SIMILAR PATTERNS OF AMINO ACIDS FOR 2J2P_E_SC2E1289_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.
1a88 CHLOROPEROXIDASE L

(Streptomyces
lividans) 		PF00561
(Abhydrolase_1) 		4 ARG A  57
ASP A  70
THR A  73
ASP A   7
 None
 0.76A 2j2pE-1a88A:
0.0
2j2pF-1a88A:
0.1		 2j2pE-1a88A:
21.91
2j2pF-1a88A:
21.91
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.
1a8s CHLOROPEROXIDASE F

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		4 ARG A  55
ASP A  68
THR A  71
ASP A   7
 None
 0.69A 2j2pE-1a8sA:
0.0
2j2pF-1a8sA:
undetectable		 2j2pE-1a8sA:
21.25
2j2pF-1a8sA:
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.
1do5 HUMAN COPPER
CHAPERONE FOR
SUPEROXIDE DISMUTASE
DOMAIN II

(Homo sapiens) 		PF00080
(Sod_Cu) 		4 ASP A 167
ARG A 163
ASP A 151
ASP A 185
 ZN  A  28 (-2.2A)
None
None
None
 0.81A 2j2pE-1do5A:
0.0
2j2pF-1do5A:
0.0		 2j2pE-1do5A:
22.57
2j2pF-1do5A:
22.57
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.
1dqu ISOCITRATE LYASE

(Aspergillus
nidulans) 		PF00463
(ICL) 		4 ASP A 237
ARG A  26
THR A  30
ASP A 390
 None
 1.10A 2j2pE-1dquA:
undetectable
2j2pF-1dquA:
undetectable		 2j2pE-1dquA:
16.57
2j2pF-1dquA:
16.57
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.
1gfn MATRIX PORIN OUTER
MEMBRANE PROTEIN F

(Escherichia
coli) 		PF00267
(Porin_1) 		4 ARG A 140
ASP A  97
THR A 138
ASP A 107
 None
 0.84A 2j2pE-1gfnA:
0.0
2j2pF-1gfnA:
0.0		 2j2pE-1gfnA:
19.16
2j2pF-1gfnA:
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.
1hsj FUSION PROTEIN
CONSISTING OF
STAPHYLOCOCCUS
ACCESSORY REGULATOR
PROTEIN R AND
MALTOSE BINDING
PROTEIN

(Escherichia
coli;
Staphylococcus
aureus) 		PF01547
(SBP_bac_1) 		4 ASP A 197
THR A 193
LYS A 200
ASP A 358
 None
 1.21A 2j2pE-1hsjA:
0.0
2j2pF-1hsjA:
undetectable		 2j2pE-1hsjA:
18.32
2j2pF-1hsjA:
18.32
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 ARG A 271
ASP A 273
THR A 275
ASP A 280
 None
 1.25A 2j2pE-1knrA:
undetectable
2j2pF-1knrA:
0.0		 2j2pE-1knrA:
16.44
2j2pF-1knrA:
16.44
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 ARG A 286
ASP A 149
THR A 152
ASP A 331
 None
 0.91A 2j2pE-1nneA:
undetectable
2j2pF-1nneA:
0.0		 2j2pE-1nneA:
13.25
2j2pF-1nneA:
13.25
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.
1nph GELSOLIN

(Mus musculus) 		PF00626
(Gelsolin) 		4 ARG A 711
ASP A 712
THR A 715
ASP A 675
 None
 0.76A 2j2pE-1nphA:
0.0
2j2pF-1nphA:
0.0		 2j2pE-1nphA:
22.12
2j2pF-1nphA:
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.
1nrk YGFZ PROTEIN

(Escherichia
coli) 		PF01571
(GCV_T) 		4 ASP A 112
ARG A 115
ASP A 166
ASP A  78
 None
 1.03A 2j2pE-1nrkA:
undetectable
2j2pF-1nrkA:
undetectable		 2j2pE-1nrkA:
22.29
2j2pF-1nrkA:
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.
1osm OMPK36

(Klebsiella
pneumoniae) 		PF00267
(Porin_1) 		4 ARG A 140
ASP A  97
THR A 138
ASP A 107
 None
 0.98A 2j2pE-1osmA:
undetectable
2j2pF-1osmA:
undetectable		 2j2pE-1osmA:
21.97
2j2pF-1osmA:
21.97
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.
1qv9 F420-DEPENDENT
METHYLENETETRAHYDROM
ETHANOPTERIN
DEHYDROGENASE

(Methanopyrus
kandleri) 		PF01993
(MTD) 		4 ASP A  25
ARG A  30
ASP A 269
ASP A 162
 None
 1.06A 2j2pE-1qv9A:
undetectable
2j2pF-1qv9A:
undetectable		 2j2pE-1qv9A:
20.92
2j2pF-1qv9A:
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.
1srd COPPER,ZINC
SUPEROXIDE DISMUTASE

(Spinacia
oleracea) 		PF00080
(Sod_Cu) 		4 ASP A  83
ARG A  79
ASP A  67
ASP A 101
 ZN  A 156 (-2.7A)
None
None
None
 0.91A 2j2pE-1srdA:
undetectable
2j2pF-1srdA:
undetectable		 2j2pE-1srdA:
20.63
2j2pF-1srdA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wg8 PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01795
(Methyltransf_5) 		4 ASP A 106
ARG A 109
ASP A 120
ASP A  53
 None
 1.16A 2j2pE-1wg8A:
undetectable
2j2pF-1wg8A:
undetectable		 2j2pE-1wg8A:
21.60
2j2pF-1wg8A:
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.
1wvi PUTATIVE
PHOSPHATASES
INVOLVED IN
N-ACETYL-GLUCOSAMINE
CATABOLISM

(Streptococcus
mutans) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		4 ASP A1011
ASP A1148
THR A1210
ASP A1009
 None
 1.28A 2j2pE-1wviA:
undetectable
2j2pF-1wviA:
undetectable		 2j2pE-1wviA:
19.08
2j2pF-1wviA:
19.08
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.
2a8k COLICIN E5

(Escherichia
coli) 		PF12106
(Colicin_E5) 		4 ARG A  60
ASP A  62
THR A  80
ASP A  56
 None
 1.25A 2j2pE-2a8kA:
undetectable
2j2pF-2a8kA:
undetectable		 2j2pE-2a8kA:
18.30
2j2pF-2a8kA:
18.30
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 167
ARG A 170
ASP A 171
LYS A 259
 None
 0.57A 2j2pE-2d39A:
33.1
2j2pF-2d39A:
33.2		 2j2pE-2d39A:
81.65
2j2pF-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.
2drw D-AMINO ACID AMIDASE

(Ochrobactrum
anthropi) 		PF00144
(Beta-lactamase) 		4 ARG A 250
ASP A 251
THR A 248
LYS A 254
 None
 1.06A 2j2pE-2drwA:
undetectable
2j2pF-2drwA:
undetectable		 2j2pE-2drwA:
21.33
2j2pF-2drwA:
21.33
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.
2f3x TRANSCRIPTION FACTOR
FAPR

(Bacillus
subtilis) 		PF03061
(4HBT) 		4 ASP A 124
ARG A 184
THR A 162
ASP A  84
 None
 0.96A 2j2pE-2f3xA:
undetectable
2j2pF-2f3xA:
undetectable		 2j2pE-2f3xA:
21.10
2j2pF-2f3xA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hvq HYPOTHETICAL 37.6
KDA PROTEIN IN
GP24-HOC INTERGENIC
REGION

(Escherichia
virus T4) 		PF09414
(RNA_ligase) 		4 ASP A 292
ARG A 266
THR A 263
ASP A 113
 None
 1.24A 2j2pE-2hvqA:
undetectable
2j2pF-2hvqA:
undetectable		 2j2pE-2hvqA:
20.00
2j2pF-2hvqA:
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		4 ARG A 260
ASP A 609
THR A 604
ASP A 598
 None
 1.20A 2j2pE-2i0kA:
undetectable
2j2pF-2i0kA:
undetectable		 2j2pE-2i0kA:
18.80
2j2pF-2i0kA:
18.80
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.
2i1y RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 ARG A 750
ASP A 747
THR A 728
ASP A 763
 None
 1.00A 2j2pE-2i1yA:
undetectable
2j2pF-2i1yA:
undetectable		 2j2pE-2i1yA:
20.00
2j2pF-2i1yA:
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.
2iqx PHOSPHATIDYLETHANOLA
MINE-BINDING PROTEIN
1

(Rattus
norvegicus) 		PF01161
(PBP) 		4 ARG A  26
ASP A  35
THR A  33
LYS A   2
 None
 1.02A 2j2pE-2iqxA:
undetectable
2j2pF-2iqxA:
undetectable		 2j2pE-2iqxA:
20.26
2j2pF-2iqxA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j1n OUTER MEMBRANE
PROTEIN C

(Escherichia
coli) 		PF00267
(Porin_1) 		4 ARG A 132
ASP A  89
THR A 130
ASP A  99
 None
 0.91A 2j2pE-2j1nA:
undetectable
2j2pF-2j1nA:
undetectable		 2j2pE-2j1nA:
20.17
2j2pF-2j1nA:
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.
2jf4 PERIPLASMIC
TREHALASE

(Escherichia
coli) 		PF01204
(Trehalase) 		4 ARG A 273
ASP A 274
THR A 275
ASP A  41
 None
 1.09A 2j2pE-2jf4A:
undetectable
2j2pF-2jf4A:
undetectable		 2j2pE-2jf4A:
18.50
2j2pF-2jf4A:
18.50
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.
2lnu UNCHARACTERIZED
PROTEIN

(Haloarcula
marismortui) 		PF07920
(DUF1684) 		4 ARG A  52
ASP A 145
THR A 143
ASP A   4
 None
 1.15A 2j2pE-2lnuA:
undetectable
2j2pF-2lnuA:
undetectable		 2j2pE-2lnuA:
20.18
2j2pF-2lnuA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o8e DNA MISMATCH REPAIR
PROTEIN MSH6

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 ASP B 736
ARG B1172
ASP B1171
THR B 716
 None
 1.12A 2j2pE-2o8eB:
undetectable
2j2pF-2o8eB:
undetectable		 2j2pE-2o8eB:
12.84
2j2pF-2o8eB:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2obe HEXON

(Human
mastadenovirus
E) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		4 ASP A 730
ARG A 727
ASP A 744
THR A 719
 2HP  A1610 (-3.8A)
None
None
None
 1.17A 2j2pE-2obeA:
undetectable
2j2pF-2obeA:
undetectable		 2j2pE-2obeA:
13.27
2j2pF-2obeA:
13.27
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		4 ARG A 335
ASP A 366
THR A 428
ASP A 308
 None
 1.23A 2j2pE-2okcA:
undetectable
2j2pF-2okcA:
undetectable		 2j2pE-2okcA:
20.22
2j2pF-2okcA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ooq RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE T

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 ARG A 950
ASP A 947
THR A 928
ASP A 963
 None
 1.14A 2j2pE-2ooqA:
undetectable
2j2pF-2ooqA:
undetectable		 2j2pE-2ooqA:
21.31
2j2pF-2ooqA:
21.31
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.
2oq1 TYROSINE-PROTEIN
KINASE ZAP-70

(Homo sapiens) 		PF00017
(SH2) 		4 ARG A  43
ASP A 246
THR A 229
LYS A 244
 None
 1.19A 2j2pE-2oq1A:
undetectable
2j2pF-2oq1A:
undetectable		 2j2pE-2oq1A:
19.25
2j2pF-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.
2q6d INFECTIOUS
BRONCHITIS VIRUS
(IBV) MAIN PROTEASE

(Avian
coronavirus) 		PF05409
(Peptidase_C30) 		4 ASP A 195
ARG A 129
THR A 127
ASP A 290
 None
 1.02A 2j2pE-2q6dA:
undetectable
2j2pF-2q6dA:
undetectable		 2j2pE-2q6dA:
20.71
2j2pF-2q6dA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qhe PHOSPHOLIPASE A2

(Echis carinatus) 		PF00068
(Phospholip_A2_1) 		4 ARG A  72
ASP A  71
THR A  70
LYS A  92
 None
 1.29A 2j2pE-2qheA:
undetectable
2j2pF-2qheA:
undetectable		 2j2pE-2qheA:
18.60
2j2pF-2qheA:
18.60
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 138
ARG F 141
ASP F 142
LYS F 230
 None
 0.56A 2j2pE-2wnpF:
40.5
2j2pF-2wnpF:
39.6		 2j2pE-2wnpF:
83.49
2j2pF-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.
2xe5 OUTER MEMBRANE PORIN
C

(Escherichia
coli) 		PF00267
(Porin_1) 		4 ARG A 132
ASP A  89
THR A 130
ASP A  99
 None
 0.94A 2j2pE-2xe5A:
undetectable
2j2pF-2xe5A:
undetectable		 2j2pE-2xe5A:
22.13
2j2pF-2xe5A:
22.13
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.
2yn9 POTASSIUM-TRANSPORTI
NG ATPASE ALPHA
CHAIN 1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF09040
(H-K_ATPase_N)
PF13246
(Cation_ATPase) 		4 ASP A 628
ASP A 602
THR A 391
ASP A 385
 None
 1.08A 2j2pE-2yn9A:
undetectable
2j2pF-2yn9A:
undetectable		 2j2pE-2yn9A:
10.95
2j2pF-2yn9A:
10.95
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.
2z2n VIRGINIAMYCIN B
LYASE

(Staphylococcus
aureus) 		no annotation 4 ASP A 151
ARG A 166
ASP A 172
THR A 174
 None
 1.16A 2j2pE-2z2nA:
undetectable
2j2pF-2z2nA:
undetectable		 2j2pE-2z2nA:
21.97
2j2pF-2z2nA:
21.97
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.
3ce2 PUTATIVE PEPTIDASE

(Chlamydia
abortus) 		PF01432
(Peptidase_M3)
PF08439
(Peptidase_M3_N) 		4 ASP A 479
ASP A 284
THR A 280
LYS A 287
 None
 1.03A 2j2pE-3ce2A:
undetectable
2j2pF-3ce2A:
undetectable		 2j2pE-3ce2A:
15.88
2j2pF-3ce2A:
15.88
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.
3d23 3C-LIKE PROTEINASE

(Human
coronavirus
HKU1) 		no annotation 4 ASP B 197
ARG B 131
THR B 129
ASP B 286
 None
 1.13A 2j2pE-3d23B:
undetectable
2j2pF-3d23B:
undetectable		 2j2pE-3d23B:
21.64
2j2pF-3d23B:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fg7 VILLIN-1

(Homo sapiens) 		PF00626
(Gelsolin) 		4 ARG A 689
ASP A 690
THR A 693
ASP A 653
 None
 0.84A 2j2pE-3fg7A:
undetectable
2j2pF-3fg7A:
undetectable		 2j2pE-3fg7A:
19.85
2j2pF-3fg7A:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hea ARYLESTERASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		4 ARG A  55
ASP A  68
THR A  71
ASP A   7
 None
 0.82A 2j2pE-3heaA:
undetectable
2j2pF-3heaA:
undetectable		 2j2pE-3heaA:
21.38
2j2pF-3heaA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 3

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		4 ASP 3 237
ARG 3 295
ASP 3 292
ASP 3 228
 None
 1.18A 2j2pE-3i9v3:
undetectable
2j2pF-3i9v3:
undetectable		 2j2pE-3i9v3:
13.97
2j2pF-3i9v3:
13.97
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.
3l2j FUSION PROTEIN OF
MALTOSE-BINDING
PERIPLASMIC PROTEIN
AND PARATHYROID
HORMONE/PARATHYROID
HORMONE-RELATED
PEPTIDE RECEPTOR

(Escherichia
coli;
Homo sapiens) 		PF02793
(HRM)
PF13416
(SBP_bac_8) 		4 ASP A-147
THR A-151
LYS A-144
ASP A  14
 None
 1.20A 2j2pE-3l2jA:
undetectable
2j2pF-3l2jA:
undetectable		 2j2pE-3l2jA:
16.42
2j2pF-3l2jA:
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.
3nvl 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Trypanosoma
brucei) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		4 ASP A 471
ARG A 475
ASP A 476
ASP A  30
 None
 0.97A 2j2pE-3nvlA:
undetectable
2j2pF-3nvlA:
undetectable		 2j2pE-3nvlA:
17.60
2j2pF-3nvlA:
17.60
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.
3py7 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PAXILLIN
LD1,PROTEIN E6
CHIMERA

(Deltapapillomavirus
4;
Escherichia
coli;
Homo sapiens) 		PF00518
(E6)
PF01547
(SBP_bac_1) 		4 ASP A 198
THR A 194
LYS A 201
ASP A 359
 None
 1.21A 2j2pE-3py7A:
undetectable
2j2pF-3py7A:
undetectable		 2j2pE-3py7A:
16.32
2j2pF-3py7A:
16.32
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.
3tfo PUTATIVE
3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE

(Sinorhizobium
meliloti) 		PF00106
(adh_short) 		4 ARG A 168
ASP A 229
THR A 231
ASP A 165
 None
 1.18A 2j2pE-3tfoA:
undetectable
2j2pF-3tfoA:
undetectable		 2j2pE-3tfoA:
20.85
2j2pF-3tfoA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vkw REPLICASE LARGE
SUBUNIT

(Tobacco mosaic
virus) 		PF01443
(Viral_helicase1) 		4 ASP A1089
ARG A1054
ASP A1024
THR A1056
 None
 1.11A 2j2pE-3vkwA:
undetectable
2j2pF-3vkwA:
undetectable		 2j2pE-3vkwA:
17.18
2j2pF-3vkwA:
17.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wfp POLY A POLYMERASE

(Aquifex
aeolicus;
synthetic
construct) 		PF01743
(PolyA_pol)
PF01966
(HD)
PF12627
(PolyA_pol_RNAbd) 		4 ARG A 172
ASP A 203
THR A 201
ASP A 165
 None
 1.27A 2j2pE-3wfpA:
undetectable
2j2pF-3wfpA:
undetectable		 2j2pE-3wfpA:
16.16
2j2pF-3wfpA:
16.16
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.
3won DIPEPTIDYL
AMINOPEPTIDASE BII

(Pseudoxanthomonas
mexicana) 		PF10459
(Peptidase_S46) 		4 ARG A 278
ASP A 574
THR A 276
ASP A 651
 None
 1.17A 2j2pE-3wonA:
undetectable
2j2pF-3wonA:
undetectable		 2j2pE-3wonA:
14.86
2j2pF-3wonA:
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.
4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Lactobacillus
acidophilus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ASP A 316
ARG A 401
ASP A 402
ASP A  59
 GOL  A1548 (-3.5A)
GOL  A1542 ( 3.1A)
None
GOL  A1542 (-2.1A)
 1.27A 2j2pE-4aieA:
undetectable
2j2pF-4aieA:
undetectable		 2j2pE-4aieA:
16.39
2j2pF-4aieA:
16.39
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.
4c51 CATALASE-PEROXIDASE

(Mycobacterium
tuberculosis) 		PF00141
(peroxidase) 		4 ASP A 117
ARG A 119
ASP A 194
ASP A 612
 None
 1.05A 2j2pE-4c51A:
undetectable
2j2pF-4c51A:
undetectable		 2j2pE-4c51A:
15.72
2j2pF-4c51A:
15.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d65 PORIN 2

(Providencia
stuartii) 		PF00267
(Porin_1) 		4 ARG A 134
ASP A  90
THR A 132
ASP A 100
 None
 0.76A 2j2pE-4d65A:
undetectable
2j2pF-4d65A:
undetectable		 2j2pE-4d65A:
19.60
2j2pF-4d65A:
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.
4edq MALTOSE-BINDING
PERIPLASMIC
PROTEIN,MYOSIN-BINDI
NG PROTEIN C,
CARDIAC-TYPE
CHIMERIC PROTEIN

(Escherichia
coli;
Mus musculus) 		PF07679
(I-set)
PF13416
(SBP_bac_8) 		4 ASP A 198
THR A 194
LYS A 201
ASP A 359
 None
 1.25A 2j2pE-4edqA:
undetectable
2j2pF-4edqA:
undetectable		 2j2pE-4edqA:
16.90
2j2pF-4edqA:
16.90
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.
4g6c BETA-HEXOSAMINIDASE
1

(Burkholderia
cenocepacia) 		PF00933
(Glyco_hydro_3) 		4 ARG A  54
ASP A  51
THR A  50
ASP A 120
 None
 1.05A 2j2pE-4g6cA:
undetectable
2j2pF-4g6cA:
undetectable		 2j2pE-4g6cA:
21.51
2j2pF-4g6cA:
21.51
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		4 ASP A 381
ASP A 421
THR A 424
ASP A 397
 AMP  A 602 (-3.1A)
None
AMP  A 602 ( 4.4A)
AMP  A 602 (-3.1A)
 1.17A 2j2pE-4gvlA:
undetectable
2j2pF-4gvlA:
undetectable		 2j2pE-4gvlA:
20.55
2j2pF-4gvlA:
20.55
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.
4h0m C-PHYCOCYANIN ALPHA
CHAIN
C-PHYCOCYANIN BETA
CHAIN

(Synechococcus
elongatus) 		PF00502
(Phycobilisome) 		4 ASP A  13
ARG B 108
ASP B 107
THR B   1
 None
 1.29A 2j2pE-4h0mA:
undetectable
2j2pF-4h0mA:
undetectable		 2j2pE-4h0mA:
21.97
2j2pF-4h0mA:
21.97
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.
4i9f GLYCEROL 3-PHOSPHATE
PHOSPHATASE

(Mycobacterium
tuberculosis) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		4 ASP A 212
ARG A 210
ASP A 209
ASP A 153
 None
None
CA  A 401 (-2.7A)
None
 1.28A 2j2pE-4i9fA:
undetectable
2j2pF-4i9fA:
undetectable		 2j2pE-4i9fA:
18.73
2j2pF-4i9fA:
18.73
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.
4ifp MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NACHT, LRR
AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Escherichia
coli;
Homo sapiens) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		4 ASP A 198
THR A 194
LYS A 201
ASP A 359
 None
 1.21A 2j2pE-4ifpA:
undetectable
2j2pF-4ifpA:
undetectable		 2j2pE-4ifpA:
20.06
2j2pF-4ifpA:
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.
4kf7 NUP188

(Thermothelomyces
thermophila) 		PF10487
(Nup188) 		4 ASP A 857
ARG A 862
THR A 809
ASP A 803
 None
 1.27A 2j2pE-4kf7A:
undetectable
2j2pF-4kf7A:
undetectable		 2j2pE-4kf7A:
11.65
2j2pF-4kf7A:
11.65
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.
4kv3 CHIMERA FUSION
PROTEIN OF ESX-1
SECRETION SYSTEM
PROTEIN ECCD1 AND
MALTOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli;
Mycobacterium
tuberculosis) 		PF08817
(YukD)
PF13416
(SBP_bac_8) 		4 ASP A 198
THR A 194
LYS A 201
ASP A 359
 None
 1.27A 2j2pE-4kv3A:
undetectable
2j2pF-4kv3A:
undetectable		 2j2pE-4kv3A:
17.77
2j2pF-4kv3A:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4le5 S-ADENOSYLMETHIONINE
SYNTHETASE

(Campylobacter
jejuni) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 ASP A 371
ARG A 375
ASP A 152
ASP A 382
 None
 1.18A 2j2pE-4le5A:
undetectable
2j2pF-4le5A:
undetectable		 2j2pE-4le5A:
18.62
2j2pF-4le5A:
18.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4leu PENTATRICOPEPTIDE
REPEAT-CONTAINING
PROTEIN AT3G46870

(Arabidopsis
thaliana) 		PF13041
(PPR_2) 		4 ASP A 142
ASP A 177
THR A 180
ASP A 148
 None
 1.04A 2j2pE-4leuA:
undetectable
2j2pF-4leuA:
undetectable		 2j2pE-4leuA:
22.18
2j2pF-4leuA:
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.
4lhb MOLYBDOPTERIN
ADENYLYLTRANSFERASE

(Pyrococcus
furiosus) 		PF00994
(MoCF_biosynth) 		4 ASP A  23
ARG A  87
ASP A  88
THR A  85
 None
None
SO4  A 201 (-3.7A)
None
 1.14A 2j2pE-4lhbA:
undetectable
2j2pF-4lhbA:
undetectable		 2j2pE-4lhbA:
17.99
2j2pF-4lhbA:
17.99
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.
4m8u OLIGO-1,6-GLUCOSIDAS
E 1

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ASP A 332
ARG A 418
ASP A 419
ASP A  59
 GOL  A 602 (-2.8A)
TRS  A 601 ( 3.3A)
None
TRS  A 601 (-2.8A)
 1.25A 2j2pE-4m8uA:
undetectable
2j2pF-4m8uA:
undetectable		 2j2pE-4m8uA:
16.61
2j2pF-4m8uA:
16.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofw PROTEIN DJ-1 HOMOLOG
D

(Arabidopsis
thaliana) 		PF01965
(DJ-1_PfpI) 		4 ASP A  78
ASP A  83
THR A   6
LYS A 114
 None
 1.09A 2j2pE-4ofwA:
undetectable
2j2pF-4ofwA:
undetectable		 2j2pE-4ofwA:
19.59
2j2pF-4ofwA:
19.59
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.
4qhb UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF09112
(N-glycanase_N)
PF09113
(N-glycanase_C) 		4 ARG A 239
ASP A 195
THR A 194
ASP A  83
 None
 1.05A 2j2pE-4qhbA:
undetectable
2j2pF-4qhbA:
undetectable		 2j2pE-4qhbA:
21.01
2j2pF-4qhbA:
21.01
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 5 ASP G 129
ARG G 132
ASP G 133
THR G 136
LYS G 221
 None
SO4  G 305 (-4.8A)
SO4  G 305 (-3.3A)
SO4  G 305 (-3.5A)
SO4  G 305 (-2.6A)
 0.25A 2j2pE-4r9jG:
41.1
2j2pF-4r9jG:
40.0		 2j2pE-4r9jG:
99.08
2j2pF-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.
4rwf MALTOSE TRANSPORTER
SUBUNIT, RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 2,
CALCITONIN
GENE-RELATED PEPTIDE
TYPE 1 RECEPTOR
FUSION PROTEIN

(Escherichia
coli;
Homo sapiens) 		PF02793
(HRM)
PF04901
(RAMP)
PF13416
(SBP_bac_8) 		4 ASP A 199
THR A 195
LYS A 202
ASP A 360
 None
 1.19A 2j2pE-4rwfA:
undetectable
2j2pF-4rwfA:
undetectable		 2j2pE-4rwfA:
16.02
2j2pF-4rwfA:
16.02
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		4 ASP A 198
ASP A 217
THR A 215
ASP A 264
 None
 1.10A 2j2pE-4sliA:
undetectable
2j2pF-4sliA:
undetectable		 2j2pE-4sliA:
15.27
2j2pF-4sliA:
15.27
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.
4wrn MALTOSE-BINDING
PERIPLASMIC
PROTEIN,UROMODULIN

(Escherichia
coli;
Homo sapiens) 		PF00100
(Zona_pellucida)
PF13416
(SBP_bac_8) 		4 ASP A 221
THR A 217
LYS A 224
ASP A 382
 None
 1.27A 2j2pE-4wrnA:
undetectable
2j2pF-4wrnA:
undetectable		 2j2pE-4wrnA:
15.21
2j2pF-4wrnA:
15.21
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.
4xaj MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NUCLEAR
RECEPTOR SUBFAMILY 2
GROUP E MEMBER 1

(Escherichia
coli;
Homo sapiens) 		PF00104
(Hormone_recep)
PF13416
(SBP_bac_8) 		4 ASP A 199
THR A 195
LYS A 202
ASP A 360
 None
 1.24A 2j2pE-4xajA:
undetectable
2j2pF-4xajA:
undetectable		 2j2pE-4xajA:
16.64
2j2pF-4xajA:
16.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ASP A 313
ARG A 398
ASP A 399
ASP A  60
 None
 1.23A 2j2pE-4xb3A:
undetectable
2j2pF-4xb3A:
undetectable		 2j2pE-4xb3A:
16.47
2j2pF-4xb3A:
16.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aor DOSAGE COMPENSATION
REGULATOR

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		4 ARG A 457
ASP A 463
THR A 464
ASP A 423
 None
 1.02A 2j2pE-5aorA:
undetectable
2j2pF-5aorA:
undetectable		 2j2pE-5aorA:
10.27
2j2pF-5aorA:
10.27
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.
5aza MALTOSE-BINDING
PERIPLASMIC
PROTEIN,OLIGOSACCHAR
YL TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Escherichia
coli;
Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		4 ASP A 197
THR A 193
LYS A 200
ASP A 358
 None
 1.26A 2j2pE-5azaA:
undetectable
2j2pF-5azaA:
undetectable		 2j2pE-5azaA:
13.96
2j2pF-5azaA:
13.96
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.
5dfm MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TELOMERASE-A
SSOCIATED PROTEIN 19

(Escherichia
coli;
Tetrahymena
thermophila) 		PF13416
(SBP_bac_8) 		4 ASP A 197
THR A 193
LYS A 200
ASP A 358
 None
 1.28A 2j2pE-5dfmA:
undetectable
2j2pF-5dfmA:
undetectable		 2j2pE-5dfmA:
17.89
2j2pF-5dfmA:
17.89
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.
5ey0 GTP-SENSING
TRANSCRIPTIONAL
PLEIOTROPIC
REPRESSOR CODY

(Staphylococcus
aureus) 		no annotation 4 ASP B 133
ARG B 130
THR B  37
ASP B 139
 None
 1.08A 2j2pE-5ey0B:
undetectable
2j2pF-5ey0B:
undetectable		 2j2pE-5ey0B:
20.67
2j2pF-5ey0B:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f4j PROTRUDING DOMAIN OF
GII.17 NOROVIRUS
CAPSID

(Norwalk virus) 		PF08435
(Calici_coat_C) 		4 ASP A 471
ARG A 493
ASP A 269
THR A 267
 None
 1.26A 2j2pE-5f4jA:
undetectable
2j2pF-5f4jA:
undetectable		 2j2pE-5f4jA:
18.35
2j2pF-5f4jA:
18.35
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.
5fok IRON TRANSPORT OUTER
MEMBRANE RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 ASP A  70
ARG A  73
THR A 645
ASP A 667
 None
 1.18A 2j2pE-5fokA:
undetectable
2j2pF-5fokA:
undetectable		 2j2pE-5fokA:
16.71
2j2pF-5fokA:
16.71
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.
5fvn OMPC PORIN

(Enterobacter
cloacae) 		PF00267
(Porin_1) 		4 ARG A 132
ASP A  89
THR A 130
ASP A  99
 None
 0.96A 2j2pE-5fvnA:
undetectable
2j2pF-5fvnA:
undetectable		 2j2pE-5fvnA:
21.84
2j2pF-5fvnA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h3h ABHYDROLASE
DOMAIN-CONTAINING
PROTEIN

(Exiguobacterium
antarcticum) 		PF00561
(Abhydrolase_1)
PF08386
(Abhydrolase_4) 		4 ARG A  57
ASP A  70
THR A  73
ASP A   9
 None
 0.85A 2j2pE-5h3hA:
undetectable
2j2pF-5h3hA:
undetectable		 2j2pE-5h3hA:
21.48
2j2pF-5h3hA:
21.48
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.
5hzv MALTOSE-BINDING
PERIPLASMIC
PROTEIN,ENDOGLIN

(Escherichia
coli;
Homo sapiens) 		PF00100
(Zona_pellucida)
PF13416
(SBP_bac_8) 		4 ASP A 564
THR A 560
LYS A 567
ASP A 725
 None
 1.23A 2j2pE-5hzvA:
undetectable
2j2pF-5hzvA:
undetectable		 2j2pE-5hzvA:
15.88
2j2pF-5hzvA:
15.88
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.
5hzw MALTOSE-BINDING
PERIPLASMIC
PROTEIN,ENDOGLIN

(Escherichia
coli;
Homo sapiens) 		PF13416
(SBP_bac_8) 		4 ASP A 252
THR A 248
LYS A 255
ASP A 413
 None
 1.26A 2j2pE-5hzwA:
undetectable
2j2pF-5hzwA:
undetectable		 2j2pE-5hzwA:
15.31
2j2pF-5hzwA:
15.31
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.
5i61 POTENTIAL
RNA-DEPENDENT RNA
POLYMERASE

(Human
picobirnavirus) 		no annotation 4 ARG B 408
ASP B 406
THR B 405
ASP B 249
 None
 0.96A 2j2pE-5i61B:
undetectable
2j2pF-5i61B:
undetectable		 2j2pE-5i61B:
17.13
2j2pF-5i61B:
17.13
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.
5jj4 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,SINGLE-STRAN
DED DNA CYTOSINE
DEAMINASE

(Escherichia
coli;
Homo sapiens) 		no annotation 4 ASP C 197
THR C 193
LYS C 200
ASP C 358
 None
 1.20A 2j2pE-5jj4C:
undetectable
2j2pF-5jj4C:
undetectable		 2j2pE-5jj4C:
17.76
2j2pF-5jj4C:
17.76
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.
5k94 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PROTEIN
TRANSLOCASE SUBUNIT
SECA,MALTOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF01547
(SBP_bac_1)
PF13416
(SBP_bac_8) 		4 ASP A1197
THR A1193
LYS A1200
ASP A1358
 None
 1.28A 2j2pE-5k94A:
undetectable
2j2pF-5k94A:
undetectable		 2j2pE-5k94A:
18.39
2j2pF-5k94A:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lug SPINDLIN-LIKE
PROTEIN 2, ISOFORM
CRA_A

(Homo sapiens) 		PF02513
(Spin-Ssty) 		4 ASP A 112
ARG A  53
THR A  71
ASP A  88
 None
 1.17A 2j2pE-5lugA:
undetectable
2j2pF-5lugA:
undetectable		 2j2pE-5lugA:
18.33
2j2pF-5lugA:
18.33
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.
5nxn PORIN 1

(Providencia
stuartii) 		no annotation 4 ARG A 137
ASP A  93
THR A 135
ASP A 103
 None
 0.93A 2j2pE-5nxnA:
undetectable
2j2pF-5nxnA:
undetectable		 2j2pE-5nxnA:
17.43
2j2pF-5nxnA:
17.43
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.
5o77 OMPK35

(Klebsiella
pneumoniae) 		no annotation 4 ARG A 134
ASP A  90
THR A 132
ASP A 100
 None
 0.97A 2j2pE-5o77A:
undetectable
2j2pF-5o77A:
undetectable		 2j2pE-5o77A:
18.37
2j2pF-5o77A:
18.37
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.
5o9c OSMOPORIN OMP36

(Klebsiella
aerogenes) 		no annotation 4 ARG C 133
ASP C  90
THR C 131
ASP C 100
 None
 0.93A 2j2pE-5o9cC:
undetectable
2j2pF-5o9cC:
undetectable		 2j2pE-5o9cC:
19.49
2j2pF-5o9cC:
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.
5v6y MALTOSE-BINDING
PERIPLASMIC
PROTEIN,RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 1,CALCITONIN
GENE-RELATED PEPTIDE
TYPE 1 RECEPTOR

(Escherichia
coli;
Homo sapiens) 		no annotation 4 ASP A 199
THR A 195
LYS A 202
ASP A 360
 None
 1.16A 2j2pE-5v6yA:
undetectable
2j2pF-5v6yA:
undetectable		 2j2pE-5v6yA:
17.92
2j2pF-5v6yA:
17.92
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.
5vyd PHOSPHODIESTERASE

(Salpingoeca
rosetta) 		no annotation 4 ASP A  39
ARG A  74
THR A  75
LYS A  79
 None
 1.27A 2j2pE-5vydA:
undetectable
2j2pF-5vydA:
undetectable		 2j2pE-5vydA:
20.75
2j2pF-5vydA:
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.
5whs CATALASE-PEROXIDASE

(Neurospora
crassa) 		no annotation 4 ASP A 100
ARG A 102
ASP A 177
ASP A 613
 None
 1.07A 2j2pE-5whsA:
undetectable
2j2pF-5whsA:
undetectable		 2j2pE-5whsA:
23.18
2j2pF-5whsA:
23.18
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 4 ASP A1055
ARG A1355
ASP A1353
ASP A1061
 None
 1.24A 2j2pE-5wlhA:
undetectable
2j2pF-5wlhA:
undetectable		 2j2pE-5wlhA:
10.38
2j2pF-5wlhA:
10.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wzr ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Bifidobacterium
bifidum) 		PF11308
(Glyco_hydro_129) 		4 ARG A 578
ASP A 575
THR A 572
ASP A 537
 None
 0.82A 2j2pE-5wzrA:
undetectable
2j2pF-5wzrA:
undetectable		 2j2pE-5wzrA:
14.15
2j2pF-5wzrA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x7h CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE

(Paenibacillus
sp. 598K) 		PF13199
(Glyco_hydro_66)
PF16990
(CBM_35) 		4 ASP A 376
ARG A 351
ASP A 304
ASP A 142
 None
 1.06A 2j2pE-5x7hA:
undetectable
2j2pF-5x7hA:
undetectable		 2j2pE-5x7hA:
15.35
2j2pF-5x7hA:
15.35
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.
5yf0 -

(-) 		no annotation 4 ASP A 168
ARG A 177
ASP A 178
ASP A 277
 SAM  A 505 ( 4.3A)
None
None
None
 1.11A 2j2pE-5yf0A:
undetectable
2j2pF-5yf0A:
undetectable		 2j2pE-5yf0A:
undetectable
2j2pF-5yf0A:
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.
6bq1 PHOSPHATIDYLINOSITOL
4-KINASE III ALPHA
(PI4KA)

(Homo sapiens) 		no annotation 4 ARG A1662
ASP A2043
THR A2044
ASP A1705
 None
 1.24A 2j2pE-6bq1A:
undetectable
2j2pF-6bq1A:
undetectable		 2j2pE-6bq1A:
0.00
2j2pF-6bq1A:
0.00
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.
6cn7 AEROBACTIN SYNTHASE
IUCC

(Klebsiella
pneumoniae) 		no annotation 4 ARG A 352
ASP A 271
THR A 260
ASP A 442
 None
 1.15A 2j2pE-6cn7A:
undetectable
2j2pF-6cn7A:
undetectable		 2j2pE-6cn7A:
16.67
2j2pF-6cn7A:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d7t TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 6

(Homo sapiens) 		no annotation 4 ASP A 227
ARG A 190
ASP A 188
ASP A 223
 None
 1.23A 2j2pE-6d7tA:
undetectable
2j2pF-6d7tA:
undetectable		 2j2pE-6d7tA:
undetectable
2j2pF-6d7tA:
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.
6er3 BNR/ASP-BOX REPEAT
PROTEIN

([Ruminococcus]
gnavus) 		no annotation 4 ASP A 121
ASP A 140
THR A 138
ASP A 187
 None
 1.23A 2j2pE-6er3A:
undetectable
2j2pF-6er3A:
undetectable		 2j2pE-6er3A:
16.13
2j2pF-6er3A:
16.13