SIMILAR PATTERNS OF AMINO ACIDS FOR 3SUF_A_SUEA1201_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.
1a8q BROMOPEROXIDASE A1

(Kitasatospora
aureofaciens) 		PF00561
(Abhydrolase_1) 		5 HIS A 252
ASP A 223
GLY A  27
SER A  94
ALA A 255
 None
 0.95A 3sufA-1a8qA:
undetectable		 3sufA-1a8qA:
21.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		10 GLN A  41
HIS A  57
GLY A  58
ASP A  81
ARG A 123
LEU A 135
GLY A 137
PHE A 154
ALA A 156
ALA A 157
 None
 0.54A 3sufA-1cu1A:
34.4		 3sufA-1cu1A:
81.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		10 GLN A  41
HIS A  57
GLY A  58
ASP A  81
ARG A 123
LYS A 136
GLY A 137
PHE A 154
ALA A 156
ALA A 157
 None
 0.65A 3sufA-1cu1A:
34.4		 3sufA-1cu1A:
81.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		9 GLN A  41
HIS A  57
GLY A  58
ASP A  81
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 157
 None
 0.65A 3sufA-1cu1A:
34.4		 3sufA-1cu1A:
81.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		9 GLN A  41
HIS A  57
GLY A  58
ASP A  81
LYS A 136
GLY A 137
SER A 139
PHE A 154
ALA A 157
 None
 0.76A 3sufA-1cu1A:
34.4		 3sufA-1cu1A:
81.07
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.
1elv COMPLEMENT C1S
COMPONENT

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		5 HIS A 460
ASP A 514
LYS A 614
GLY A 615
SER A 617
 SO4  A2001 ( 3.9A)
None
SO4  A2001 (-2.9A)
SO4  A2001 (-4.1A)
SO4  A2001 ( 2.7A)
 0.88A 3sufA-1elvA:
11.2		 3sufA-1elvA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1evq SERINE HYDROLASE

(Alicyclobacillus
acidocaldarius) 		PF07859
(Abhydrolase_3) 		5 HIS A 282
ASP A 252
GLY A  82
SER A 155
ALA A 285
 EPE  A 455 (-4.0A)
None
EPE  A 455 (-3.5A)
EPE  A 455 (-1.4A)
None
 1.01A 3sufA-1evqA:
undetectable		 3sufA-1evqA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eyw PHOSPHOTRIESTERASE

(Brevundimonas
diminuta) 		PF02126
(PTE) 		5 GLY A 166
LEU A 192
GLY A 195
ALA A 187
ALA A 188
 None
 0.88A 3sufA-1eywA:
undetectable		 3sufA-1eywA:
24.35
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.
1g8k ARSENITE OXIDASE

(Alcaligenes
faecalis) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 GLY A 605
LEU A 182
GLY A 178
PHE A 593
ALA A 186
 None
 1.02A 3sufA-1g8kA:
undetectable		 3sufA-1g8kA:
13.21
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.
1hju BETA-1,4-GALACTANASE

(Thermothelomyces
thermophila) 		PF07745
(Glyco_hydro_53) 		5 GLN A 126
GLY A 124
LEU A  74
ALA A  71
ALA A  72
 None
 1.04A 3sufA-1hjuA:
undetectable		 3sufA-1hjuA:
22.98
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.
1jkm BREFELDIN A ESTERASE

(Bacillus
subtilis) 		PF07859
(Abhydrolase_3) 		5 HIS A 338
ASP A 308
ARG A 331
GLY A 126
SER A 202
 None
 0.78A 3sufA-1jkmA:
undetectable		 3sufA-1jkmA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kig FACTOR XA

(Bos taurus) 		PF00089
(Trypsin) 		5 GLN H  61
HIS H  57
ASP H 102
GLY H 193
SER H 195
 None
 0.83A 3sufA-1kigH:
9.6		 3sufA-1kigH:
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.
1kuu CONSERVED PROTEIN

(Methanothermobacter) 		PF07826
(IMP_cyclohyd) 		5 GLY A 119
GLY A  10
SER A  16
ALA A 188
ALA A 187
 None
 1.06A 3sufA-1kuuA:
undetectable		 3sufA-1kuuA:
24.19
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.
1kvk MEVALONATE KINASE

(Rattus
norvegicus) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 HIS A 197
LEU A 137
GLY A 140
ALA A 147
ALA A 148
 MG  A 536 ( 4.3A)
None
ATP  A 535 (-2.8A)
MG  A 536 (-3.9A)
None
 0.89A 3sufA-1kvkA:
undetectable		 3sufA-1kvkA:
20.31
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 GLY A 418
LEU A 514
GLY A 511
ALA A 519
ALA A 518
 None
 1.06A 3sufA-1l5jA:
undetectable		 3sufA-1l5jA:
13.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l8w VLSE1

(Borreliella
burgdorferi) 		PF00921
(Lipoprotein_2) 		5 GLY A 311
LEU A 286
GLY A 288
ALA A 281
ALA A 282
 None
 1.04A 3sufA-1l8wA:
undetectable		 3sufA-1l8wA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lxt PHOSPHOGLUCOMUTASE
(DEPHOSPHO FORM)

(Oryctolagus
cuniculus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 GLY A 326
LEU A 364
GLY A 329
SER A 371
ALA A 367
 None
 0.98A 3sufA-1lxtA:
undetectable		 3sufA-1lxtA:
15.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 GLN A  41
HIS A  57
ASP A  81
GLY A 137
SER A 139
 None
 1.06A 3sufA-1ns3A:
30.3		 3sufA-1ns3A:
78.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		6 GLN A  41
HIS A  57
GLY A  58
ASP A  81
GLY A 137
ALA A 157
 None
 0.80A 3sufA-1ns3A:
30.3		 3sufA-1ns3A:
78.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		6 HIS A  57
ARG A 123
LEU A 135
GLY A 137
PHE A 154
ALA A 157
 None
 0.84A 3sufA-1ns3A:
30.3		 3sufA-1ns3A:
78.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		8 HIS A  57
GLY A  58
ASP A  81
LEU A 135
GLY A 137
PHE A 154
ALA A 156
ALA A 157
 None
 0.49A 3sufA-1ns3A:
30.3		 3sufA-1ns3A:
78.00
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.
1p3c GLUTAMYL-ENDOPEPTIDA
SE

(Bacillus
intermedius) 		PF00089
(Trypsin) 		5 HIS A  47
ASP A  97
GLY A 169
SER A 171
ALA A 188
 None
 0.72A 3sufA-1p3cA:
10.1		 3sufA-1p3cA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p9h INVASIN

(Yersinia
enterocolitica) 		PF05658
(YadA_head)
PF05662
(YadA_stalk) 		5 GLY A  76
GLY A 104
SER A  93
ALA A  95
ALA A 109
 None
 1.04A 3sufA-1p9hA:
undetectable		 3sufA-1p9hA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p9h INVASIN

(Yersinia
enterocolitica) 		PF05658
(YadA_head)
PF05662
(YadA_stalk) 		5 GLY A  90
GLY A 118
SER A 107
ALA A 109
ALA A 123
 None
 1.03A 3sufA-1p9hA:
undetectable		 3sufA-1p9hA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA

(Paracoccus
denitrificans) 		PF00115
(COX1) 		5 HIS A  28
ASP A 124
LEU A 530
PHE A 543
ALA A 122
 None
 0.83A 3sufA-1qleA:
undetectable		 3sufA-1qleA:
16.31
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.
1sgf NERVE GROWTH FACTOR

(Mus musculus) 		PF00089
(Trypsin) 		5 HIS G  57
ASP G 102
LYS G 192
GLY G 193
SER G 195
 None
 0.87A 3sufA-1sgfG:
10.6		 3sufA-1sgfG:
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.
1wz8 ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		5 GLY A  28
LEU A 120
GLY A  70
SER A  68
ALA A 123
 None
 1.02A 3sufA-1wz8A:
undetectable		 3sufA-1wz8A:
19.49
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.
1x0l HOMOISOCITRATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00180
(Iso_dh) 		5 GLY A  14
ARG A 103
LEU A 241
GLY A 261
ALA A 244
 None
 0.96A 3sufA-1x0lA:
undetectable		 3sufA-1x0lA:
19.71
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.
1yq8 MINOR CAPSID PROTEIN

(Salmonella
virus PRD1) 		PF08949
(DUF1860) 		5 GLY A 175
LEU A 203
GLY A 237
ALA A 337
ALA A 336
 None
 1.05A 3sufA-1yq8A:
undetectable		 3sufA-1yq8A:
23.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2aip PROTEIN C ACTIVATOR

(Agkistrodon
contortrix) 		PF00089
(Trypsin) 		5 HIS A  57
ASP A 102
LYS A 192
GLY A 193
SER A 195
 SO4  A 301 (-3.8A)
None
SO4  A 301 (-4.4A)
SO4  A 301 (-3.9A)
SO4  A 301 (-2.8A)
 1.06A 3sufA-2aipA:
10.8		 3sufA-2aipA:
24.80
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.
2eij CYTOCHROME C OXIDASE
SUBUNIT 1

(Bos taurus) 		PF00115
(COX1) 		5 HIS A  12
ASP A  91
LEU A 492
PHE A 505
ALA A  89
 None
 1.03A 3sufA-2eijA:
undetectable		 3sufA-2eijA:
16.70
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.
2fk5 FUCULOSE-1-PHOSPHATE
ALDOLASE

(Thermus
thermophilus) 		PF00596
(Aldolase_II) 		5 GLY A  27
ARG A 144
GLY A 152
ALA A 155
ALA A 145
 None
 1.07A 3sufA-2fk5A:
undetectable		 3sufA-2fk5A:
20.95
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.
2ijl MOLYBDENUM-BINDING
TRANSCRIPTIONAL
REPRESSOR

(Agrobacterium
fabrum) 		PF00126
(HTH_1) 		5 ARG A  44
LEU A  29
GLY A  25
ALA A  45
ALA A  42
 None
None
SO4  A 203 (-3.2A)
None
None
 1.06A 3sufA-2ijlA:
undetectable		 3sufA-2ijlA:
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.
2isq CYSTEINE SYNTHASE

(Arabidopsis
thaliana) 		PF00291
(PALP) 		6 GLY A 225
LEU A 258
GLY A 267
PHE A 295
ALA A 273
ALA A 274
 PLP  A 400 (-3.5A)
None
None
None
None
None
 1.20A 3sufA-2isqA:
undetectable		 3sufA-2isqA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n03 PLECTIN

(Homo sapiens) 		PF00681
(Plectin) 		5 ASP A4555
LEU A4516
GLY A4514
ALA A4508
ALA A4507
 None
 1.07A 3sufA-2n03A:
undetectable		 3sufA-2n03A:
20.78
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.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		5 GLN A 777
GLY A 774
LEU A 731
ALA A 726
ALA A 727
 None
 1.04A 3sufA-2okxA:
undetectable		 3sufA-2okxA:
15.01
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.
2r3v MEVALONATE KINASE

(Homo sapiens) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 HIS A 197
LEU A 137
GLY A 140
ALA A 147
ALA A 148
 None
 1.02A 3sufA-2r3vA:
undetectable		 3sufA-2r3vA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vid SERINE PROTEASE SPLB

(Staphylococcus
aureus) 		PF00089
(Trypsin) 		5 HIS A  39
ASP A  77
GLY A 155
SER A 157
ALA A 174
 None
 0.74A 3sufA-2vidA:
12.3		 3sufA-2vidA:
22.12
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.
2wge 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 1

(Mycobacterium
tuberculosis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 236
GLY A 318
PHE A 230
ALA A 338
ALA A 310
 None
TLM  A1424 ( 4.0A)
None
None
None
 1.03A 3sufA-2wgeA:
undetectable		 3sufA-2wgeA:
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.
2xdf PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Escherichia
coli) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		5 GLY A 503
GLY A 293
SER A 524
ALA A 527
ALA A 284
 None
 1.06A 3sufA-2xdfA:
undetectable		 3sufA-2xdfA:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aja PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycolicibacterium
smegmatis) 		PF01083
(Cutinase) 		5 HIS A 300
GLY A 293
ASP A 269
GLY A  83
SER A 176
 None
 0.93A 3sufA-3ajaA:
undetectable		 3sufA-3ajaA:
20.33
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.
3fcp L-ALA-D/L-GLU
EPIMERASE, A
MUCONATE LACTONIZING
ENZYME

(Klebsiella
pneumoniae) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLN A 241
GLY A 266
LEU A 248
GLY A 269
ALA A 252
 None
 1.00A 3sufA-3fcpA:
undetectable		 3sufA-3fcpA:
20.73
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.
3g0i EPOXIDE HYDROLASE

(Aspergillus
niger) 		PF06441
(EHN) 		5 HIS A 374
ASP A 348
GLY A 116
ALA A 376
ALA A 377
 VPR  A   1 ( 4.6A)
VPR  A   1 ( 4.5A)
None
None
None
 1.03A 3sufA-3g0iA:
undetectable		 3sufA-3g0iA:
19.50
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.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN A 382
HIS A 226
ASP A 186
GLY A 384
ALA A 290
 None
 0.97A 3sufA-3gcwA:
undetectable		 3sufA-3gcwA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN A 382
HIS A 226
ASP A 186
GLY A 384
SER A 386
 None
 0.91A 3sufA-3gcwA:
undetectable		 3sufA-3gcwA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h77 PQS BIOSYNTHETIC
ENZYME

(Pseudomonas
aeruginosa) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A 316
LEU A 119
GLY A 114
ALA A 323
ALA A 324
 CSJ  A 112 ( 3.2A)
None
CSJ  A 112 ( 4.5A)
None
None
 0.92A 3sufA-3h77A:
undetectable		 3sufA-3h77A:
21.70
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.
3hea ARYLESTERASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 HIS A 251
ASP A 222
GLY A  27
SER A  94
ALA A 254
 EEE  A 300 (-4.3A)
None
EEE  A 300 (-3.4A)
EEE  A 300 (-1.4A)
None
 0.98A 3sufA-3heaA:
undetectable		 3sufA-3heaA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i09 PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Burkholderia
mallei) 		PF13458
(Peripla_BP_6) 		5 HIS A 200
LEU A 253
GLY A 228
PHE A 175
ALA A 225
 None
None
EDO  A   8 ( 4.0A)
AAE  A 501 (-3.6A)
None
 1.02A 3sufA-3i09A:
undetectable		 3sufA-3i09A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3msu CITRATE SYNTHASE

(Francisella
tularensis) 		PF00285
(Citrate_synt) 		5 HIS A 135
LEU A 261
GLY A 263
ALA A 384
ALA A 387
 None
 1.03A 3sufA-3msuA:
undetectable		 3sufA-3msuA:
18.27
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.
3q3w 3-ISOPROPYLMALATE
DEHYDRATASE SMALL
SUBUNIT

(Campylobacter
jejuni) 		PF00694
(Aconitase_C) 		5 HIS A   7
LEU A  92
GLY A  96
SER A  71
ALA A  99
 None
 0.96A 3sufA-3q3wA:
undetectable		 3sufA-3q3wA:
17.65
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.
3s29 SUCROSE SYNTHASE 1

(Arabidopsis
thaliana) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 HIS A 287
GLY A 288
ASP A 417
GLY A 302
ALA A 439
 FRU  A 902 (-4.0A)
None
None
FRU  A 902 ( 2.2A)
FRU  A 902 ( 3.7A)
 0.92A 3sufA-3s29A:
undetectable		 3sufA-3s29A:
12.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s6l HEP_HAG FAMILY

(Burkholderia
pseudomallei) 		PF05658
(YadA_head)
PF05662
(YadA_stalk) 		5 GLY A  50
GLY A  78
SER A  67
ALA A  69
ALA A  83
 None
 1.07A 3sufA-3s6lA:
undetectable		 3sufA-3s6lA:
24.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3stj PROTEASE DEGQ

(Escherichia
coli) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 HIS A  82
ASP A 112
GLY A 185
SER A 187
ALA A 204
 None
 0.71A 3sufA-3stjA:
13.2		 3sufA-3stjA:
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.
3tij NUPC FAMILY PROTEIN

(Vibrio cholerae) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		5 GLY A 137
LEU A 128
GLY A 131
ALA A 146
ALA A 147
 None
DMU  A 425 ( 4.5A)
DMU  A 425 ( 4.3A)
None
None
 1.02A 3sufA-3tijA:
undetectable		 3sufA-3tijA:
19.58
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.
3u0f BETA-KETOACYL
SYNTHASE

(Brucella
abortus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ASP A 304
ARG A 375
LEU A 330
GLY A 332
ALA A 359
 None
 0.99A 3sufA-3u0fA:
undetectable		 3sufA-3u0fA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v5q NT-3 GROWTH FACTOR
RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 GLY A 633
LEU A 657
GLY A 652
PHE A 764
ALA A 660
 None
 1.04A 3sufA-3v5qA:
undetectable		 3sufA-3v5qA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wj2 CARBOXYLESTERASE

(Ferroplasma
acidiphilum) 		PF07859
(Abhydrolase_3) 		5 HIS A 281
ASP A 251
GLY A  84
SER A 156
ALA A 284
 None
 1.06A 3sufA-3wj2A:
undetectable		 3sufA-3wj2A:
19.55
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.
3wmr PROLINE
IMINOPEPTIDASE

(Streptomyces
halstedii) 		PF00561
(Abhydrolase_1) 		5 ASP A 250
LEU A  36
GLY A  38
SER A 110
ALA A 133
 None
 1.05A 3sufA-3wmrA:
undetectable		 3sufA-3wmrA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ain GLYCINE BETAINE
TRANSPORTER BETP

(Corynebacterium
glutamicum) 		PF02028
(BCCT) 		5 GLY A 149
ARG A 390
LEU A 202
ALA A 386
ALA A 205
 None
 0.92A 3sufA-4ainA:
undetectable		 3sufA-4ainA:
17.51
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.
4c89 ESTERASE

(Lactobacillus
plantarum) 		PF07859
(Abhydrolase_3) 		5 HIS A 313
ASP A 283
GLY A 106
SER A 174
ALA A 316
 None
 1.05A 3sufA-4c89A:
undetectable		 3sufA-4c89A:
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.
4f4h GLUTAMINE DEPENDENT
NAD+ SYNTHETASE

(Burkholderia
thailandensis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 GLY A 305
LEU A 407
GLY A 302
SER A 309
ALA A 316
 None
 1.04A 3sufA-4f4hA:
undetectable		 3sufA-4f4hA:
15.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fcs VERSATILE PEROXIDASE
VPL2

(Pleurotus
eryngii) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		5 GLY A  51
GLY A  63
SER A  64
PHE A  68
ALA A 131
 CA  A 402 ( 4.7A)
None
CA  A 402 (-2.4A)
None
None
 1.02A 3sufA-4fcsA:
undetectable		 3sufA-4fcsA:
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 14

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M) 		5 ARG N 354
LEU N 361
GLY N 359
ALA N 355
ALA N 352
 None
 0.99A 3sufA-4heaN:
undetectable		 3sufA-4heaN:
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.
4hvl MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
thermoresistibile) 		PF00082
(Peptidase_S8) 		5 HIS A 123
ASP A  92
GLY A 332
SER A 334
ALA A 204
 ZN  A 506 ( 3.3A)
None
ACT  A 512 (-3.5A)
ZN  A 506 ( 2.2A)
ACT  A 512 ( 4.7A)
 0.94A 3sufA-4hvlA:
undetectable		 3sufA-4hvlA:
21.49
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.
4iig BETA-GLUCOSIDASE 1

(Aspergillus
aculeatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.04A 3sufA-4iigA:
undetectable		 3sufA-4iigA:
13.31
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.
4jga 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Rickettsia
rickettsii) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A  65
LEU A  17
GLY A  22
ALA A  92
ALA A  93
 None
 0.96A 3sufA-4jgaA:
undetectable		 3sufA-4jgaA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kpg MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 HIS A 123
ASP A  92
GLY A 332
SER A 334
ALA A 204
 None
 0.98A 3sufA-4kpgA:
undetectable		 3sufA-4kpgA:
19.70
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.
4lls GERANYLTRANSTRANSFER
ASE

(Roseobacter
denitrificans) 		PF00348
(polyprenyl_synt) 		5 GLN A 213
ASP A  80
LEU A 151
GLY A 177
ALA A 154
 IPE  A 301 ( 4.1A)
CA  A 304 ( 2.9A)
None
None
None
 1.05A 3sufA-4llsA:
undetectable		 3sufA-4llsA:
20.87
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.
4m1z MEMBRANE-ANCHORED
MYCOSIN MYCP1

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		5 HIS A 123
ASP A  92
GLY A 332
SER A 334
ALA A 204
 None
 0.91A 3sufA-4m1zA:
undetectable		 3sufA-4m1zA:
22.07
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		5 HIS A 306
ASP A 259
GLY A 510
SER A 512
ALA A 364
 None
 0.66A 3sufA-4mzdA:
undetectable		 3sufA-4mzdA:
17.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		5 ARG A 123
LEU A 135
LYS A 136
PHE A 154
ALA A 157
 None
2R8  A 301 (-4.4A)
GOL  A 310 ( 2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.8A)
 0.87A 3sufA-4nwkA:
34.5		 3sufA-4nwkA:
99.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nwk HCV NS3 1A PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		11 GLN A  41
HIS A  57
GLY A  58
ASP A  81
LEU A 135
LYS A 136
GLY A 137
SER A 139
PHE A 154
ALA A 156
ALA A 157
 2R8  A 301 ( 3.5A)
2R8  A 301 (-3.3A)
2R8  A 301 (-3.5A)
2R8  A 301 (-3.6A)
2R8  A 301 (-4.4A)
GOL  A 310 ( 2.6A)
GOL  A 305 ( 3.2A)
2R8  A 301 (-2.6A)
2R8  A 301 (-3.7A)
2R8  A 301 (-3.1A)
2R8  A 301 (-3.8A)
 0.34A 3sufA-4nwkA:
34.5		 3sufA-4nwkA:
99.49
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.
4ov6 PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN B 382
HIS B 226
ASP B 186
GLY B 384
ALA B 290
 None
 0.95A 3sufA-4ov6B:
undetectable		 3sufA-4ov6B:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ov6 PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		5 GLN B 382
HIS B 226
ASP B 186
GLY B 384
SER B 386
 None
 0.93A 3sufA-4ov6B:
undetectable		 3sufA-4ov6B:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rbn SUCROSE
SYNTHASE:GLYCOSYL
TRANSFERASES GROUP 1

(Nitrosomonas
europaea) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 HIS A 273
GLY A 274
ASP A 404
GLY A 288
ALA A 426
 None
 0.88A 3sufA-4rbnA:
undetectable		 3sufA-4rbnA:
14.21
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.
4w78 HYDRATASE CHSH1
HYDRATASE CHSH2

(Mycobacterium
tuberculosis) 		PF13452
(MaoC_dehydrat_N)
no annotation 		5 ARG A  55
GLY B  68
SER B  70
ALA A  56
ALA A  53
 None
 0.78A 3sufA-4w78A:
undetectable		 3sufA-4w78A:
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.
4x2x NS6 PROTEASE

(Norwalk virus) 		PF05416
(Peptidase_C37) 		5 HIS A  30
ASP A  54
GLY A 137
ALA A 159
ALA A 160
 None
 0.66A 3sufA-4x2xA:
10.7		 3sufA-4x2xA:
21.60
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.
4xel INORGANIC
PYROPHOSPHATASE

(Pseudomonas
aeruginosa) 		PF00719
(Pyrophosphatase) 		5 GLY A  83
LEU A  73
GLY A  57
ALA A  24
ALA A  54
 None
 1.01A 3sufA-4xelA:
undetectable		 3sufA-4xelA:
20.50
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.
4zas CALS13

(Micromonospora
echinospora) 		PF01041
(DegT_DnrJ_EryC1) 		5 ASP A 173
LEU A 204
GLY A 199
SER A 197
ALA A 177
 LLP  A 202 ( 2.9A)
None
LLP  A 202 ( 4.3A)
LLP  A 202 ( 2.8A)
None
 1.05A 3sufA-4zasA:
undetectable		 3sufA-4zasA:
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.
5ah0 LIPASE

(Pelosinus
fermentans) 		no annotation 5 HIS A 372
ASP A 330
GLY A  26
SER A 129
ALA A 375
 None
 1.03A 3sufA-5ah0A:
undetectable		 3sufA-5ah0A:
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.
5cyk RIBOSOME BIOGENESIS
PROTEIN YTM1

(Chaetomium
thermophilum) 		PF00400
(WD40)
PF08154
(NLE) 		5 HIS A 224
GLY A 223
ASP A 246
ALA A 243
ALA A 303
 None
 1.03A 3sufA-5cykA:
undetectable		 3sufA-5cykA:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5da0 SULPHATE TRANSPORTER

(Deinococcus
geothermalis) 		PF00916
(Sulfate_transp)
PF01740
(STAS) 		5 GLY A 267
ARG A 118
LEU A 240
GLY A 238
ALA A 117
 None
None
DMU  A 601 (-3.9A)
None
None
 1.00A 3sufA-5da0A:
undetectable		 3sufA-5da0A:
17.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eqq NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		10 GLN A1041
HIS A1057
GLY A1058
ASP A1081
ARG A1123
LEU A1135
GLY A1137
PHE A1154
ALA A1156
ALA A1157
 5RS  A1203 (-2.9A)
5RS  A1203 (-2.5A)
5RS  A1203 ( 2.9A)
5RS  A1203 (-3.5A)
5RS  A1203 ( 3.3A)
5RS  A1203 (-4.2A)
5RS  A1203 (-3.2A)
5RS  A1203 (-3.3A)
5RS  A1203 (-2.9A)
5RS  A1203 (-3.5A)
 0.40A 3sufA-5eqqA:
35.5		 3sufA-5eqqA:
94.00
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.
5f8z PLASMA KALLIKREIN
LIGHT CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		5 HIS A  57
ASP A 102
LYS A 192
GLY A 193
SER A 195
 None
 0.74A 3sufA-5f8zA:
10.3		 3sufA-5f8zA:
28.12
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.
5h3h ABHYDROLASE
DOMAIN-CONTAINING
PROTEIN

(Exiguobacterium
antarcticum) 		PF00561
(Abhydrolase_1)
PF08386
(Abhydrolase_4) 		5 HIS A 248
GLY A 249
LEU A 119
ALA A 123
ALA A 124
 F50  A 301 (-4.0A)
None
None
None
None
 1.05A 3sufA-5h3hA:
undetectable		 3sufA-5h3hA:
23.33
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 HIS A 317
ASP A 287
ARG A 310
GLY A 107
SER A 188
 TRS  A 402 (-4.3A)
None
None
TRS  A 402 ( 3.8A)
TRS  A 402 (-2.3A)
 0.92A 3sufA-5hc4A:
undetectable		 3sufA-5hc4A:
21.75
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.
5iof SULPHATE TRANSPORTER

(Deinococcus
geothermalis) 		PF00916
(Sulfate_transp) 		5 GLY A 267
ARG A 118
LEU A 240
GLY A 238
ALA A 117
 None
 1.00A 3sufA-5iofA:
undetectable		 3sufA-5iofA:
19.20
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.
5kp7 CURD

(Moorea
producens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		5 GLY A 117
GLY A 327
SER A 325
PHE A 324
ALA A 227
 None
 0.98A 3sufA-5kp7A:
undetectable		 3sufA-5kp7A:
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.
5mif 'CARBOXYL ESTERASE 2

(Tuber
melanosporum) 		PF07859
(Abhydrolase_3) 		5 HIS A 317
ASP A 287
GLY A 117
SER A 190
ALA A 320
 None
 1.06A 3sufA-5mifA:
undetectable		 3sufA-5mifA:
20.17
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.
5to3 PROTHROMBIN,THROMBOM
ODULIN

(Homo sapiens) 		PF00089
(Trypsin)
PF09064
(Tme5_EGF_like) 		5 HIS B  58
ASP B 114
GLY B 218
SER B 220
ALA B 242
 0G6  B 501 (-2.5A)
None
0G6  B 501 (-3.9A)
0G6  B 501 (-1.3A)
0G6  B 501 (-3.4A)
 0.70A 3sufA-5to3B:
4.2		 3sufA-5to3B:
16.63
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.
5tr7 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Vibrio cholerae) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		5 HIS A  48
ASP A  46
GLY A 250
PHE A 279
ALA A 247
 None
 1.06A 3sufA-5tr7A:
undetectable		 3sufA-5tr7A:
19.53
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.
5vlh PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		5 GLN A 382
HIS A 226
ASP A 186
GLY A 384
ALA A 290
 None
 0.90A 3sufA-5vlhA:
undetectable		 3sufA-5vlhA:
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.
5vlh PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		5 GLN A 382
HIS A 226
ASP A 186
GLY A 384
SER A 386
 None
 0.86A 3sufA-5vlhA:
undetectable		 3sufA-5vlhA:
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.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 6 ARG A 123
LEU A 135
LYS A 136
GLY A 137
PHE A 154
ALA A 157
 None
 1.29A 3sufA-5wdxA:
27.1		 3sufA-5wdxA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 8 GLN A  41
HIS A  57
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 156
ALA A 157
 None
 0.75A 3sufA-5wdxA:
27.1		 3sufA-5wdxA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 10 HIS A  57
GLY A  58
ASP A  81
ARG A 123
LEU A 135
GLY A 137
SER A 139
PHE A 154
ALA A 156
ALA A 157
 None
 0.56A 3sufA-5wdxA:
27.1		 3sufA-5wdxA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xtb NADH-UBIQUINONE
OXIDOREDUCTASE 75
KDA SUBUNIT,
MITOCHONDRIAL

(Homo sapiens) 		PF00384
(Molybdopterin)
PF09326
(NADH_dhqG_C)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		5 LEU M 218
GLY M 220
PHE M 185
ALA M 186
ALA M 190
 None
 1.07A 3sufA-5xtbM:
undetectable		 3sufA-5xtbM:
15.01
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.
5y0m -

(-) 		no annotation 5 GLY A  68
ARG A  44
GLY A 108
ALA A  63
ALA A 165
 None
 1.07A 3sufA-5y0mA:
undetectable		 3sufA-5y0mA:
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.
6aun PLA2G6, IPLA2BETA

(Cricetulus
griseus) 		no annotation 5 GLY A 463
LEU A 597
GLY A 532
SER A 583
ALA A 586
 None
 1.03A 3sufA-6aunA:
undetectable		 3sufA-6aunA:
19.07
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.
6b5f NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Yersinia
enterocolitica) 		no annotation 5 GLY A 251
LEU A 242
GLY A 244
ALA A 270
ALA A 268
 None
 1.05A 3sufA-6b5fA:
undetectable		 3sufA-6b5fA:
22.47