SIMILAR PATTERNS OF AMINO ACIDS FOR 5L5F_Y_BO2Y301

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.
1aos ARGININOSUCCINATE
LYASE

(Homo sapiens) 		PF00206
(Lyase_1)
PF14698
(ASL_C2) 		4 SER A 234
ALA A 203
ASP A 115
SER A 112
 None
 1.06A 5l5fY-1aosA:
0.0
5l5fZ-1aosA:
undetectable		 5l5fY-1aosA:
18.32
5l5fZ-1aosA:
19.29
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.
1du5 ZEAMATIN

(Zea mays) 		PF00314
(Thaumatin) 		4 THR A  81
ALA A 180
ASP A 186
SER A 190
 None
 1.13A 5l5fY-1du5A:
undetectable
5l5fZ-1du5A:
0.0		 5l5fY-1du5A:
20.94
5l5fZ-1du5A:
23.32
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.
1e5m BETA KETOACYL ACYL
CARRIER PROTEIN
SYNTHASE II

(Synechocystis
sp. PCC 6803) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 THR A 342
SER A 337
SER A 336
ALA A 356
 None
 0.96A 5l5fY-1e5mA:
0.0
5l5fZ-1e5mA:
0.0		 5l5fY-1e5mA:
19.31
5l5fZ-1e5mA:
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.
1e6y METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanosarcina
barkeri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		4 SER A1434
ALA A1429
ASP A1363
SER A1397
 None
 1.10A 5l5fY-1e6yA:
0.0
5l5fZ-1e6yA:
0.0		 5l5fY-1e6yA:
18.52
5l5fZ-1e6yA:
17.18
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.
1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE

(Paraburkholderia
xenovorans) 		PF00903
(Glyoxalase) 		4 SER A 287
SER A 236
MET A 175
SER A 281
 None
P6G  A 600 ( 4.0A)
P6G  A 600 (-4.4A)
BP6  A 300 ( 4.3A)
 1.12A 5l5fY-1lkdA:
0.0
5l5fZ-1lkdA:
undetectable		 5l5fY-1lkdA:
22.01
5l5fZ-1lkdA:
21.43
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.
1llp LIGNIN PEROXIDASE

(Phanerochaete
chrysosporium) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 SER A  53
ALA A 139
ASP A  68
SER A  70
 None
None
CA  A 351 (-3.1A)
CA  A 351 (-2.4A)
 1.12A 5l5fY-1llpA:
0.0
5l5fZ-1llpA:
0.0		 5l5fY-1llpA:
17.44
5l5fZ-1llpA:
21.10
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.
1lzk HEROIN ESTERASE

(Rhodococcus sp.) 		PF07859
(Abhydrolase_3) 		4 THR A   6
SER A 284
ASP A 264
SER A 199
 None
 0.95A 5l5fY-1lzkA:
0.0
5l5fZ-1lzkA:
0.0		 5l5fY-1lzkA:
22.26
5l5fZ-1lzkA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mox EPIDERMAL GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		4 THR A 278
SER A 291
ALA A 286
SER A 342
 None
 1.06A 5l5fY-1moxA:
undetectable
5l5fZ-1moxA:
undetectable		 5l5fY-1moxA:
17.66
5l5fZ-1moxA:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pcv OSMOTIN

(Nicotiana
tabacum) 		PF00314
(Thaumatin) 		4 THR A  81
ALA A 178
ASP A 184
SER A 188
 None
 1.06A 5l5fY-1pcvA:
undetectable
5l5fZ-1pcvA:
0.0		 5l5fY-1pcvA:
22.04
5l5fZ-1pcvA:
18.29
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.
1t6p PHENYLALANINE
AMMONIA-LYASE

(Rhodotorula
toruloides) 		PF00221
(Lyase_aromatic) 		4 THR A 513
ALA A 506
ASP A 214
SER A 210
 None
None
175  A 211 ( 4.2A)
175  A 211 ( 4.7A)
 1.10A 5l5fY-1t6pA:
undetectable
5l5fZ-1t6pA:
undetectable		 5l5fY-1t6pA:
14.89
5l5fZ-1t6pA:
16.62
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.
1t9f PROTEIN 1D10

(Caenorhabditis
elegans) 		PF02815
(MIR) 		4 SER A 163
ALA A  61
ASP A  39
SER A  41
 None
 1.12A 5l5fY-1t9fA:
undetectable
5l5fZ-1t9fA:
undetectable		 5l5fY-1t9fA:
20.78
5l5fZ-1t9fA:
22.76
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.
1wcg THIOGLUCOSIDASE

(Brevicoryne
brassicae) 		PF00232
(Glyco_hydro_1) 		4 SER A  14
SER A 417
ASP A  64
SER A  57
 None
 1.13A 5l5fY-1wcgA:
0.0
5l5fZ-1wcgA:
undetectable		 5l5fY-1wcgA:
18.61
5l5fZ-1wcgA:
19.64
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.
1wlp NEUTROPHIL CYTOSOL
FACTOR 1

(Homo sapiens) 		PF00018
(SH3_1) 		4 SER B 191
SER B 277
ALA B 207
SER B 208
 None
 1.04A 5l5fY-1wlpB:
undetectable
5l5fZ-1wlpB:
undetectable		 5l5fY-1wlpB:
22.56
5l5fZ-1wlpB:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yln HYPOTHETICAL PROTEIN
VCA0042

(Vibrio cholerae) 		PF07238
(PilZ)
PF12945
(YcgR_2) 		4 THR A  58
SER A 109
MET A  73
ALA A 122
 None
 1.01A 5l5fY-1ylnA:
undetectable
5l5fZ-1ylnA:
undetectable		 5l5fY-1ylnA:
23.19
5l5fZ-1ylnA:
21.43
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.
1yzp PEROXIDASE
MANGANESE-DEPENDENT
I

(Phanerochaete
chrysosporium) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 SER A  52
ALA A 136
ASP A  64
SER A  66
 None
None
CA  A 372 (-3.1A)
CA  A 372 (-2.4A)
 1.08A 5l5fY-1yzpA:
undetectable
5l5fZ-1yzpA:
undetectable		 5l5fY-1yzpA:
19.61
5l5fZ-1yzpA:
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.
1ztm FUSION GLYCOPROTEIN

(Human
respirovirus 3) 		PF00523
(Fusion_gly) 		4 THR A 390
SER A 300
ALA A 377
ASP A 297
 None
 1.13A 5l5fY-1ztmA:
undetectable
5l5fZ-1ztmA:
undetectable		 5l5fY-1ztmA:
15.65
5l5fZ-1ztmA:
19.80
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.
2aex COPROPORPHYRINOGEN
III OXIDASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01218
(Coprogen_oxidas) 		4 THR A 409
MET A 222
ALA A 218
SER A 215
 None
 1.11A 5l5fY-2aexA:
undetectable
5l5fZ-2aexA:
0.0		 5l5fY-2aexA:
19.88
5l5fZ-2aexA:
22.29
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.
2axq SACCHAROPINE
DEHYDROGENASE

(Saccharomyces
cerevisiae) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		4 SER A 172
ALA A 392
ASP A 355
SER A 389
 None
 1.06A 5l5fY-2axqA:
undetectable
5l5fZ-2axqA:
undetectable		 5l5fY-2axqA:
18.43
5l5fZ-2axqA:
19.87
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.
2b81 LUCIFERASE-LIKE
MONOOXYGENASE

(Bacillus cereus) 		PF00296
(Bac_luciferase) 		4 THR A 197
SER A 133
SER A 105
ASP A 139
 None
SO4  A2429 ( 4.7A)
None
None
 0.88A 5l5fY-2b81A:
undetectable
5l5fZ-2b81A:
undetectable		 5l5fY-2b81A:
21.32
5l5fZ-2b81A:
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.
2be1 SERINE/THREONINE-PRO
TEIN
KINASE/ENDORIBONUCLE
ASE IRE1

(Saccharomyces
cerevisiae) 		no annotation 4 THR A 165
ALA A 295
ASP A 221
SER A 291
 None
 0.94A 5l5fY-2be1A:
undetectable
5l5fZ-2be1A:
undetectable		 5l5fY-2be1A:
21.96
5l5fZ-2be1A:
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.
2cw6 HYDROXYMETHYLGLUTARY
L-COA LYASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00682
(HMGL-like) 		4 SER A 142
SER A 146
LYS A 184
SER A 169
 None
 1.05A 5l5fY-2cw6A:
undetectable
5l5fZ-2cw6A:
undetectable		 5l5fY-2cw6A:
21.04
5l5fZ-2cw6A:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fhg PROTEASOME, BETA
SUBUNIT

(Mycobacterium
tuberculosis) 		no annotation 4 THR H 301
SER H 327
LYS H 333
ALA H 349
 None
 0.42A 5l5fY-2fhgH:
25.6
5l5fZ-2fhgH:
22.0		 5l5fY-2fhgH:
26.67
5l5fZ-2fhgH:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g1s RENIN

(Homo sapiens) 		PF00026
(Asp) 		4 THR A  34
SER A  79
ALA A 309
SER A 228
 None
4IG  A 885 (-3.0A)
None
None
 1.11A 5l5fY-2g1sA:
undetectable
5l5fZ-2g1sA:
undetectable		 5l5fY-2g1sA:
22.04
5l5fZ-2g1sA:
22.69
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.
2g76 D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Homo sapiens) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 THR A  97
SER A  54
ALA A 285
SER A 286
 None
MLT  A 503 (-2.7A)
MLT  A 503 ( 3.3A)
None
 1.08A 5l5fY-2g76A:
undetectable
5l5fZ-2g76A:
undetectable		 5l5fY-2g76A:
23.66
5l5fZ-2g76A:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gh4 PUTATIVE GLYCOSYL
HYDROLASE YTER

(Bacillus
subtilis) 		PF07470
(Glyco_hydro_88) 		4 THR A 316
SER A 277
SER A 280
ASP A 255
 None
 1.00A 5l5fY-2gh4A:
undetectable
5l5fZ-2gh4A:
undetectable		 5l5fY-2gh4A:
21.21
5l5fZ-2gh4A:
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.
2nyf NOSTOC PUNCTIFORME
PHENYLALANINE
AMMONIA LYASE

(Nostoc
punctiforme) 		PF00221
(Lyase_aromatic) 		4 THR A 178
SER A 226
ALA A 220
SER A 137
 None
 1.12A 5l5fY-2nyfA:
undetectable
5l5fZ-2nyfA:
undetectable		 5l5fY-2nyfA:
16.02
5l5fZ-2nyfA:
16.87
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.
2o3i HYPOTHETICAL PROTEIN

(Chromobacterium
violaceum) 		PF06032
(DUF917) 		4 SER A 301
SER A  22
ALA A 314
ASP A 318
 None
 1.11A 5l5fY-2o3iA:
undetectable
5l5fZ-2o3iA:
undetectable		 5l5fY-2o3iA:
20.92
5l5fZ-2o3iA:
19.85
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.
2poz PUTATIVE DEHYDRATASE

(Mesorhizobium
japonicum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 THR A 261
SER A  94
ALA A  82
SER A  79
 None
 0.85A 5l5fY-2pozA:
undetectable
5l5fZ-2pozA:
undetectable		 5l5fY-2pozA:
20.22
5l5fZ-2pozA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE

(Photobacterium
phosphoreum) 		PF11477
(PM0188) 		4 SER A 180
SER A 181
ASP A 189
SER A 191
 None
 1.13A 5l5fY-2zwiA:
undetectable
5l5fZ-2zwiA:
undetectable		 5l5fY-2zwiA:
19.95
5l5fZ-2zwiA:
21.68
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.
3b40 PROBABLE DIPEPTIDASE

(Pseudomonas
aeruginosa) 		PF01244
(Peptidase_M19) 		4 THR A  61
SER A 389
SER A 388
SER A 243
 None
 1.10A 5l5fY-3b40A:
undetectable
5l5fZ-3b40A:
undetectable		 5l5fY-3b40A:
19.22
5l5fZ-3b40A:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ebb PHOSPHOLIPASE
A2-ACTIVATING
PROTEIN

(Homo sapiens) 		PF08324
(PUL) 		4 THR A 731
SER A 692
SER A 694
ALA A 687
 None
 1.11A 5l5fY-3ebbA:
undetectable
5l5fZ-3ebbA:
undetectable		 5l5fY-3ebbA:
21.64
5l5fZ-3ebbA:
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.
3f5c NUCLEAR RECEPTOR
SUBFAMILY 0 GROUP B
MEMBER 1

(Mus musculus) 		PF00104
(Hormone_recep) 		4 THR B 267
MET B 298
ALA B 294
SER B 443
 None
 1.07A 5l5fY-3f5cB:
undetectable
5l5fZ-3f5cB:
undetectable		 5l5fY-3f5cB:
20.71
5l5fZ-3f5cB:
20.59
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.
3gpr RHODOCETIN SUBUNIT
GAMMA

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		4 THR C3098
SER C3101
ASP C3074
SER C3082
 None
 1.01A 5l5fY-3gprC:
undetectable
5l5fZ-3gprC:
undetectable		 5l5fY-3gprC:
17.14
5l5fZ-3gprC:
20.18
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.
3hvd PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		4 THR A 488
SER A 230
SER A 227
ALA A 258
 None
 1.05A 5l5fY-3hvdA:
undetectable
5l5fZ-3hvdA:
undetectable		 5l5fY-3hvdA:
16.76
5l5fZ-3hvdA:
18.62
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.
3igh UNCHARACTERIZED
METAL-DEPENDENT
HYDROLASE

(Pyrococcus
horikoshii) 		PF07969
(Amidohydro_3) 		4 SER X  82
SER X 222
ALA X 328
ASP X 326
 None
 1.11A 5l5fY-3ighX:
undetectable
5l5fZ-3ighX:
undetectable		 5l5fY-3ighX:
18.81
5l5fZ-3ighX:
20.68
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.
3lrh ANTI-HUNTINGTIN VL
DOMAIN

(Homo sapiens) 		PF07686
(V-set) 		4 THR A  19
SER A  64
ALA A  72
ASP A  52
 None
 1.09A 5l5fY-3lrhA:
undetectable
5l5fZ-3lrhA:
undetectable		 5l5fY-3lrhA:
20.74
5l5fZ-3lrhA:
19.82
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.
3mj8 STIMULATORY HAMSTER
ANTIBODY HL4E10 FAB
LIGHT CHAIN

(Cricetulus
migratorius) 		no annotation 4 THR L  20
SER L  63
ALA L  71
ASP L  51
 None
 1.10A 5l5fY-3mj8L:
undetectable
5l5fZ-3mj8L:
undetectable		 5l5fY-3mj8L:
21.69
5l5fZ-3mj8L:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n2z LYSOSOMAL PRO-X
CARBOXYPEPTIDASE

(Homo sapiens) 		PF05577
(Peptidase_S28) 		4 THR B  90
ALA B 202
ASP B 458
SER B 425
 None
 1.12A 5l5fY-3n2zB:
undetectable
5l5fZ-3n2zB:
undetectable		 5l5fY-3n2zB:
18.59
5l5fZ-3n2zB:
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.
3ncy ADIC

(Salmonella
enterica) 		PF13520
(AA_permease_2) 		4 THR A  89
ALA A  75
ASP A  67
SER A  69
 None
 1.09A 5l5fY-3ncyA:
undetectable
5l5fZ-3ncyA:
undetectable		 5l5fY-3ncyA:
17.50
5l5fZ-3ncyA:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nz4 PHENYLALANINE
AMMONIA-LYASE

(Taxus
canadensis) 		PF00221
(Lyase_aromatic) 		4 SER A 351
MET A 152
ASP A 354
SER A 145
 None
 1.13A 5l5fY-3nz4A:
undetectable
5l5fZ-3nz4A:
undetectable		 5l5fY-3nz4A:
14.56
5l5fZ-3nz4A:
14.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3out GLUTAMATE RACEMASE

(Francisella
tularensis) 		PF01177
(Asp_Glu_race) 		4 THR A  18
SER A 209
ASP A  96
SER A  78
 None
 1.11A 5l5fY-3outA:
undetectable
5l5fZ-3outA:
undetectable		 5l5fY-3outA:
21.05
5l5fZ-3outA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT N

(Escherichia
coli) 		no annotation 4 THR N 244
SER N 302
SER N 301
ALA N 340
 None
 1.13A 5l5fY-3rkoN:
undetectable
5l5fZ-3rkoN:
undetectable		 5l5fY-3rkoN:
19.38
5l5fZ-3rkoN:
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.
3s6b METHIONINE
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF00557
(Peptidase_M24) 		4 THR A 336
SER A 195
SER A 155
ALA A 115
 None
 1.10A 5l5fY-3s6bA:
undetectable
5l5fZ-3s6bA:
undetectable		 5l5fY-3s6bA:
20.22
5l5fZ-3s6bA:
21.02
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.
3tex PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		4 THR A 488
SER A 230
SER A 227
ALA A 258
 None
 1.08A 5l5fY-3texA:
undetectable
5l5fZ-3texA:
undetectable		 5l5fY-3texA:
13.72
5l5fZ-3texA:
15.59
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.
3tlm SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 1

(Bos taurus) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF08282
(Hydrolase_3)
PF13246
(Cation_ATPase) 		4 THR A 804
SER A 935
SER A 939
ALA A 100
 None
 1.11A 5l5fY-3tlmA:
undetectable
5l5fZ-3tlmA:
undetectable		 5l5fY-3tlmA:
12.65
5l5fZ-3tlmA:
12.00
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.
4bct THAUMATIN-LIKE
PROTEIN

(Actinidia
deliciosa) 		PF00314
(Thaumatin) 		4 THR A 104
ALA A 199
ASP A 205
SER A 209
 None
 1.10A 5l5fY-4bctA:
undetectable
5l5fZ-4bctA:
undetectable		 5l5fY-4bctA:
18.58
5l5fZ-4bctA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bj8 ZEBAVIDIN

(Danio rerio) 		PF01382
(Avidin) 		4 THR A  40
SER A 100
SER A 111
ASP A 103
 None
BTN  A1123 ( 4.8A)
None
None
 1.02A 5l5fY-4bj8A:
undetectable
5l5fZ-4bj8A:
undetectable		 5l5fY-4bj8A:
24.41
5l5fZ-4bj8A:
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.
4ct4 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF16415
(CNOT1_CAF1_bind) 		4 SER A1145
LYS A1203
ALA A1200
SER A1240
 None
 0.96A 5l5fY-4ct4A:
undetectable
5l5fZ-4ct4A:
undetectable		 5l5fY-4ct4A:
19.69
5l5fZ-4ct4A:
23.96
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.
4cv5 GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF12842
(DUF3819) 		4 THR A1210
SER A1112
SER A1111
ALA A1204
 None
 1.05A 5l5fY-4cv5A:
undetectable
5l5fZ-4cv5A:
undetectable		 5l5fY-4cv5A:
21.83
5l5fZ-4cv5A:
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.
4e21 6-PHOSPHOGLUCONATE
DEHYDROGENASE
(DECARBOXYLATING)

(Geobacter
metallireducens) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		4 SER A  74
ALA A  69
ASP A  91
SER A  95
 None
 1.02A 5l5fY-4e21A:
undetectable
5l5fZ-4e21A:
undetectable		 5l5fY-4e21A:
21.24
5l5fZ-4e21A:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4exl PHOSPHATE-BINDING
PROTEIN PSTS 1

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		4 THR A 203
SER A 233
ALA A  40
SER A  38
 None
CL  A 305 (-4.9A)
None
None
 1.08A 5l5fY-4exlA:
undetectable
5l5fZ-4exlA:
undetectable		 5l5fY-4exlA:
23.44
5l5fZ-4exlA:
23.44
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.
4f4f THREONINE SYNTHASE

(Brucella
melitensis) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		4 SER A 217
ALA A 463
ASP A 159
SER A 461
 None
 1.05A 5l5fY-4f4fA:
undetectable
5l5fZ-4f4fA:
undetectable		 5l5fY-4f4fA:
17.21
5l5fZ-4f4fA:
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.
4fbl LIPS LIPOLYTIC
ENZYME

(unidentified) 		PF12146
(Hydrolase_4) 		4 SER A 255
SER A 224
MET A  65
SER A 126
 None
None
None
SPD  A 301 ( 2.3A)
 1.02A 5l5fY-4fblA:
undetectable
5l5fZ-4fblA:
undetectable		 5l5fY-4fblA:
21.20
5l5fZ-4fblA:
20.34
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.
4gvf BETA-HEXOSAMINIDASE

(Salmonella
enterica) 		PF00933
(Glyco_hydro_3) 		4 THR A 179
SER A 127
ALA A 212
ASP A 122
 None
 1.13A 5l5fY-4gvfA:
undetectable
5l5fZ-4gvfA:
undetectable		 5l5fY-4gvfA:
21.51
5l5fZ-4gvfA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jru THAUMATIN-LIKE
PROTEIN

(Vitis vinifera) 		PF00314
(Thaumatin) 		4 THR A 104
ALA A 199
ASP A 205
SER A 209
 None
 1.12A 5l5fY-4jruA:
undetectable
5l5fZ-4jruA:
undetectable		 5l5fY-4jruA:
20.85
5l5fZ-4jruA:
21.25
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.
4kpg MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		4 SER A 118
ALA A 159
ASP A 121
SER A 157
 None
 1.11A 5l5fY-4kpgA:
undetectable
5l5fZ-4kpgA:
undetectable		 5l5fY-4kpgA:
20.72
5l5fZ-4kpgA:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l5h VVTL1

(Vitis vinifera) 		PF00314
(Thaumatin) 		4 THR A 104
ALA A 196
ASP A 202
SER A 206
 None
 1.07A 5l5fY-4l5hA:
undetectable
5l5fZ-4l5hA:
undetectable		 5l5fY-4l5hA:
21.65
5l5fZ-4l5hA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l63 ECXA

(Escherichia
coli) 		PF16313
(DUF4953) 		4 SER A 216
SER A 246
ALA A 206
SER A 270
 None
 0.88A 5l5fY-4l63A:
undetectable
5l5fZ-4l63A:
undetectable		 5l5fY-4l63A:
20.93
5l5fZ-4l63A:
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.
4nik SINGLE-CHAIN FV
FRAGMENT ANTIBODY

(Homo sapiens) 		PF07686
(V-set) 		4 THR B 153
SER B 199
ALA B 207
ASP B 187
 None
 0.97A 5l5fY-4nikB:
undetectable
5l5fZ-4nikB:
undetectable		 5l5fY-4nikB:
20.55
5l5fZ-4nikB:
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.
4ql6 CARBOXY-TERMINAL
PROCESSING PROTEASE

(Chlamydia
trachomatis) 		PF00595
(PDZ)
PF03572
(Peptidase_S41) 		4 THR A 359
SER A 453
ASP A 475
SER A 527
 None
 1.10A 5l5fY-4ql6A:
undetectable
5l5fZ-4ql6A:
undetectable		 5l5fY-4ql6A:
17.14
5l5fZ-4ql6A:
16.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r3u 2-HYDROXYISOBUTYRYL-
COA MUTASE LARGE
SUBUNIT

(Aquincola
tertiaricarbonis) 		PF01642
(MM_CoA_mutase) 		4 THR A  99
ALA A 143
ASP A 145
SER A 128
 None
 1.04A 5l5fY-4r3uA:
undetectable
5l5fZ-4r3uA:
undetectable		 5l5fY-4r3uA:
15.25
5l5fZ-4r3uA:
19.66
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		4 SER A 319
SER A 321
ALA A 311
SER A 289
 None
 1.04A 5l5fY-4sliA:
undetectable
5l5fZ-4sliA:
undetectable		 5l5fY-4sliA:
16.33
5l5fZ-4sliA:
16.77
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.
4u6u COG5

(Kluyveromyces
lactis) 		PF10392
(COG5) 		4 SER B 253
SER B 252
ALA B 259
SER B 328
 None
 1.10A 5l5fY-4u6uB:
undetectable
5l5fZ-4u6uB:
undetectable		 5l5fY-4u6uB:
25.00
5l5fZ-4u6uB:
20.34
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.
4upi SULFATASE FAMILY
PROTEIN

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase) 		4 SER A 411
SER A 410
ALA A 372
SER A 370
 None
 1.10A 5l5fY-4upiA:
undetectable
5l5fZ-4upiA:
undetectable		 5l5fY-4upiA:
16.87
5l5fZ-4upiA:
18.53
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.
4y5x DIABODY 310 VH
DOMAIN

(Homo sapiens) 		PF07686
(V-set) 		4 THR B  19
SER B  64
ALA B  72
ASP B  52
 None
 1.08A 5l5fY-4y5xB:
undetectable
5l5fZ-4y5xB:
undetectable		 5l5fY-4y5xB:
19.63
5l5fZ-4y5xB:
17.81
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.
4ye5 PEPTIDOGLYCAN
SYNTHETASE
PENICILLIN-BINDING
PROTEIN 3

(Bifidobacterium
adolescentis) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 THR A 554
MET A 443
ALA A 312
SER A 310
 None
 1.01A 5l5fY-4ye5A:
undetectable
5l5fZ-4ye5A:
undetectable		 5l5fY-4ye5A:
17.15
5l5fZ-4ye5A:
18.95
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.
4zpj EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Sphaerobacter
thermophilus) 		PF13458
(Peripla_BP_6) 		4 THR A 173
SER A 198
ALA A 159
SER A 156
 None
 1.06A 5l5fY-4zpjA:
undetectable
5l5fZ-4zpjA:
undetectable		 5l5fY-4zpjA:
18.42
5l5fZ-4zpjA:
18.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e2e BETA-LACTAMASE

(Yersinia
enterocolitica) 		PF13354
(Beta-lactamase2) 		4 THR A 220
SER A 256
ALA A  18
SER A  17
 None
 1.04A 5l5fY-5e2eA:
undetectable
5l5fZ-5e2eA:
undetectable		 5l5fY-5e2eA:
23.05
5l5fZ-5e2eA:
22.44
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.
5e6k POLYKETIDE SYNTHASE
PKSL

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 SER A 169
SER A 409
LYS A 309
SER A 337
 None
 1.10A 5l5fY-5e6kA:
undetectable
5l5fZ-5e6kA:
undetectable		 5l5fY-5e6kA:
16.37
5l5fZ-5e6kA:
17.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ed1 DOUBLE-STRANDED
RNA-SPECIFIC EDITASE
1

(Homo sapiens) 		PF02137
(A_deamin) 		4 THR A 373
SER A 399
SER A 402
SER A 625
 None
 1.12A 5l5fY-5ed1A:
undetectable
5l5fZ-5ed1A:
undetectable		 5l5fY-5ed1A:
19.45
5l5fZ-5ed1A:
20.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		4 THR L   1
SER L  21
MET L  45
ALA L  49
 None
 0.76A 5l5fY-5fmgL:
28.4
5l5fZ-5fmgL:
23.7		 5l5fY-5fmgL:
48.58
5l5fZ-5fmgL:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fql IDURONATE-2-SULFATAS
E

(Homo sapiens) 		PF00884
(Sulfatase) 		4 THR A 355
SER A  87
SER A  90
ASP A  98
 None
ALS  A  84 ( 4.6A)
None
None
 1.07A 5l5fY-5fqlA:
0.0
5l5fZ-5fqlA:
0.0		 5l5fY-5fqlA:
17.99
5l5fZ-5fqlA:
18.20
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.
5h2v IMPORTIN SUBUNIT
BETA-3

(Saccharomyces
cerevisiae) 		PF13513
(HEAT_EZ) 		4 THR A 995
SER A 955
ALA A 967
SER A 921
 None
 1.01A 5l5fY-5h2vA:
undetectable
5l5fZ-5h2vA:
undetectable		 5l5fY-5h2vA:
11.18
5l5fZ-5h2vA:
11.30
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		4 THR A1780
SER A1893
ALA A1794
ASP A1902
 None
 1.13A 5l5fY-5h64A:
undetectable
5l5fZ-5h64A:
undetectable		 5l5fY-5h64A:
6.18
5l5fZ-5h64A:
6.44
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.
5iz2 MAJOR AMPULLATE
SPIDROIN 1A

(Nephila
clavipes) 		no annotation 4 THR B  94
SER B  89
ALA B 128
SER B 131
 None
 0.99A 5l5fY-5iz2B:
undetectable
5l5fZ-5iz2B:
undetectable		 5l5fY-5iz2B:
21.33
5l5fZ-5iz2B:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j6o PUTATIVE POLYKETIDE
SYNTHASE

(Brevibacillus
brevis) 		PF14765
(PS-DH) 		4 SER A1947
SER A1948
ALA A1980
SER A1979
 None
 0.95A 5l5fY-5j6oA:
undetectable
5l5fZ-5j6oA:
undetectable		 5l5fY-5j6oA:
21.25
5l5fZ-5j6oA:
22.15
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.
5jh1 ALDOSE REDUCTASE,
AKR4C7

(Zea mays) 		PF00248
(Aldo_ket_red) 		4 SER A 154
ALA A  46
ASP A  44
SER A  20
 None
 1.11A 5l5fY-5jh1A:
undetectable
5l5fZ-5jh1A:
undetectable		 5l5fY-5jh1A:
24.36
5l5fZ-5jh1A:
22.29
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.
5ldy IG DOMAIN PROTEIN
GROUP 1 DOMAIN
PROTEIN

(Yersinia
pseudotuberculosis) 		PF09134
(Invasin_D3) 		4 SER A1717
SER A1687
ALA A1651
SER A1664
 None
 1.05A 5l5fY-5ldyA:
undetectable
5l5fZ-5ldyA:
undetectable		 5l5fY-5ldyA:
20.05
5l5fZ-5ldyA:
21.25
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.
5lnk MITOCHONDRIAL
COMPLEX I, ND5
SUBUNIT

(Ovis aries) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N)
PF06455
(NADH5_C) 		4 THR L 370
SER L 345
SER L 349
ALA L 365
 None
 1.03A 5l5fY-5lnkL:
undetectable
5l5fZ-5lnkL:
undetectable		 5l5fY-5lnkL:
15.27
5l5fZ-5lnkL:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5loa MESO-DIAMINOPIMELATE
D-DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF16654
(DAPDH_C) 		4 THR A 117
ALA A 275
ASP A 272
SER A  17
 None
 1.12A 5l5fY-5loaA:
undetectable
5l5fZ-5loaA:
undetectable		 5l5fY-5loaA:
19.63
5l5fZ-5loaA:
23.01
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.
5ltm PHENYLALANINE
AMMONIA LYASE

(Anabaena) 		no annotation 4 THR B 178
SER B 226
ALA B 220
SER B 137
 None
 1.12A 5l5fY-5ltmB:
undetectable
5l5fZ-5ltmB:
undetectable		 5l5fY-5ltmB:
17.44
5l5fZ-5ltmB:
19.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5m2b PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5

(Homo sapiens;
Saccharomyces
cerevisiae) 		PF00227
(Proteasome) 		6 THR K   1
SER K  21
SER K  27
LYS K  33
MET K  45
ALA K  49
 7DX  K 301 (-3.3A)
None
7DX  K 301 ( 4.2A)
7DX  K 301 (-4.2A)
7DX  K 301 ( 3.8A)
7DX  K 301 (-3.2A)
 0.20A 5l5fY-5m2bK:
40.0
5l5fZ-5m2bK:
23.9		 5l5fY-5m2bK:
100.00
5l5fZ-5m2bK:
23.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n6c D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Homo sapiens) 		no annotation 4 THR A  98
SER A  55
ALA A 286
SER A 287
 None
TLA  A 401 (-2.9A)
TLA  A 401 ( 3.2A)
None
 1.09A 5l5fY-5n6cA:
undetectable
5l5fZ-5n6cA:
undetectable		 5l5fY-5n6cA:
15.46
5l5fZ-5n6cA:
16.19
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.
5ocy ACPA E4 FAB FRAGMENT
- LIGHT CHAIN

(Homo sapiens) 		no annotation 4 THR L  19
SER L  64
ALA L  72
ASP L  52
 None
 1.08A 5l5fY-5ocyL:
undetectable
5l5fZ-5ocyL:
undetectable		 5l5fY-5ocyL:
15.82
5l5fZ-5ocyL:
16.75
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.
5ot0 L-ASPARAGINASE

(Thermococcus
kodakarensis) 		no annotation 4 THR A  82
SER A  14
ALA A 122
SER A 120
 None
 1.08A 5l5fY-5ot0A:
undetectable
5l5fZ-5ot0A:
undetectable		 5l5fY-5ot0A:
22.42
5l5fZ-5ot0A:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5to3 PROTHROMBIN,THROMBOM
ODULIN

(Homo sapiens) 		PF00089
(Trypsin)
PF09064
(Tme5_EGF_like) 		4 THR B 192
ALA B 242
ASP B 114
SER B 241
 None
0G6  B 501 (-3.4A)
None
None
 0.95A 5l5fY-5to3B:
undetectable
5l5fZ-5to3B:
undetectable		 5l5fY-5to3B:
18.58
5l5fZ-5to3B:
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.
5uam ULVAN LYASE-PL25

(Pseudoalteromonas
sp. PLSV) 		PF15892
(BNR_4) 		4 SER A 385
ALA A 344
ASP A 388
SER A 332
 None
 1.12A 5l5fY-5uamA:
undetectable
5l5fZ-5uamA:
undetectable		 5l5fY-5uamA:
18.01
5l5fZ-5uamA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uqr 2-METHYLCITRATE
SYNTHASE,
MITOCHONDRIAL

(Aspergillus
fumigatus) 		no annotation 4 SER A 292
ALA A 183
ASP A 202
SER A 180
 None
 0.80A 5l5fY-5uqrA:
undetectable
5l5fZ-5uqrA:
undetectable		 5l5fY-5uqrA:
16.67
5l5fZ-5uqrA:
19.64
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.
5xa5 ALPHA-CATENIN-LIKE
PROTEIN HMP-1
BETA-CATENIN-LIKE
PROTEIN HMP-2

(Caenorhabditis
elegans) 		PF01044
(Vinculin)
no annotation 		4 THR B  56
SER B  47
ASP A 192
SER A  18
 None
 0.88A 5l5fY-5xa5B:
undetectable
5l5fZ-5xa5B:
undetectable		 5l5fY-5xa5B:
12.82
5l5fZ-5xa5B:
12.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xni MCYF

(Microcystis
aeruginosa) 		no annotation 4 THR A 196
SER A 107
MET A  14
ALA A  90
 DGL  A 301 (-3.2A)
None
None
None
 1.05A 5l5fY-5xniA:
undetectable
5l5fZ-5xniA:
undetectable		 5l5fY-5xniA:
14.76
5l5fZ-5xniA:
14.80
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT

(Komagataella
phaffii) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 THR A 810
SER A 784
ASP A 792
SER A 794
 None
 1.09A 5l5fY-5xogA:
undetectable
5l5fZ-5xogA:
undetectable		 5l5fY-5xogA:
9.75
5l5fZ-5xogA:
10.70
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.
5y0q UPF0348 PROTEIN
B4417_3650

(Bacillus
subtilis) 		no annotation 4 SER A 240
MET A  58
ALA A  54
SER A  51
 None
 0.98A 5l5fY-5y0qA:
undetectable
5l5fZ-5y0qA:
undetectable		 5l5fY-5y0qA:
undetectable
5l5fZ-5y0qA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6avo PROTEASOME SUBUNIT
BETA TYPE-10
PROTEASOME SUBUNIT
BETA TYPE-9

(Homo sapiens) 		no annotation 5 THR A   1
SER A  21
LYS A  33
ALA A  49
SER B 118
 None
 0.69A 5l5fY-6avoA:
25.3
5l5fZ-6avoA:
25.5		 5l5fY-6avoA:
20.38
5l5fZ-6avoA:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6avo PROTEASOME SUBUNIT
BETA TYPE-10
PROTEASOME SUBUNIT
BETA TYPE-9

(Homo sapiens) 		no annotation 4 THR A   1
SER A  21
LYS A  33
SER B 120
 None
 0.95A 5l5fY-6avoA:
25.3
5l5fZ-6avoA:
25.5		 5l5fY-6avoA:
20.38
5l5fZ-6avoA:
17.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6avo PROTEASOME SUBUNIT
BETA TYPE-8

(Homo sapiens) 		no annotation 5 THR C   1
SER C  21
LYS C  33
MET C  45
ALA C  49
 BZ7  C 301 (-4.0A)
BZ7  C 301 (-4.9A)
BZ7  C 301 ( 4.8A)
BZ7  C 301 ( 4.7A)
BZ7  C 301 (-2.8A)
 0.59A 5l5fY-6avoC:
34.5
5l5fZ-6avoC:
24.6		 5l5fY-6avoC:
100.00
5l5fZ-6avoC:
14.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6avo PROTEASOME SUBUNIT
BETA TYPE-8

(Homo sapiens) 		no annotation 5 THR C   1
SER C  21
SER C  27
MET C  45
ALA C  49
 BZ7  C 301 (-4.0A)
BZ7  C 301 (-4.9A)
BZ7  C 301 (-3.4A)
BZ7  C 301 ( 4.7A)
BZ7  C 301 (-2.8A)
 0.69A 5l5fY-6avoC:
34.5
5l5fZ-6avoC:
24.6		 5l5fY-6avoC:
100.00
5l5fZ-6avoC:
14.55
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.
6bgi ANOCTAMIN-1

(Mus musculus) 		no annotation 4 THR A 422
MET A 416
ALA A 345
SER A 346
 None
 1.08A 5l5fY-6bgiA:
undetectable
5l5fZ-6bgiA:
undetectable		 5l5fY-6bgiA:
20.56
5l5fZ-6bgiA:
17.80
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.
6c4n PSEUDOPALINE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		no annotation 4 THR A 216
SER A 149
LYS A 368
ALA A 128
 None
None
NAP  A 501 ( 4.9A)
None
 0.98A 5l5fY-6c4nA:
undetectable
5l5fZ-6c4nA:
undetectable		 5l5fY-6c4nA:
15.64
5l5fZ-6c4nA:
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.
6es9 ACYL-COA
DEHYDROGENASE

(Paracoccus
denitrificans) 		no annotation 4 THR A 165
ALA A 230
ASP A 479
SER A 228
 None
 1.07A 5l5fY-6es9A:
0.0
5l5fZ-6es9A:
undetectable		 5l5fY-6es9A:
17.45
5l5fZ-6es9A:
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.
6fu4 PROBABLE CHEMOTAXIS
TRANSDUCER

(Pseudomonas
aeruginosa) 		no annotation 4 THR A 194
ALA A 187
ASP A 206
SER A 185
 None
 1.07A 5l5fY-6fu4A:
undetectable
5l5fZ-6fu4A:
0.6		 5l5fY-6fu4A:
12.80
5l5fZ-6fu4A:
13.51