
 1.27A 3ijxB-4am6A:
undetectable
3ijxD-4am6A:
undetectable		 3ijxB-4am6A:
17.25
3ijxD-4am6A:
17.25
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.
4asl EPA1P

([Candida]
glabrata) 		PF10528
(GLEYA) 		5 LEU A 221
ILE A 219
SER A 254
SER A  62
GLY A 147
 None
 1.06A 3ijxB-4aslA:
undetectable
3ijxD-4aslA:
undetectable		 3ijxB-4aslA:
22.80
3ijxD-4aslA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cgn GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE

(Leishmania
major) 		PF01233
(NMT)
PF02799
(NMT_C) 		5 SER A 221
ILE A 235
PRO A 236
SER A 233
GLY A 234
 None
 1.41A 3ijxB-4cgnA:
undetectable
3ijxD-4cgnA:
undetectable		 3ijxB-4cgnA:
20.40
3ijxD-4cgnA:
20.40
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.
4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 PRO A 385
LEU A 307
ILE A 309
SER A 274
GLY A 320
 None
 1.34A 3ijxB-4e4gA:
undetectable
3ijxD-4e4gA:
undetectable		 3ijxB-4e4gA:
20.12
3ijxD-4e4gA:
20.12
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.
4fxb PUTATIVE CYTOCHROME
P450

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 LEU A 205
ILE A 169
PRO A 170
SER A 222
GLY A 168
 None
 1.28A 3ijxB-4fxbA:
undetectable
3ijxD-4fxbA:
undetectable		 3ijxB-4fxbA:
19.95
3ijxD-4fxbA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gx8 DNA POLYMERASE III
SUBUNIT EPSILON,DNA
POLYMERASE III
SUBUNIT ALPHA

(Escherichia
coli) 		PF02811
(PHP) 		5 LEU A  33
SER A  31
ILE A 107
PRO A 109
GLY A 102
 None
 1.36A 3ijxB-4gx8A:
undetectable
3ijxD-4gx8A:
undetectable		 3ijxB-4gx8A:
21.98
3ijxD-4gx8A:
21.98
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.
4h5i GUANINE
NUCLEOTIDE-EXCHANGE
FACTOR SEC12

(Saccharomyces
cerevisiae) 		no annotation 5 SER A  79
LEU A 164
SER A 162
ILE A 159
SER A 139
 None
 1.37A 3ijxB-4h5iA:
undetectable
3ijxD-4h5iA:
undetectable		 3ijxB-4h5iA:
23.48
3ijxD-4h5iA:
23.48
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.
4itc LYS-GINGIPAIN W83

(Porphyromonas
gingivalis) 		PF07675
(Cleaved_Adhesin) 		5 LEU A1045
ILE A 993
PRO A 994
SER A 988
GLY A 992
 None
GAI  A1206 (-4.0A)
GOL  A1207 ( 4.9A)
None
None
 1.35A 3ijxB-4itcA:
undetectable
3ijxD-4itcA:
undetectable		 3ijxB-4itcA:
21.17
3ijxD-4itcA:
21.17
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.
4k3c OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

([Haemophilus]
ducreyi) 		PF01103
(Bac_surface_Ag)
PF07244
(POTRA) 		5 LYS A 776
SER A 666
ILE A 782
PRO A 773
GLY A 661
 None
 1.11A 3ijxB-4k3cA:
undetectable
3ijxD-4k3cA:
undetectable		 3ijxB-4k3cA:
20.24
3ijxD-4k3cA:
20.24
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.
4ln1 L-LACTATE
DEHYDROGENASE 1

(Bacillus cereus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A 183
SER A 302
ILE A 175
SER A 258
GLY A 273
 None
 1.28A 3ijxB-4ln1A:
undetectable
3ijxD-4ln1A:
undetectable		 3ijxB-4ln1A:
23.84
3ijxD-4ln1A:
23.84
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.
4lvc S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE)

(Bradyrhizobium
elkanii) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 LEU A 273
SER A 272
ILE A 244
SER A 239
GLY A 243
 None
 1.02A 3ijxB-4lvcA:
undetectable
3ijxD-4lvcA:
undetectable		 3ijxB-4lvcA:
20.89
3ijxD-4lvcA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mhc NUCLEOPORIN NUP157

(Saccharomyces
cerevisiae) 		PF08801
(Nucleoporin_N) 		5 LEU A 599
SER A 576
ILE A 506
PRO A 543
GLY A 505
 None
 1.20A 3ijxB-4mhcA:
undetectable
3ijxD-4mhcA:
undetectable		 3ijxB-4mhcA:
15.74
3ijxD-4mhcA:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r7a HISTONE-BINDING
PROTEIN RBBP4

(Homo sapiens) 		PF00400
(WD40)
PF12265
(CAF1C_H4-bd) 		5 SER B 280
LEU B 306
ILE B 254
SER B 234
GLY B 244
 None
 1.22A 3ijxB-4r7aB:
undetectable
3ijxD-4r7aB:
undetectable		 3ijxB-4r7aB:
19.67
3ijxD-4r7aB:
19.67
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.
4rxt SUGAR ABC
TRANSPORTER

(Agrobacterium
tumefaciens) 		PF13407
(Peripla_BP_4) 		5 LYS A 201
SER A 230
LEU A 217
ILE A 213
GLY A 210
 None
 1.41A 3ijxB-4rxtA:
2.5
3ijxD-4rxtA:
2.5		 3ijxB-4rxtA:
25.39
3ijxD-4rxtA:
25.39
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.
4ut1 FLAGELLAR
HOOK-ASSOCIATED
PROTEIN

(Burkholderia
pseudomallei) 		PF06429
(Flg_bbr_C) 		5 SER A 383
LEU A 367
SER A 368
ILE A 399
GLY A 386
 None
 1.35A 3ijxB-4ut1A:
undetectable
3ijxD-4ut1A:
undetectable		 3ijxB-4ut1A:
16.17
3ijxD-4ut1A:
16.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yk8 AUTOPHAGY PROTEIN 13

(Schizosaccharomyces
pombe) 		PF10033
(ATG13) 		5 PRO B 249
LEU B 156
ILE B  44
SER B  37
GLY B  41
 None
 1.31A 3ijxB-4yk8B:
undetectable
3ijxD-4yk8B:
undetectable		 3ijxB-4yk8B:
22.42
3ijxD-4yk8B:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE

(Vesicular
stomatitis
virus) 		PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap) 		5 SER A1093
ILE A 884
PRO A 933
SER A 952
GLY A 885
 None
 1.36A 3ijxB-5a22A:
undetectable
3ijxD-5a22A:
undetectable		 3ijxB-5a22A:
8.17
3ijxD-5a22A:
8.17
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.
5bob TRANSLATION
INITIATION FACTOR 2
(IF-2 GTPASE)

(Streptococcus
suis) 		no annotation 5 LEU A 293
ILE A 287
SER A 317
SER A 189
GLY A 195
 None
 1.34A 3ijxB-5bobA:
undetectable
3ijxD-5bobA:
undetectable		 3ijxB-5bobA:
21.30
3ijxD-5bobA:
21.30
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.
5bs5 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Acinetobacter
baumannii) 		PF00275
(EPSP_synthase) 		5 LEU A 477
SER A 481
ILE A 488
SER A 414
GLY A 487
 None
 1.28A 3ijxB-5bs5A:
undetectable
3ijxD-5bs5A:
undetectable		 3ijxB-5bs5A:
22.19
3ijxD-5bs5A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fby SEPARASE

(Chaetomium
thermophilum) 		PF03568
(Peptidase_C50) 		5 PRO A2020
ILE A2077
PRO A2076
SER A2054
GLY A2024
 None
 1.06A 3ijxB-5fbyA:
undetectable
3ijxD-5fbyA:
undetectable		 3ijxB-5fbyA:
17.94
3ijxD-5fbyA:
17.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ghf AMINOTRANSFERASE
CLASS-III

(Ochrobactrum
anthropi) 		PF00202
(Aminotran_3) 		5 SER A  59
LEU A 347
ILE A 430
PRO A 428
GLY A  63
 None
 1.28A 3ijxB-5ghfA:
undetectable
3ijxD-5ghfA:
undetectable		 3ijxB-5ghfA:
19.21
3ijxD-5ghfA:
19.21
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.
5hn4 HOMOISOCITRATE
DEHYDROGENASE

(Thermococcus
kodakarensis) 		PF00180
(Iso_dh) 		5 PRO A 248
LEU A  65
ILE A  17
SER A 252
GLY A  13
 None
 1.19A 3ijxB-5hn4A:
undetectable
3ijxD-5hn4A:
undetectable		 3ijxB-5hn4A:
22.16
3ijxD-5hn4A:
22.16
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.
5hzw MALTOSE-BINDING
PERIPLASMIC
PROTEIN,ENDOGLIN

(Escherichia
coli;
Homo sapiens) 		PF13416
(SBP_bac_8) 		5 LEU A 572
SER A 485
ILE A 514
PRO A 515
GLY A 513
 None
 1.37A 3ijxB-5hzwA:
8.3
3ijxD-5hzwA:
8.1		 3ijxB-5hzwA:
17.77
3ijxD-5hzwA:
17.77
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.
5irp ALANINE RACEMASE 2

(Bacillus
subtilis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 SER A 300
LEU A 253
ILE A 289
SER A 296
GLY A 290
 None
 1.34A 3ijxB-5irpA:
undetectable
3ijxD-5irpA:
undetectable		 3ijxB-5irpA:
21.64
3ijxD-5irpA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kc8 GLUTAMATE RECEPTOR
IONOTROPIC, DELTA-2

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 SER A 354
LEU A  93
ILE A  90
SER A 352
GLY A  89
 None
 1.35A 3ijxB-5kc8A:
undetectable
3ijxD-5kc8A:
undetectable		 3ijxB-5kc8A:
19.63
3ijxD-5kc8A:
19.63
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.
5l2e GLUTAMATE RECEPTOR
IONOTROPIC,
DELTA-2,GLUTAMATE
RECEPTOR IONOTROPIC,
DELTA-2

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 SER A 354
LEU A  93
ILE A  90
SER A 352
GLY A  89
 None
 1.33A 3ijxB-5l2eA:
27.8
3ijxD-5l2eA:
27.7		 3ijxB-5l2eA:
16.59
3ijxD-5l2eA:
16.59
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.
5lcw CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 SER Q 285
LEU Q 189
ILE Q 229
SER Q 273
GLY Q 244
 None
 1.39A 3ijxB-5lcwQ:
undetectable
3ijxD-5lcwQ:
undetectable		 3ijxB-5lcwQ:
19.44
3ijxD-5lcwQ:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lcw CELL DIVISION CYCLE
PROTEIN 20 HOMOLOG

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 SER R 285
LEU R 189
ILE R 229
SER R 273
GLY R 244
 None
 1.39A 3ijxB-5lcwR:
undetectable
3ijxD-5lcwR:
undetectable		 3ijxB-5lcwR:
18.65
3ijxD-5lcwR:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n0g PRECORRIN-8X
METHYLMUTASE

(Rhodobacter
capsulatus) 		no annotation 5 PRO A 138
SER A 116
ILE A 134
PRO A 163
GLY A 135
 None
 1.15A 3ijxB-5n0gA:
undetectable
3ijxD-5n0gA:
undetectable		 3ijxB-5n0gA:
15.42
3ijxD-5n0gA:
15.42
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.
5n8n EVPB FAMILY TYPE VI
SECRETION PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 PRO B 192
ILE B 194
SER B 369
SER B 237
GLY B 241
 None
 1.27A 3ijxB-5n8nB:
undetectable
3ijxD-5n8nB:
undetectable		 3ijxB-5n8nB:
14.40
3ijxD-5n8nB:
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.
5nfg PROCARDOSIN-B,PROCAR
DOSIN-B

(Cynara
cardunculus) 		no annotation 5 SER A 110
LEU A  86
ILE A  66
SER A 137
GLY A  67
 None
 1.39A 3ijxB-5nfgA:
undetectable
3ijxD-5nfgA:
undetectable		 3ijxB-5nfgA:
20.41
3ijxD-5nfgA:
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.
5oev GLUTATHIONE
SYNTHETASE-LIKE
EFFECTOR 22
(GPA-GSS22-APO)

(Globodera
pallida) 		no annotation 5 SER A 192
LEU A 125
ILE A 127
SER A 458
GLY A 441
 None
 1.24A 3ijxB-5oevA:
undetectable
3ijxD-5oevA:
undetectable		 3ijxB-5oevA:
17.05
3ijxD-5oevA:
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.
5okz EXOSOME COMPLEX
COMPONENT MTR3

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH) 		5 LEU F 127
ILE F 135
PRO F  80
SER F  82
GLY F 134
 None
 1.37A 3ijxB-5okzF:
undetectable
3ijxD-5okzF:
undetectable		 3ijxB-5okzF:
20.96
3ijxD-5okzF:
20.96
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 SER A 164
LEU A 299
ILE A 301
SER A 286
GLY A 308
 FAD  A 601 ( 3.9A)
None
None
FAD  A 601 ( 3.8A)
None
 1.34A 3ijxB-5u25A:
undetectable
3ijxD-5u25A:
undetectable		 3ijxB-5u25A:
18.96
3ijxD-5u25A:
18.96
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.
5uj1 DNA TOPOISOMERASE 1

(Mycobacterium
tuberculosis) 		no annotation 5 LYS A  28
LEU A  32
SER A  34
ILE A 141
GLY A 338
 None
 1.03A 3ijxB-5uj1A:
undetectable
3ijxD-5uj1A:
undetectable		 3ijxB-5uj1A:
14.92
3ijxD-5uj1A:
14.92
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.
5uqz GLUCAN-BINDING
PROTEIN C, GBPC

(Streptococcus
mutans) 		no annotation 5 LEU A 364
ILE A 384
SER A 346
SER A 344
GLY A 426
 None
 1.37A 3ijxB-5uqzA:
undetectable
3ijxD-5uqzA:
undetectable		 3ijxB-5uqzA:
16.06
3ijxD-5uqzA:
16.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 ILE A 481
PRO A 494
SER A 497
SER A 729
GLY A 731
 None
CYZ  A1302 (-4.5A)
CYZ  A1302 (-3.2A)
None
None
 0.55A 3ijxB-5weoA:
25.2
3ijxD-5weoA:
25.2		 3ijxB-5weoA:
66.93
3ijxD-5weoA:
66.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 LYS A 493
PRO A 494
SER A 497
LEU A 751
SER A 754
 None
CYZ  A1302 (-4.5A)
CYZ  A1302 (-3.2A)
None
CYZ  A1302 ( 4.1A)
 0.90A 3ijxB-5weoA:
25.2
3ijxD-5weoA:
25.2		 3ijxB-5weoA:
66.93
3ijxD-5weoA:
66.93
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.
5wue UNCHARACTERIZED
PROTEIN

(Sulfolobus
acidocaldarius) 		PF03458
(UPF0126) 		5 SER A  23
LEU A 142
SER A 143
ILE A 138
GLY A 136
 None
 1.05A 3ijxB-5wueA:
undetectable
3ijxD-5wueA:
undetectable		 3ijxB-5wueA:
21.62
3ijxD-5wueA:
21.62
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.
5xtd NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Homo sapiens) 		PF15879
(MWFE) 		5 SER s 163
LEU s 237
ILE s 105
PRO s  88
GLY s 101
 None
 1.17A 3ijxB-5xtds:
undetectable
3ijxD-5xtds:
undetectable		 3ijxB-5xtds:
20.86
3ijxD-5xtds:
20.86
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.
5yzc GLYCOPROTEIN
F1,MEASLES VIRUS
FUSION PROTEIN

(Measles
morbillivirus) 		no annotation 5 LEU B 246
ILE B 265
PRO B 286
SER B 344
GLY B 264
 None
 1.31A 3ijxB-5yzcB:
undetectable
3ijxD-5yzcB:
undetectable		 3ijxB-5yzcB:
14.40
3ijxD-5yzcB:
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.
6ape BIFUNCTIONAL PROTEIN
FOLD

(Helicobacter
pylori) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 PRO A 143
ILE A 174
PRO A 146
SER A 179
GLY A 175
 None
 1.32A 3ijxB-6apeA:
undetectable
3ijxD-6apeA:
undetectable		 3ijxB-6apeA:
22.96
3ijxD-6apeA:
22.96
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.
6bxe VARIABLE LYMPHOCYTE
RECEPTOR DIVERSITY
REGION

(Petromyzon
marinus) 		no annotation 5 LEU A  54
ILE A  47
PRO A  23
SER A  42
GLY A  45
 None
 1.32A 3ijxB-6bxeA:
undetectable
3ijxD-6bxeA:
undetectable		 3ijxB-6bxeA:
14.40
3ijxD-6bxeA:
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 5 LYS A 196
LEU A 229
ILE A 192
SER A 202
GLY A 191
 None
 1.21A 3ijxB-6cmzA:
undetectable
3ijxD-6cmzA:
undetectable		 3ijxB-6cmzA:
18.55
3ijxD-6cmzA:
18.55
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.
6cyz HOMOSERINE KINASE

(Mycobacteroides
abscessus) 		no annotation 5 PRO A 269
LEU A 100
SER A  19
ILE A 184
PRO A 185
 None
 1.36A 3ijxB-6cyzA:
undetectable
3ijxD-6cyzA:
undetectable		 3ijxB-6cyzA:
16.67
3ijxD-6cyzA:
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.
6d04 RETICULOCYTE BINDING
PROTEIN 2, PUTATIVE

(Plasmodium
vivax) 		no annotation 5 LYS E 576
LEU E 580
SER E 582
ILE E 567
PRO E 568
 None
 1.19A 3ijxB-6d04E:
undetectable
3ijxD-6d04E:
undetectable		 3ijxB-6d04E:
22.35
3ijxD-6d04E:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eo2 TRANSCRIPTIONAL
REGULATORY PROTEIN
RCSB

(Salmonella
enterica) 		no annotation 5 LYS A  72
SER A  38
LEU A 101
ILE A  68
GLY A  67
 None
 1.35A 3ijxB-6eo2A:
undetectable
3ijxD-6eo2A:
undetectable		 3ijxB-6eo2A:
25.76
3ijxD-6eo2A:
25.76