SIMILAR PATTERNS OF AMINO ACIDS FOR 2J2P_A_SC2A1290_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.
1arl APO-CARBOXYPEPTIDASE
A=ALPHA= (COX)

(Bos taurus) 		PF00246
(Peptidase_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.90A 2j2pA-1arlA:
0.0
2j2pB-1arlA:
undetectable		 2j2pA-1arlA:
24.04
2j2pB-1arlA:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1aye PROCARBOXYPEPTIDASE
A2

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.97A 2j2pA-1ayeA:
undetectable
2j2pB-1ayeA:
0.0		 2j2pA-1ayeA:
19.60
2j2pB-1ayeA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		4 SER A 231
LEU A 414
GLY A 417
ARG A 464
 None
 1.24A 2j2pA-1cu1A:
0.0
2j2pB-1cu1A:
undetectable		 2j2pA-1cu1A:
14.62
2j2pB-1cu1A:
14.62
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.
1dtd CARBOXYPEPTIDASE A2

(Homo sapiens) 		PF00246
(Peptidase_M14) 		4 SER A 553
LEU A 636
GLY A 634
ARG A 479
 None
 0.95A 2j2pA-1dtdA:
0.0
2j2pB-1dtdA:
0.0		 2j2pA-1dtdA:
19.62
2j2pB-1dtdA:
19.62
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.
1jqg CARBOXYPEPTIDASE A

(Helicoverpa
armigera) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 1.12A 2j2pA-1jqgA:
0.0
2j2pB-1jqgA:
undetectable		 2j2pA-1jqgA:
17.78
2j2pB-1jqgA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kwm PROCARBOXYPEPTIDASE
B

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.92A 2j2pA-1kwmA:
0.0
2j2pB-1kwmA:
0.0		 2j2pA-1kwmA:
19.16
2j2pB-1kwmA:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mt5 FATTY-ACID AMIDE
HYDROLASE

(Rattus
norvegicus) 		PF01425
(Amidase) 		4 ASP A 395
SER A 157
LEU A 154
GLY A 155
 None
 1.19A 2j2pA-1mt5A:
0.0
2j2pB-1mt5A:
0.0		 2j2pA-1mt5A:
18.70
2j2pB-1mt5A:
18.70
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.
1pca PROCARBOXYPEPTIDASE
A PCPA

(Sus scrofa) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.94A 2j2pA-1pcaA:
undetectable
2j2pB-1pcaA:
0.0		 2j2pA-1pcaA:
21.11
2j2pB-1pcaA:
21.11
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.
1ri6 PUTATIVE ISOMERASE
YBHE

(Escherichia
coli) 		PF10282
(Lactonase) 		4 ASP A  48
SER A  46
LEU A 117
GLY A 116
 None
 1.08A 2j2pA-1ri6A:
undetectable
2j2pB-1ri6A:
0.9		 2j2pA-1ri6A:
20.57
2j2pB-1ri6A:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ry2 ACETYL-COENZYME A
SYNTHETASE 1

(Saccharomyces
cerevisiae) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		4 ASP A 467
SER A 441
GLY A 443
ARG A 418
 AMP  A 720 (-3.4A)
None
AMP  A 720 (-3.9A)
None
 1.23A 2j2pA-1ry2A:
undetectable
2j2pB-1ry2A:
undetectable		 2j2pA-1ry2A:
15.13
2j2pB-1ry2A:
15.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uc8 LYSINE BIOSYNTHESIS
ENZYME

(Thermus
thermophilus) 		PF08443
(RimK) 		4 SER A 280
LEU A  72
GLY A  73
ARG A  42
 None
 1.11A 2j2pA-1uc8A:
undetectable
2j2pB-1uc8A:
undetectable		 2j2pA-1uc8A:
17.79
2j2pB-1uc8A:
17.79
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.
1yq2 BETA-GALACTOSIDASE

(Arthrobacter
sp. C2-2) 		PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 ASP A1002
LEU A 994
GLY A 995
ARG A 766
 None
 1.01A 2j2pA-1yq2A:
undetectable
2j2pB-1yq2A:
undetectable		 2j2pA-1yq2A:
12.39
2j2pB-1yq2A:
12.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zak ADENYLATE KINASE

(Zea mays) 		PF00406
(ADK) 		4 ASP A  90
SER A  35
GLY A  19
ARG A 158
 None
None
AP5  A 223 (-3.6A)
AP5  A 223 (-2.9A)
 1.08A 2j2pA-1zakA:
undetectable
2j2pB-1zakA:
undetectable		 2j2pA-1zakA:
21.43
2j2pB-1zakA:
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.
1zli CARBOXYPEPTIDASE B

(Homo sapiens) 		PF00246
(Peptidase_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.96A 2j2pA-1zliA:
undetectable
2j2pB-1zliA:
undetectable		 2j2pA-1zliA:
23.00
2j2pB-1zliA:
23.00
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.
2boa CARBOXYPEPTIDASE A4

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A1197
LEU A1280
GLY A1278
ARG A1124
 None
 0.93A 2j2pA-2boaA:
undetectable
2j2pB-2boaA:
undetectable		 2j2pA-2boaA:
19.55
2j2pB-2boaA:
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.
2c6x CITRATE SYNTHASE 1

(Bacillus
subtilis) 		PF00285
(Citrate_synt) 		4 ASP A 196
SER A 199
LEU A 101
GLY A 102
 None
 1.01A 2j2pA-2c6xA:
undetectable
2j2pB-2c6xA:
undetectable		 2j2pA-2c6xA:
18.99
2j2pB-2c6xA:
18.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d39 FICOLIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 ASP A 163
SER A 165
LEU A 183
GLY A 184
 None
 0.19A 2j2pA-2d39A:
32.9
2j2pB-2d39A:
33.3		 2j2pA-2d39A:
81.65
2j2pB-2d39A:
81.65
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.
2g3b PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Rhodococcus
jostii) 		PF00440
(TetR_N)
PF13977
(TetR_C_6) 		4 SER A 107
LEU A  24
GLY A  20
ARG A  47
 None
 1.15A 2j2pA-2g3bA:
undetectable
2j2pB-2g3bA:
undetectable		 2j2pA-2g3bA:
20.75
2j2pB-2g3bA:
20.75
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.
2gwn DIHYDROOROTASE

(Porphyromonas
gingivalis) 		PF01979
(Amidohydro_1) 		4 ASP A 389
SER A 391
LEU A   9
GLY A  52
 None
 1.23A 2j2pA-2gwnA:
undetectable
2j2pB-2gwnA:
undetectable		 2j2pA-2gwnA:
18.52
2j2pB-2gwnA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h39 PROBABLE
GALACTOSE-1-PHOSPHAT
E URIDYL TRANSFERASE

(Arabidopsis
thaliana) 		PF01087
(GalP_UDP_transf)
PF02744
(GalP_UDP_tr_C) 		4 ASP A 269
SER A 231
LEU A 274
GLY A 272
 None
 0.89A 2j2pA-2h39A:
undetectable
2j2pB-2h39A:
undetectable		 2j2pA-2h39A:
17.81
2j2pB-2h39A:
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.
2hsi PUTATIVE PEPTIDASE
M23

(Pseudomonas
aeruginosa) 		PF01551
(Peptidase_M23) 		4 ASP A 217
SER A 145
LEU A  61
GLY A 221
 None
 1.17A 2j2pA-2hsiA:
undetectable
2j2pB-2hsiA:
undetectable		 2j2pA-2hsiA:
21.58
2j2pB-2hsiA:
21.58
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.
2oq1 TYROSINE-PROTEIN
KINASE ZAP-70

(Homo sapiens) 		PF00017
(SH2) 		4 ASP A   5
LEU A  45
GLY A  46
ARG A 121
 None
 1.17A 2j2pA-2oq1A:
undetectable
2j2pB-2oq1A:
undetectable		 2j2pA-2oq1A:
19.25
2j2pB-2oq1A:
19.25
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.
2pcu CARBOXYPEPTIDASE A4

(Homo sapiens) 		PF00246
(Peptidase_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
GOL  A 501 (-4.4A)
None
GOL  A 501 (-4.0A)
 0.93A 2j2pA-2pcuA:
undetectable
2j2pB-2pcuA:
undetectable		 2j2pA-2pcuA:
21.32
2j2pB-2pcuA:
21.32
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.
2qjt NICOTINAMIDE-NUCLEOT
IDE
ADENYLYLTRANSFERASE

(Francisella
tularensis) 		no annotation 4 ASP B 207
SER B 287
GLY B 235
ARG B 282
 None
None
AMP  B 602 (-3.3A)
None
 1.10A 2j2pA-2qjtB:
undetectable
2j2pB-2qjtB:
undetectable		 2j2pA-2qjtB:
20.45
2j2pB-2qjtB:
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.
2va8 SKI2-TYPE HELICASE

(Sulfolobus
solfataricus) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 ASP A 126
SER A 161
LEU A 434
GLY A 435
 None
 1.04A 2j2pA-2va8A:
undetectable
2j2pB-2va8A:
undetectable		 2j2pA-2va8A:
14.86
2j2pB-2va8A:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vro ALDEHYDE
DEHYDROGENASE

(Paraburkholderia
xenovorans) 		PF00171
(Aldedh) 		4 ASP A 269
SER A 442
LEU A 420
ARG A 450
 None
 1.16A 2j2pA-2vroA:
undetectable
2j2pB-2vroA:
undetectable		 2j2pA-2vroA:
17.20
2j2pB-2vroA:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wia FERROUS IRON
TRANSPORT PROTEIN B

(Klebsiella
pneumoniae) 		PF02421
(FeoB_N) 		4 SER A 215
LEU A 206
GLY A 205
ARG A 248
 None
 0.97A 2j2pA-2wiaA:
undetectable
2j2pB-2wiaA:
undetectable		 2j2pA-2wiaA:
19.71
2j2pB-2wiaA:
19.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wnp FICOLIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		4 ASP F 134
SER F 136
LEU F 154
GLY F 155
 None
 0.30A 2j2pA-2wnpF:
39.4
2j2pB-2wnpF:
40.5		 2j2pA-2wnpF:
83.49
2j2pB-2wnpF:
83.49
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.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		4 SER A 889
LEU A 892
GLY A 877
ARG A 953
 None
 1.23A 2j2pA-2xvgA:
undetectable
2j2pB-2xvgA:
undetectable		 2j2pA-2xvgA:
12.76
2j2pB-2xvgA:
12.76
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.
2yyh 8-OXO-DGTPASE DOMAIN

(Aquifex
aeolicus) 		PF00293
(NUDIX) 		4 ASP A  13
SER A  90
GLY A  44
ARG A  85
 None
 1.14A 2j2pA-2yyhA:
undetectable
2j2pB-2yyhA:
undetectable		 2j2pA-2yyhA:
19.16
2j2pB-2yyhA:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b9y AMMONIUM TRANSPORTER
FAMILY RH-LIKE
PROTEIN

(Nitrosomonas
europaea) 		PF00909
(Ammonium_transp) 		4 ASP A 162
SER A 276
LEU A 329
GLY A 328
 None
 1.21A 2j2pA-3b9yA:
undetectable
2j2pB-3b9yA:
undetectable		 2j2pA-3b9yA:
21.69
2j2pB-3b9yA:
21.69
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.
3c0k UPF0064 PROTEIN YCCW

(Escherichia
coli) 		PF10672
(Methyltrans_SAM) 		4 SER A 109
LEU A 386
GLY A 385
ARG A 371
 None
 0.84A 2j2pA-3c0kA:
undetectable
2j2pB-3c0kA:
undetectable		 2j2pA-3c0kA:
20.40
2j2pB-3c0kA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cnj CHOLESTEROL OXIDASE

(Streptomyces
sp. SA-COO) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 ASP A 474
SER A 476
LEU A 292
GLY A 293
 FAD  A 510 (-4.4A)
None
None
FAD  A 510 ( 4.0A)
 1.13A 2j2pA-3cnjA:
undetectable
2j2pB-3cnjA:
undetectable		 2j2pA-3cnjA:
19.88
2j2pB-3cnjA:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d4u CARBOXYPEPTIDASE B2

(Bos taurus) 		PF00246
(Peptidase_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.97A 2j2pA-3d4uA:
undetectable
2j2pB-3d4uA:
undetectable		 2j2pA-3d4uA:
19.60
2j2pB-3d4uA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e1t HALOGENASE

(Chondromyces
crocatus) 		PF04820
(Trp_halogenase) 		4 ASP A 371
SER A 374
GLY A 218
ARG A 258
 None
 1.21A 2j2pA-3e1tA:
undetectable
2j2pB-3e1tA:
undetectable		 2j2pA-3e1tA:
16.93
2j2pB-3e1tA:
16.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e2i THYMIDINE KINASE

(Staphylococcus
aureus) 		PF00265
(TK) 		4 ASP A  88
SER A  22
LEU A 116
GLY A 115
 None
GOL  A 201 (-2.8A)
None
None
 1.01A 2j2pA-3e2iA:
undetectable
2j2pB-3e2iA:
undetectable		 2j2pA-3e2iA:
21.65
2j2pB-3e2iA:
21.65
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.
3e4c CASPASE-1

(Homo sapiens) 		PF00656
(Peptidase_C14) 		4 ASP A 185
SER A 347
LEU A 353
GLY A 351
 None
 1.20A 2j2pA-3e4cA:
undetectable
2j2pB-3e4cA:
undetectable		 2j2pA-3e4cA:
22.81
2j2pB-3e4cA:
22.81
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.
3ehc SNOAL-LIKE
POLYKETIDE CYCLASE

(Agrobacterium
fabrum) 		PF07366
(SnoaL) 		4 ASP A  29
LEU A  23
GLY A  24
ARG A  44
 None
 1.21A 2j2pA-3ehcA:
undetectable
2j2pB-3ehcA:
undetectable		 2j2pA-3ehcA:
22.54
2j2pB-3ehcA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fju CARBOXYPEPTIDASE A1

(Homo sapiens) 		PF00246
(Peptidase_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
 0.98A 2j2pA-3fjuA:
undetectable
2j2pB-3fjuA:
undetectable		 2j2pA-3fjuA:
18.99
2j2pB-3fjuA:
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.
3h1l MITOCHONDRIAL
UBIQUINOL-CYTOCHROME
-C REDUCTASE COMPLEX
CORE PROTEIN I

(Gallus gallus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		4 ASP A 226
SER A 220
LEU A  19
GLY A  22
 None
 1.09A 2j2pA-3h1lA:
undetectable
2j2pB-3h1lA:
undetectable		 2j2pA-3h1lA:
20.00
2j2pB-3h1lA:
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 5

(Thermus
thermophilus) 		PF00329
(Complex1_30kDa) 		4 ASP 5  19
LEU 5  22
GLY 5  23
ARG 5 193
 None
 1.23A 2j2pA-3i9v5:
undetectable
2j2pB-3i9v5:
undetectable		 2j2pA-3i9v5:
20.92
2j2pB-3i9v5:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3is5 CALCIUM-DEPENDENT
PROTEIN KINASE

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		4 ASP A 270
SER A 275
LEU A 267
GLY A 215
 None
GOL  A 400 ( 4.7A)
None
None
 0.96A 2j2pA-3is5A:
undetectable
2j2pB-3is5A:
undetectable		 2j2pA-3is5A:
18.40
2j2pB-3is5A:
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.
3itd 17BETA-HYDROXYSTEROI
D DEHYDROGENASE

(Curvularia
lunata) 		PF13561
(adh_short_C2) 		4 SER A  68
LEU A  41
GLY A  39
ARG A  15
 None
 0.93A 2j2pA-3itdA:
undetectable
2j2pB-3itdA:
undetectable		 2j2pA-3itdA:
22.30
2j2pB-3itdA:
22.30
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.
3lms CARBOXYPEPTIDASE B2

(Homo sapiens) 		PF00246
(Peptidase_M14) 		4 SER A 197
LEU A 280
GLY A 278
ARG A 124
 None
GOL  A 505 (-4.6A)
None
GOL  A 505 (-3.9A)
 0.97A 2j2pA-3lmsA:
undetectable
2j2pB-3lmsA:
undetectable		 2j2pA-3lmsA:
21.62
2j2pB-3lmsA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3osl CARBOXYPEPTIDASE B2

(Bos taurus) 		PF00246
(Peptidase_M14) 		4 SER A 311
LEU A 395
GLY A 393
ARG A 236
 None
 0.97A 2j2pA-3oslA:
undetectable
2j2pB-3oslA:
undetectable		 2j2pA-3oslA:
17.90
2j2pB-3oslA:
17.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pie 5'->3'
EXORIBONUCLEASE
(XRN1)

(Kluyveromyces
lactis) 		PF03159
(XRN_N) 		4 ASP A 279
LEU A 724
GLY A 723
ARG A 254
 None
 1.14A 2j2pA-3pieA:
undetectable
2j2pB-3pieA:
undetectable		 2j2pA-3pieA:
11.25
2j2pB-3pieA:
11.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pie 5'->3'
EXORIBONUCLEASE
(XRN1)

(Kluyveromyces
lactis) 		PF03159
(XRN_N) 		4 SER A  56
LEU A 696
GLY A 695
ARG A1220
 None
 1.24A 2j2pA-3pieA:
undetectable
2j2pB-3pieA:
undetectable		 2j2pA-3pieA:
11.25
2j2pB-3pieA:
11.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q9n COA BINDING PROTEIN
CONSENSUS ANKYRIN
REPEAT

(Escherichia
coli) 		PF12796
(Ank_2)
PF13380
(CoA_binding_2)
PF13637
(Ank_4) 		4 ASP C 139
LEU C 133
GLY C 134
ARG A 115
 None
 1.23A 2j2pA-3q9nC:
undetectable
2j2pB-3q9nC:
undetectable		 2j2pA-3q9nC:
18.89
2j2pB-3q9nC:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r7s CASPASE-2 SUBUNIT
P18

(Homo sapiens) 		PF00656
(Peptidase_C14) 		4 ASP A 268
SER A 196
LEU A 201
GLY A 200
 None
 1.18A 2j2pA-3r7sA:
undetectable
2j2pB-3r7sA:
undetectable		 2j2pA-3r7sA:
21.50
2j2pB-3r7sA:
21.50
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.
3rlf MALTOSE TRANSPORT
SYSTEM PERMEASE
PROTEIN MALG
MALTOSE/MALTODEXTRIN
IMPORT ATP-BINDING
PROTEIN MALK

(Escherichia
coli) 		PF00005
(ABC_tran)
PF00528
(BPD_transp_1)
PF08402
(TOBE_2) 		4 SER G 187
LEU A  86
GLY G 293
ARG A 146
 None
 1.17A 2j2pA-3rlfG:
undetectable
2j2pB-3rlfG:
undetectable		 2j2pA-3rlfG:
19.13
2j2pB-3rlfG:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tcm ALANINE
AMINOTRANSFERASE 2

(Hordeum vulgare) 		PF00155
(Aminotran_1_2) 		4 ASP A 146
SER A 335
LEU A 342
GLY A 309
 None
 1.17A 2j2pA-3tcmA:
undetectable
2j2pB-3tcmA:
undetectable		 2j2pA-3tcmA:
17.97
2j2pB-3tcmA:
17.97
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.
3thn EXONUCLEASE,
PUTATIVE

(Thermotoga
maritima) 		PF00149
(Metallophos) 		4 ASP A  14
SER A  13
LEU A 214
GLY A 215
 MN  A 360 (-3.4A)
None
None
None
 1.19A 2j2pA-3thnA:
undetectable
2j2pB-3thnA:
undetectable		 2j2pA-3thnA:
19.76
2j2pB-3thnA:
19.76
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.
3vqi ATG5

(Kluyveromyces
marxianus) 		PF04106
(APG5) 		4 ASP A  42
SER A 261
LEU A  89
GLY A  87
 None
 1.08A 2j2pA-3vqiA:
undetectable
2j2pB-3vqiA:
undetectable		 2j2pA-3vqiA:
18.91
2j2pB-3vqiA:
18.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4apl APICAL MEMBRANE
ANTIGEN 1

(Neospora
caninum) 		PF02430
(AMA-1) 		4 ASP A 274
SER A 182
LEU A 185
GLY A 186
 None
 1.12A 2j2pA-4aplA:
undetectable
2j2pB-4aplA:
undetectable		 2j2pA-4aplA:
20.14
2j2pB-4aplA:
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.
4aw2 SERINE/THREONINE-PRO
TEIN KINASE MRCK
ALPHA

(Rattus
norvegicus) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		4 ASP A 412
SER A  27
GLY A 401
ARG A  71
 None
None
None
22E  A 500 ( 4.0A)
 0.84A 2j2pA-4aw2A:
undetectable
2j2pB-4aw2A:
undetectable		 2j2pA-4aw2A:
20.28
2j2pB-4aw2A:
20.28
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 ASP A 453
SER A 451
LEU A1270
GLY A1268
 None
 1.10A 2j2pA-4bedA:
undetectable
2j2pB-4bedA:
undetectable		 2j2pA-4bedA:
8.77
2j2pB-4bedA:
8.77
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.
4bh6 APC/C ACTIVATOR
PROTEIN CDH1

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 ASP A 363
SER A 361
GLY A 324
ARG A 369
 None
 0.86A 2j2pA-4bh6A:
undetectable
2j2pB-4bh6A:
undetectable		 2j2pA-4bh6A:
22.29
2j2pB-4bh6A:
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.
4bm1 MANGANESE PEROXIDASE
4

(Pleurotus
ostreatus) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 ASP A  69
SER A  71
LEU A 144
GLY A  52
 CA  A 401 (-3.1A)
CA  A 401 (-2.4A)
None
CA  A 401 ( 4.9A)
 1.05A 2j2pA-4bm1A:
undetectable
2j2pB-4bm1A:
undetectable		 2j2pA-4bm1A:
21.01
2j2pB-4bm1A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c4a PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Mus musculus) 		PF06325
(PrmA) 		4 ASP A  70
LEU A  77
GLY A  76
ARG A  44
 SAH  A1689 ( 4.4A)
SAH  A1689 ( 4.5A)
None
SAH  A1689 (-2.7A)
 1.20A 2j2pA-4c4aA:
undetectable
2j2pB-4c4aA:
undetectable		 2j2pA-4c4aA:
15.20
2j2pB-4c4aA:
15.20
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.
4deq NEUROPILIN-1,
VASCULAR ENDOTHELIAL
GROWTH FACTOR A

(Homo sapiens) 		PF00754
(F5_F8_type_C)
PF14554
(VEGF_C) 		4 ASP A 158
SER A 160
LEU A 126
GLY A 163
 None
 1.12A 2j2pA-4deqA:
undetectable
2j2pB-4deqA:
undetectable		 2j2pA-4deqA:
20.00
2j2pB-4deqA:
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.
4dqd EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		4 SER A 199
LEU A 205
GLY A 202
ARG A 234
 None
None
GOL  A 403 (-3.5A)
None
 1.21A 2j2pA-4dqdA:
undetectable
2j2pB-4dqdA:
undetectable		 2j2pA-4dqdA:
19.83
2j2pB-4dqdA:
19.83
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.
4gbm CURM
SULFOTRANSFERASE

(Moorea
producens) 		PF13469
(Sulfotransfer_3) 		4 SER A 263
LEU A  85
GLY A  84
ARG A  72
 None
SO4  A 416 (-3.6A)
SO4  A 416 ( 4.9A)
SO4  A 416 (-2.9A)
 0.85A 2j2pA-4gbmA:
undetectable
2j2pB-4gbmA:
undetectable		 2j2pA-4gbmA:
20.06
2j2pB-4gbmA:
20.06
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.
4gwn MEPRIN A SUBUNIT
BETA

(Homo sapiens) 		PF00629
(MAM)
PF01400
(Astacin) 		4 ASP A 353
SER A 316
LEU A 412
GLY A 413
 None
 1.21A 2j2pA-4gwnA:
undetectable
2j2pB-4gwnA:
undetectable		 2j2pA-4gwnA:
17.56
2j2pB-4gwnA:
17.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i0x ESAT-6-LIKE PROTEIN
MAB_3112
ESAT-6-LIKE PROTEIN
MAB_3113

(Mycobacteroides
abscessus) 		PF06013
(WXG100) 		4 ASP A   2
LEU A   7
GLY A   5
ARG B  40
 None
 1.21A 2j2pA-4i0xA:
undetectable
2j2pB-4i0xA:
undetectable		 2j2pA-4i0xA:
16.06
2j2pB-4i0xA:
16.06
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.
4j2g KLTH0A00704P

(Lachancea
thermotolerans) 		PF10033
(ATG13) 		4 SER A 202
LEU A 208
GLY A 207
ARG A 118
 SO4  A 301 ( 4.5A)
SO4  A 301 (-4.0A)
SO4  A 301 (-3.6A)
SO4  A 301 (-2.6A)
 0.87A 2j2pA-4j2gA:
undetectable
2j2pB-4j2gA:
undetectable		 2j2pA-4j2gA:
22.18
2j2pB-4j2gA:
22.18
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.
4j3b M1 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		4 ASP A1012
SER A1014
LEU A1020
GLY A1017
 None
 1.19A 2j2pA-4j3bA:
undetectable
2j2pB-4j3bA:
undetectable		 2j2pA-4j3bA:
13.42
2j2pB-4j3bA:
13.42
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.
4l7a UNCHARACTERIZED
PROTEIN

(Bacteroides
caccae) 		PF15890
(Peptidase_Mx1) 		4 ASP A 224
LEU A 210
GLY A 211
ARG A 202
 None
 0.90A 2j2pA-4l7aA:
undetectable
2j2pB-4l7aA:
undetectable		 2j2pA-4l7aA:
19.23
2j2pB-4l7aA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nbq POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Coxiella
burnetii) 		PF00013
(KH_1)
PF00575
(S1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		4 SER A 437
LEU A 485
GLY A 486
ARG A 328
 SO4  A 701 (-2.9A)
None
None
None
 1.18A 2j2pA-4nbqA:
undetectable
2j2pB-4nbqA:
undetectable		 2j2pA-4nbqA:
13.94
2j2pB-4nbqA:
13.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q00 FERROUS IRON
TRANSPORT PROTEIN B

(Escherichia
coli) 		PF02421
(FeoB_N) 		4 SER A 215
LEU A 206
GLY A 205
ARG A 248
 None
 0.93A 2j2pA-4q00A:
undetectable
2j2pB-4q00A:
undetectable		 2j2pA-4q00A:
18.82
2j2pB-4q00A:
18.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r9j FICOLIN-2

(Homo sapiens) 		no annotation 4 ASP G 125
SER G 127
LEU G 145
GLY G 146
 None
 0.45A 2j2pA-4r9jG:
39.9
2j2pB-4r9jG:
41.0		 2j2pA-4r9jG:
99.08
2j2pB-4r9jG:
99.08
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.
4rzz PEPTIDASE M24

(Ruegeria
lacuscaerulensis) 		PF00557
(Peptidase_M24) 		4 ASP A  53
LEU A  19
GLY A  22
ARG A  29
 None
 1.10A 2j2pA-4rzzA:
undetectable
2j2pB-4rzzA:
undetectable		 2j2pA-4rzzA:
17.96
2j2pB-4rzzA:
17.96
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.
4ubs PENTALENIC ACID
SYNTHASE

(Streptomyces
avermitilis) 		PF00067
(p450) 		4 ASP A  96
SER A  67
LEU A  93
GLY A  94
 None
None
HEM  A 501 ( 4.1A)
PO4  A 523 ( 3.8A)
 1.24A 2j2pA-4ubsA:
undetectable
2j2pB-4ubsA:
undetectable		 2j2pA-4ubsA:
20.20
2j2pB-4ubsA:
20.20
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.
4uf4 CARBOXYPEPTIDASE A1

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A 307
LEU A 390
GLY A 388
ARG A 234
 None
 0.94A 2j2pA-4uf4A:
undetectable
2j2pB-4uf4A:
undetectable		 2j2pA-4uf4A:
19.51
2j2pB-4uf4A:
19.51
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.
4yiv APICAL MEMBRANE
ANTIGEN AMA1

(Toxoplasma
gondii) 		PF02430
(AMA-1) 		4 ASP A 280
SER A 188
LEU A 191
GLY A 192
 None
 1.12A 2j2pA-4yivA:
undetectable
2j2pB-4yivA:
undetectable		 2j2pA-4yivA:
20.59
2j2pB-4yivA:
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.
4yk6 ADENOMATOUS
POLYPOSIS COLI
PROTEIN

(Homo sapiens) 		PF00514
(Arm)
PF16629
(Arm_APC_u3) 		4 ASP A 482
SER A 494
LEU A 488
GLY A 487
 None
 0.98A 2j2pA-4yk6A:
undetectable
2j2pB-4yk6A:
undetectable		 2j2pA-4yk6A:
19.44
2j2pB-4yk6A:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ypt REPLICASE
POLYPROTEIN 1AB

(Murine
coronavirus) 		PF08715
(Viral_protease) 		4 ASP A1666
SER A1665
LEU A1637
GLY A1638
 None
 1.16A 2j2pA-4yptA:
undetectable
2j2pB-4yptA:
undetectable		 2j2pA-4yptA:
23.74
2j2pB-4yptA:
23.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z79 LEIOMODIN-1
ACTIN-BINDING SITE 2
(ABS2)

(Homo sapiens) 		no annotation 4 ASP A 373
LEU A 405
GLY A 401
ARG A 409
 None
None
None
CL  A 507 (-4.1A)
 1.22A 2j2pA-4z79A:
undetectable
2j2pB-4z79A:
undetectable		 2j2pA-4z79A:
19.82
2j2pB-4z79A:
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.
4z94 GELSOLIN,
TROPOMODULIN-1,
LEIOMODIN-1 CHIMERA

(Homo sapiens) 		PF00626
(Gelsolin) 		4 ASP G1373
LEU G1405
GLY G1401
ARG G1409
 None
 1.14A 2j2pA-4z94G:
undetectable
2j2pB-4z94G:
undetectable		 2j2pA-4z94G:
21.85
2j2pB-4z94G:
21.85
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.
4zoh PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 SER A 184
LEU A 165
GLY A 212
ARG A 245
 None
FES  C 202 ( 4.1A)
None
None
 1.08A 2j2pA-4zohA:
undetectable
2j2pB-4zohA:
undetectable		 2j2pA-4zohA:
16.12
2j2pB-4zohA:
16.12
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.
5a31 THE
ANAPHASE-PROMOTING
COMPLEX CHAIN R

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 ASP R 287
SER R 285
GLY R 248
ARG R 293
 None
 0.88A 2j2pA-5a31R:
undetectable
2j2pB-5a31R:
undetectable		 2j2pA-5a31R:
21.41
2j2pB-5a31R:
21.41
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.
5a6c G-PROTEIN-SIGNALING
MODULATOR 2, AFADIN

(Homo sapiens) 		PF13176
(TPR_7)
PF13181
(TPR_8)
PF13424
(TPR_12) 		4 ASP A  81
SER A  55
LEU A  92
GLY A  93
 None
 0.97A 2j2pA-5a6cA:
undetectable
2j2pB-5a6cA:
undetectable		 2j2pA-5a6cA:
22.87
2j2pB-5a6cA:
22.87
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.
5eks 3-DEHYDROQUINATE
SYNTHASE

(Acinetobacter
baumannii) 		PF01761
(DHQ_synthase) 		4 ASP A 192
LEU A 336
GLY A 337
ARG A 291
 None
 1.20A 2j2pA-5eksA:
undetectable
2j2pB-5eksA:
undetectable		 2j2pA-5eksA:
21.87
2j2pB-5eksA:
21.87
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.
5f3y ANKYRIN REPEAT AND
SAM
DOMAIN-CONTAINING
PROTEIN 4B
UNCONVENTIONAL
MYOSIN-VIIB

(Mus musculus) 		PF00784
(MyTH4)
no annotation 		4 SER A1295
LEU B 270
GLY B 269
ARG A1265
 None
 1.16A 2j2pA-5f3yA:
undetectable
2j2pB-5f3yA:
undetectable		 2j2pA-5f3yA:
18.00
2j2pB-5f3yA:
18.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fhx ANTIBODY FRAGMENT
HEAVY-CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 SER H 237
LEU H 135
GLY H 134
ARG H 243
 None
 1.22A 2j2pA-5fhxH:
undetectable
2j2pB-5fhxH:
undetectable		 2j2pA-5fhxH:
22.69
2j2pB-5fhxH:
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.
5fql IDURONATE-2-SULFATAS
E

(Homo sapiens) 		PF00884
(Sulfatase) 		4 ASP A 252
LEU A 339
GLY A 340
ARG A  48
 None
 0.81A 2j2pA-5fqlA:
undetectable
2j2pB-5fqlA:
undetectable		 2j2pA-5fqlA:
16.42
2j2pB-5fqlA:
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.
5h1k GEM-ASSOCIATED
PROTEIN 5

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 ASP A 557
SER A 559
LEU A 553
GLY A 554
 None
 1.22A 2j2pA-5h1kA:
undetectable
2j2pB-5h1kA:
undetectable		 2j2pA-5h1kA:
15.63
2j2pB-5h1kA:
15.63
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.
5hvf CARBOXYPEPTIDASE B2

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 SER A 289
LEU A 373
GLY A 371
ARG A 214
 None
 0.91A 2j2pA-5hvfA:
undetectable
2j2pB-5hvfA:
undetectable		 2j2pA-5hvfA:
19.80
2j2pB-5hvfA:
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.
5kx6 GALACTOSIDE
2-ALPHA-L-FUCOSYLTRA
NSFERASE

(Arabidopsis
thaliana) 		PF03254
(XG_FTase) 		4 ASP A  95
LEU A 101
GLY A 100
ARG A 333
 None
 1.09A 2j2pA-5kx6A:
undetectable
2j2pB-5kx6A:
undetectable		 2j2pA-5kx6A:
18.12
2j2pB-5kx6A:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l5n PLEXIN-A4

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		4 ASP A 429
SER A 451
LEU A 454
GLY A 448
 ASP  A 429 ( 0.5A)
SER  A 451 ( 0.0A)
LEU  A 454 ( 0.5A)
GLY  A 448 ( 0.0A)
 1.11A 2j2pA-5l5nA:
undetectable
2j2pB-5l5nA:
undetectable		 2j2pA-5l5nA:
11.41
2j2pB-5l5nA:
11.41
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.
5l9w ACETOPHENONE
CARBOXYLASE DELTA
SUBUNIT
ACETOPHENONE
CARBOXYLASE GAMMA
SUBUNIT

(Aromatoleum
aromaticum) 		PF01968
(Hydantoinase_A)
PF02538
(Hydantoinase_B)
PF05378
(Hydant_A_N) 		4 SER A 409
LEU B 569
GLY B 571
ARG B 517
 EPE  A 704 (-3.7A)
None
EPE  A 704 ( 4.9A)
None
 1.11A 2j2pA-5l9wA:
undetectable
2j2pB-5l9wA:
undetectable		 2j2pA-5l9wA:
14.72
2j2pB-5l9wA:
14.72
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.
5msc CARBOXYLIC ACID
REDUCTASE

(Nocardia
iowensis) 		PF00501
(AMP-binding) 		4 ASP A 193
SER A 125
LEU A 120
GLY A 122
 None
 1.16A 2j2pA-5mscA:
undetectable
2j2pB-5mscA:
undetectable		 2j2pA-5mscA:
11.25
2j2pB-5mscA:
11.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n4c PROLYL
OLIGOPEPTIDASE

(Galerina
marginata) 		no annotation 4 SER A 211
LEU A  90
GLY A 154
ARG A 410
 None
 1.21A 2j2pA-5n4cA:
undetectable
2j2pB-5n4cA:
undetectable		 2j2pA-5n4cA:
17.05
2j2pB-5n4cA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nnl INACTIVE
DIHYDROOROTASE-LIKE
DOMAIN

(Chaetomium
thermophilum) 		no annotation 4 ASP A1696
SER A1672
LEU A1739
GLY A1737
 None
 1.05A 2j2pA-5nnlA:
undetectable
2j2pB-5nnlA:
undetectable		 2j2pA-5nnlA:
18.87
2j2pB-5nnlA:
18.87
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.
5npr UDP-N-ACETYLGLUCOSAM
INE--PEPTIDE
N-ACETYLGLUCOSAMINYL
TRANSFERASE 110 KDA
SUBUNIT

(Homo sapiens) 		no annotation 4 ASP A 554
SER A 552
LEU A 653
GLY A 654
 None
 1.20A 2j2pA-5nprA:
undetectable
2j2pB-5nprA:
undetectable		 2j2pA-5nprA:
16.98
2j2pB-5nprA:
16.98
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.
5nv8 EF-P ARGININE 32
RHAMNOSYL-TRANSFERAS
E

(Pseudomonas
putida) 		PF10093
(DUF2331) 		4 ASP A 364
LEU A 156
GLY A 154
ARG A 278
 None
 1.14A 2j2pA-5nv8A:
undetectable
2j2pB-5nv8A:
undetectable		 2j2pA-5nv8A:
18.58
2j2pB-5nv8A:
18.58
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.
5u22 N2152

(Neocallimastix
frontalis) 		PF01229
(Glyco_hydro_39) 		4 ASP A 304
LEU A  55
GLY A 295
ARG A  98
 None
 1.17A 2j2pA-5u22A:
undetectable
2j2pB-5u22A:
undetectable		 2j2pA-5u22A:
20.75
2j2pB-5u22A:
20.75
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.
5uc0 UNCHARACTERIZED
PROTEIN COG5400

(Brucella
abortus) 		PF06577
(DUF1134) 		4 ASP A 119
SER A  85
LEU A 116
GLY A 117
 None
 1.08A 2j2pA-5uc0A:
undetectable
2j2pB-5uc0A:
undetectable		 2j2pA-5uc0A:
21.19
2j2pB-5uc0A:
21.19
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.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36

(Bos taurus) 		no annotation 4 ASP A 168
LEU A 808
GLY A 809
ARG A 816
 None
 1.13A 2j2pA-5vhaA:
undetectable
2j2pB-5vhaA:
undetectable		 2j2pA-5vhaA:
17.26
2j2pB-5vhaA:
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.
5xd0 GLUCANASE

(Paenibacillus
sp. X4) 		PF01270
(Glyco_hydro_8) 		4 ASP A 158
LEU A 205
GLY A 206
ARG A 219
 None
None
None
PGE  A 501 ( 4.9A)
 0.91A 2j2pA-5xd0A:
undetectable
2j2pB-5xd0A:
undetectable		 2j2pA-5xd0A:
21.87
2j2pB-5xd0A:
21.87
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.
5xyh CBSA

(Xanthomonas
oryzae) 		no annotation 4 ASP A 131
SER A 137
LEU A 141
GLY A 129
 None
 1.08A 2j2pA-5xyhA:
undetectable
2j2pB-5xyhA:
undetectable		 2j2pA-5xyhA:
17.14
2j2pB-5xyhA:
17.14