SIMILAR PATTERNS OF AMINO ACIDS FOR 3KO0_J_TFPJ201

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.
1att ANTITHROMBIN III

(Bos taurus) 		PF00079
(Serpin) 		4 PHE A 107
PHE A 109
GLY A 340
PHE A 124
 None
 1.04A 3ko0B-1attA:
0.3
3ko0J-1attA:
0.3		 3ko0B-1attA:
11.81
3ko0J-1attA:
11.81
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.
1b8g PROTEIN
(1-AMINOCYCLOPROPANE
-1-CARBOXYLATE
SYNTHASE)

(Malus domestica) 		PF00155
(Aminotran_1_2) 		4 GLY A 404
MET A  43
CYH A 409
PHE A 410
 None
 1.11A 3ko0B-1b8gA:
0.0
3ko0J-1b8gA:
0.0		 3ko0B-1b8gA:
13.21
3ko0J-1b8gA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1brl BACTERIAL LUCIFERASE

(Vibrio harveyi) 		PF00296
(Bac_luciferase) 		4 PHE A 327
CYH A 324
PHE A   3
PHE A  36
 None
 1.10A 3ko0B-1brlA:
undetectable
3ko0J-1brlA:
undetectable		 3ko0B-1brlA:
15.34
3ko0J-1brlA:
15.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d1p TYROSINE PHOSPHATASE

(Saccharomyces
cerevisiae) 		PF01451
(LMWPc) 		4 GLY A 136
CYH A  13
MET A  93
PHE A 151
 None
EPE  A 201 (-3.3A)
None
None
 0.84A 3ko0B-1d1pA:
undetectable
3ko0J-1d1pA:
undetectable		 3ko0B-1d1pA:
23.36
3ko0J-1d1pA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dgj ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
desulfuricans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY A 191
CYH A  45
CYH A 137
PHE A 423
 None
FES  A 909 (-2.3A)
FES  A 908 (-2.3A)
MCN  A 914 (-3.6A)
 1.05A 3ko0B-1dgjA:
0.9
3ko0J-1dgjA:
0.5		 3ko0B-1dgjA:
7.44
3ko0J-1dgjA:
7.44
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.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE
CUTS, IRON-SULFUR
PROTEIN OF CARBON
MONOXIDE
DEHYDROGENASE

(Hydrogenophaga
pseudoflava) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY B  33
CYH A  47
CYH A 136
PHE B 268
 None
FES  A1908 (-2.2A)
FES  A1907 (-2.3A)
PCD  B1920 (-3.6A)
 1.00A 3ko0B-1ffvB:
0.4
3ko0J-1ffvB:
0.0		 3ko0B-1ffvB:
8.53
3ko0J-1ffvB:
8.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gan GALECTIN-1

(Rhinella
arenarum) 		PF00337
(Gal-bind_lectin) 		4 PHE A 101
GLY A  22
CYH A  17
PHE A 107
 None
 1.07A 3ko0B-1ganA:
undetectable
3ko0J-1ganA:
undetectable		 3ko0B-1ganA:
17.91
3ko0J-1ganA:
17.91
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.
1h7v RUBREDOXIN

(Guillardia
theta) 		PF00301
(Rubredoxin) 		4 PHE A  41
PHE A  34
GLY A  27
CYH A  10
 None
None
None
ZN  A  61 (-2.3A)
 1.11A 3ko0B-1h7vA:
undetectable
3ko0J-1h7vA:
undetectable		 3ko0B-1h7vA:
21.78
3ko0J-1h7vA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1js8 HEMOCYANIN

(Enteroctopus
dofleini) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 PHE A2647
GLY A2825
PHE A2636
PHE A2600
 None
 1.03A 3ko0B-1js8A:
undetectable
3ko0J-1js8A:
undetectable		 3ko0B-1js8A:
13.47
3ko0J-1js8A:
13.47
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.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi) 		PF00365
(PFK) 		4 GLY A 313
CYH A 329
PHE A 332
PHE A 351
 None
 1.09A 3ko0B-1kzhA:
1.6
3ko0J-1kzhA:
1.6		 3ko0B-1kzhA:
10.99
3ko0J-1kzhA:
10.99
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN
CARBON MONOXIDE
DEHYDROGENASE SMALL
CHAIN

(Oligotropha
carboxidovorans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY B  36
CYH A  47
CYH A 137
PHE B 271
 None
FES  A4908 (-2.2A)
FES  A4907 (-2.3A)
MCN  B4920 ( 3.5A)
 0.99A 3ko0B-1n60B:
0.4
3ko0J-1n60B:
0.0		 3ko0B-1n60B:
8.91
3ko0J-1n60B:
8.91
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 GLY A 970
CYH A 871
PHE A 870
PHE A1174
 None
 0.97A 3ko0B-1ofeA:
0.0
3ko0J-1ofeA:
0.0		 3ko0B-1ofeA:
6.25
3ko0J-1ofeA:
6.25
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.
1psu PHENYLACETIC ACID
DEGRADATION PROTEIN
PAAI

(Escherichia
coli) 		PF03061
(4HBT) 		4 PHE A  84
GLY A  47
PHE A  57
PHE A 125
 None
 1.03A 3ko0B-1psuA:
undetectable
3ko0J-1psuA:
undetectable		 3ko0B-1psuA:
21.62
3ko0J-1psuA:
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.
1qnr ENDO-1,4-B-D-MANNANA
SE

(Trichoderma
reesei) 		PF00150
(Cellulase) 		4 PHE A 240
PHE A 226
GLY A 254
PHE A 237
 None
 0.71A 3ko0B-1qnrA:
undetectable
3ko0J-1qnrA:
undetectable		 3ko0B-1qnrA:
13.95
3ko0J-1qnrA:
13.95
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.
1qwj CYTIDINE
MONOPHOSPHO-N-ACETYL
NEURAMINIC ACID
SYNTHETASE

(Mus musculus) 		PF02348
(CTP_transf_3) 		4 PHE A  83
GLY A 103
PHE A 215
PHE A 217
 None
 1.00A 3ko0B-1qwjA:
undetectable
3ko0J-1qwjA:
undetectable		 3ko0B-1qwjA:
15.95
3ko0J-1qwjA:
15.95
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.
1rw9 CHONDROITIN AC LYASE

(Paenarthrobacter
aurescens) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		4 PHE A 660
GLY A 389
MET A 627
CYH A 513
 None
 0.96A 3ko0B-1rw9A:
undetectable
3ko0J-1rw9A:
undetectable		 3ko0B-1rw9A:
8.45
3ko0J-1rw9A:
8.45
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.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT
4-HYDROXYBENZOYL-COA
REDUCTASE GAMMA
SUBUNIT

(Thauera
aromatica) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY A  26
CYH C  46
CYH C 135
PHE A 245
 None
FES  C1908 (-2.2A)
FES  C1907 (-2.3A)
PCD  A1920 (-3.4A)
 1.09A 3ko0B-1sb3A:
undetectable
3ko0J-1sb3A:
undetectable		 3ko0B-1sb3A:
7.84
3ko0J-1sb3A:
7.84
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
LARGE SUBUNIT
QUINOLINE
2-OXIDOREDUCTASE
SMALL SUBUNIT

(Pseudomonas
putida) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY B  29
CYH A  53
CYH A 142
PHE B 255
 None
FES  A4908 (-2.3A)
FES  A4907 (-2.4A)
MCN  B4921 ( 3.8A)
 1.06A 3ko0B-1t3qB:
0.9
3ko0J-1t3qB:
0.4		 3ko0B-1t3qB:
7.50
3ko0J-1t3qB:
7.50
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.
1t84 WISKOTT-ALDRICH
SYNDROME PROTEIN

(Homo sapiens) 		PF00786
(PBD) 		4 PHE A  52
PHE A  30
GLY A  80
PHE A  17
 None
None
None
WSK  A 108 (-3.7A)
 1.06A 3ko0B-1t84A:
undetectable
3ko0J-1t84A:
undetectable		 3ko0B-1t84A:
23.01
3ko0J-1t84A:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u2v ARP2/3 COMPLEX 20KDA
SUBUNIT
ARP2/3 COMPLEX 34KDA
SUBUNIT

(Bos taurus) 		PF04045
(P34-Arc)
PF05856
(ARPC4) 		4 PHE D 247
PHE F 164
GLY D 178
PHE F 168
 None
 1.08A 3ko0B-1u2vD:
undetectable
3ko0J-1u2vD:
0.8		 3ko0B-1u2vD:
16.55
3ko0J-1u2vD:
16.55
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.
1up4 6-PHOSPHO-BETA-GLUCO
SIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 GLY A 108
CYH A 162
PHE A  77
PHE A 158
 None
 1.05A 3ko0B-1up4A:
undetectable
3ko0J-1up4A:
undetectable		 3ko0B-1up4A:
14.17
3ko0J-1up4A:
14.17
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.
1usy ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT

(Thermotoga
maritima) 		PF13393
(tRNA-synt_His) 		4 PHE C  12
PHE C 120
GLY C 266
PHE C  10
 None
 0.93A 3ko0B-1usyC:
undetectable
3ko0J-1usyC:
undetectable		 3ko0B-1usyC:
16.79
3ko0J-1usyC:
16.79
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.
1v5s MAP/MICROTUBULE
AFFINITY-REGULATING
KINASE 3

(Mus musculus) 		PF02149
(KA1) 		4 PHE A  97
PHE A 107
CYH A  55
CYH A  67
 None
 0.73A 3ko0B-1v5sA:
undetectable
3ko0J-1v5sA:
undetectable		 3ko0B-1v5sA:
23.26
3ko0J-1v5sA:
23.26
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.
1v5s MAP/MICROTUBULE
AFFINITY-REGULATING
KINASE 3

(Mus musculus) 		PF02149
(KA1) 		4 PHE A  97
PHE A 107
GLY A 122
CYH A  67
 None
 0.82A 3ko0B-1v5sA:
undetectable
3ko0J-1v5sA:
undetectable		 3ko0B-1v5sA:
23.26
3ko0J-1v5sA:
23.26
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 PHE A  82
GLY A  89
PHE A  95
PHE A 120
 None
 1.07A 3ko0B-1xc6A:
undetectable
3ko0J-1xc6A:
undetectable		 3ko0B-1xc6A:
6.85
3ko0J-1xc6A:
6.85
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.
2b4x ANTITHROMBIN-III

(Homo sapiens) 		PF00079
(Serpin) 		4 PHE I 106
PHE I 108
GLY I 339
PHE I 123
 None
 0.80A 3ko0B-2b4xI:
undetectable
3ko0J-2b4xI:
undetectable		 3ko0B-2b4xI:
15.12
3ko0J-2b4xI:
15.12
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.
2c2n MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Homo sapiens) 		PF00698
(Acyl_transf_1) 		4 PHE A 211
GLY A 183
PHE A 170
PHE A 219
 None
 0.89A 3ko0B-2c2nA:
undetectable
3ko0J-2c2nA:
0.3		 3ko0B-2c2nA:
13.91
3ko0J-2c2nA:
13.91
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.
2eng ENDOGLUCANASE V

(Humicola
insolens) 		PF02015
(Glyco_hydro_45) 		4 PHE A 174
GLY A 149
PHE A 182
PHE A  94
 None
 1.10A 3ko0B-2engA:
undetectable
3ko0J-2engA:
undetectable		 3ko0B-2engA:
18.57
3ko0J-2engA:
18.57
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.
2gmi UBIQUITIN-CONJUGATIN
G ENZYME VARIANT
MMS2

(Saccharomyces
cerevisiae) 		PF00179
(UQ_con) 		4 PHE B  77
PHE B 137
GLY B  43
CYH B  85
 None
 1.00A 3ko0B-2gmiB:
undetectable
3ko0J-2gmiB:
1.0		 3ko0B-2gmiB:
20.15
3ko0J-2gmiB:
20.15
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.
2hdx SH2-B PH DOMAIN
CONTAINING SIGNALING
MEDIATOR 1 GAMMA
ISOFORM

(Mus musculus) 		PF00017
(SH2) 		4 PHE A 552
GLY A 530
CYH A 587
MET A 600
 None
 0.97A 3ko0B-2hdxA:
undetectable
3ko0J-2hdxA:
undetectable		 3ko0B-2hdxA:
21.57
3ko0J-2hdxA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jok PUTATIVE
G-NUCLEOTIDE
EXCHANGE FACTOR

(Burkholderia
pseudomallei) 		PF07487
(SopE_GEF) 		4 GLY A 171
MET A 132
CYH A 131
PHE A 130
 None
 1.08A 3ko0B-2jokA:
undetectable
3ko0J-2jokA:
undetectable		 3ko0B-2jokA:
17.20
3ko0J-2jokA:
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.
2jok PUTATIVE
G-NUCLEOTIDE
EXCHANGE FACTOR

(Burkholderia
pseudomallei) 		PF07487
(SopE_GEF) 		4 GLY A 173
MET A 132
CYH A 131
PHE A 130
 None
 1.10A 3ko0B-2jokA:
undetectable
3ko0J-2jokA:
undetectable		 3ko0B-2jokA:
17.20
3ko0J-2jokA:
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.
2lf2 UNCHARACTERIZED
PROTEIN

(Cytophaga
hutchinsonii) 		PF08327
(AHSA1) 		4 PHE A  92
GLY A  62
PHE A  35
PHE A 118
 None
 0.98A 3ko0B-2lf2A:
undetectable
3ko0J-2lf2A:
undetectable		 3ko0B-2lf2A:
22.49
3ko0J-2lf2A:
22.49
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.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		4 PHE A 117
GLY A  86
PHE A 100
PHE A  72
 None
 1.10A 3ko0B-2qy6A:
undetectable
3ko0J-2qy6A:
undetectable		 3ko0B-2qy6A:
18.18
3ko0J-2qy6A:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rc5 FERREDOXIN-NADP
REDUCTASE

(Leptospira
interrogans) 		PF00175
(NAD_binding_1) 		4 GLY A 176
CYH A 134
MET A 138
CYH A 139
 None
FAD  A 415 (-4.9A)
None
None
 0.79A 3ko0B-2rc5A:
undetectable
3ko0J-2rc5A:
undetectable		 3ko0B-2rc5A:
16.09
3ko0J-2rc5A:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rc5 FERREDOXIN-NADP
REDUCTASE

(Leptospira
interrogans) 		PF00175
(NAD_binding_1) 		4 GLY A 273
CYH A 134
MET A 138
CYH A 139
 None
FAD  A 415 (-4.9A)
None
None
 0.87A 3ko0B-2rc5A:
undetectable
3ko0J-2rc5A:
undetectable		 3ko0B-2rc5A:
16.09
3ko0J-2rc5A:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xr1 CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
100 KD SUBUNIT

(Methanosarcina
mazei) 		PF07521
(RMMBL)
PF07650
(KH_2)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		4 PHE A 197
PHE A 349
GLY A 211
PHE A 601
 None
 1.06A 3ko0B-2xr1A:
undetectable
3ko0J-2xr1A:
undetectable		 3ko0B-2xr1A:
9.52
3ko0J-2xr1A:
9.52
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.
2yfu CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		no annotation 4 PHE A  27
GLY A  14
PHE A  77
PHE A 134
 GOL  A1143 (-4.6A)
None
None
None
 1.07A 3ko0B-2yfuA:
undetectable
3ko0J-2yfuA:
undetectable		 3ko0B-2yfuA:
24.10
3ko0J-2yfuA:
24.10
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.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Thermotoga
maritima) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		4 PHE A 208
PHE A 309
GLY A  95
PHE A 293
 None
 1.11A 3ko0B-3a14A:
undetectable
3ko0J-3a14A:
undetectable		 3ko0B-3a14A:
14.79
3ko0J-3a14A:
14.79
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		4 PHE A 118
GLY A 100
PHE A  74
PHE A 777
 None
 1.09A 3ko0B-3abzA:
undetectable
3ko0J-3abzA:
undetectable		 3ko0B-3abzA:
9.16
3ko0J-3abzA:
9.16
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.
3cea MYO-INOSITOL
2-DEHYDROGENASE

(Lactobacillus
plantarum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 PHE A 172
PHE A 169
GLY A  16
MET A 185
 NAD  A 400 (-4.4A)
None
NAD  A 400 (-3.3A)
None
 0.90A 3ko0B-3ceaA:
undetectable
3ko0J-3ceaA:
undetectable		 3ko0B-3ceaA:
15.03
3ko0J-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dmc NTF2-LIKE PROTEIN

(Trichormus
variabilis) 		PF12680
(SnoaL_2) 		4 PHE A  40
GLY A 116
PHE A  20
PHE A  63
 None
 1.11A 3ko0B-3dmcA:
undetectable
3ko0J-3dmcA:
undetectable		 3ko0B-3dmcA:
23.19
3ko0J-3dmcA:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e02 UNCHARACTERIZED
PROTEIN DUF849

(Paraburkholderia
xenovorans) 		PF05853
(BKACE) 		4 PHE A 151
PHE A 184
CYH A 172
MET A 113
 None
 1.07A 3ko0B-3e02A:
undetectable
3ko0J-3e02A:
undetectable		 3ko0B-3e02A:
15.89
3ko0J-3e02A:
15.89
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.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY A 191
CYH A  45
CYH A 137
PHE A 421
 None
FES  A 909 (-2.3A)
FES  A 908 (-2.3A)
PCD  A 921 (-3.4A)
 1.04A 3ko0B-3fahA:
1.0
3ko0J-3fahA:
undetectable		 3ko0B-3fahA:
7.39
3ko0J-3fahA:
7.39
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF10

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF16004
(EFTUD2) 		4 PHE B 602
GLY B 896
CYH B 653
PHE B 644
 None
 0.94A 3ko0B-3jb9B:
1.8
3ko0J-3jb9B:
undetectable		 3ko0B-3jb9B:
7.07
3ko0J-3jb9B:
7.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k17 LIN0012 PROTEIN

(Listeria
innocua) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 PHE A 217
PHE A 327
GLY A 220
PHE A 264
 None
 1.01A 3ko0B-3k17A:
undetectable
3ko0J-3k17A:
undetectable		 3ko0B-3k17A:
14.88
3ko0J-3k17A:
14.88
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.
3k28 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
2

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		4 GLY A 253
CYH A 144
MET A 213
PHE A 360
 None
 0.78A 3ko0B-3k28A:
undetectable
3ko0J-3k28A:
undetectable		 3ko0B-3k28A:
12.53
3ko0J-3k28A:
12.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lvv GLUTAMATE--CYSTEINE
LIGASE

(Saccharomyces
cerevisiae) 		PF03074
(GCS) 		4 PHE A 450
PHE A 410
GLY A 371
PHE A 437
 None
 1.04A 3ko0B-3lvvA:
undetectable
3ko0J-3lvvA:
undetectable		 3ko0B-3lvvA:
10.31
3ko0J-3lvvA:
10.31
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.
3lxz GLUTATHIONE
S-TRANSFERASE FAMILY
PROTEIN

(Pseudomonas
putida) 		PF13417
(GST_N_3)
PF14497
(GST_C_3) 		4 PHE A 133
PHE A 181
GLY A 169
PHE A 142
 None
 1.01A 3ko0B-3lxzA:
undetectable
3ko0J-3lxzA:
undetectable		 3ko0B-3lxzA:
19.65
3ko0J-3lxzA:
19.65
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.
3oaj PUTATIVE
RING-CLEAVING
DIOXYGENASE MHQO

(Bacillus
subtilis) 		PF00903
(Glyoxalase) 		4 PHE A  51
PHE A  64
GLY A 284
PHE A  25
 None
 1.09A 3ko0B-3oajA:
undetectable
3ko0J-3oajA:
undetectable		 3ko0B-3oajA:
15.87
3ko0J-3oajA:
15.87
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.
3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE

(Streptococcus
mutans) 		PF01180
(DHO_dh) 		4 PHE A 281
GLY A 248
CYH A  25
PHE A  42
 None
FMN  A 400 (-3.3A)
MLY  A  45 ( 3.2A)
None
 1.08A 3ko0B-3oixA:
undetectable
3ko0J-3oixA:
undetectable		 3ko0B-3oixA:
12.75
3ko0J-3oixA:
12.75
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.
3pvz UDP-N-ACETYLGLUCOSAM
INE 4,6-DEHYDRATASE

(Aliivibrio
fischeri) 		PF02719
(Polysacc_synt_2) 		4 GLY A 153
CYH A 159
CYH A 245
PHE A 247
 None
 1.03A 3ko0B-3pvzA:
undetectable
3ko0J-3pvzA:
undetectable		 3ko0B-3pvzA:
13.42
3ko0J-3pvzA:
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.
3t5v NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 PHE B  16
CYH B  65
PHE B  68
PHE B  90
 None
 0.84A 3ko0B-3t5vB:
undetectable
3ko0J-3t5vB:
undetectable		 3ko0B-3t5vB:
13.08
3ko0J-3t5vB:
13.08
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.
3tze TRYPTOPHANYL-TRNA
SYNTHETASE

(Encephalitozoon
cuniculi) 		PF00579
(tRNA-synt_1b) 		4 PHE A 169
GLY A 201
CYH A 210
PHE A 215
 None
 0.84A 3ko0B-3tzeA:
undetectable
3ko0J-3tzeA:
undetectable		 3ko0B-3tzeA:
13.90
3ko0J-3tzeA:
13.90
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.
3ujh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF00342
(PGI) 		4 PHE A 216
GLY A 157
CYH A 248
PHE A 247
 None
G6Q  A 571 ( 3.3A)
None
None
 0.92A 3ko0B-3ujhA:
2.0
3ko0J-3ujhA:
1.7		 3ko0B-3ujhA:
9.95
3ko0J-3ujhA:
9.95
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.
3va7 KLLA0E08119P

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 GLY A1621
CYH A1351
PHE A1331
PHE A1271
 None
 1.11A 3ko0B-3va7A:
undetectable
3ko0J-3va7A:
undetectable		 3ko0B-3va7A:
5.82
3ko0J-3va7A:
5.82
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.
3vgj TYROSYL-TRNA
SYNTHETASE, PUTATIVE

(Plasmodium
falciparum) 		PF00579
(tRNA-synt_1b) 		4 PHE A 120
GLY A  62
MET A 259
PHE A 353
 None
TYR  A 401 ( 3.3A)
None
None
 0.97A 3ko0B-3vgjA:
undetectable
3ko0J-3vgjA:
undetectable		 3ko0B-3vgjA:
15.55
3ko0J-3vgjA:
15.55
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.
3wfl BETA-MANNANASE

(Talaromyces
trachyspermus) 		PF00150
(Cellulase) 		4 PHE A 273
PHE A 259
GLY A 287
PHE A 270
 None
 0.71A 3ko0B-3wflA:
undetectable
3ko0J-3wflA:
undetectable		 3ko0B-3wflA:
13.24
3ko0J-3wflA:
13.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		4 PHE A 240
PHE A 226
GLY A 254
PHE A 237
 None
 0.74A 3ko0B-3zizA:
undetectable
3ko0J-3zizA:
undetectable		 3ko0B-3zizA:
11.52
3ko0J-3zizA:
11.52
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.
3zy3 PUTATIVE GDP-FUCOSE
PROTEIN
O-FUCOSYLTRANSFERASE
1

(Caenorhabditis
elegans) 		PF10250
(O-FucT) 		4 PHE A 118
PHE A 192
GLY A 156
PHE A  54
 None
 1.06A 3ko0B-3zy3A:
undetectable
3ko0J-3zy3A:
undetectable		 3ko0B-3zy3A:
16.10
3ko0J-3zy3A:
16.10
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.
4dw1 P2X PURINOCEPTOR

(Danio rerio) 		PF00864
(P2X_receptor) 		4 PHE A 322
PHE A 102
GLY A 253
PHE A 233
 None
 0.86A 3ko0B-4dw1A:
undetectable
3ko0J-4dw1A:
undetectable		 3ko0B-4dw1A:
13.78
3ko0J-4dw1A:
13.78
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.
4fch OUTER MEMBRANE
PROTEIN SUSE

(Bacteroides
thetaiotaomicron) 		PF16411
(SusF_SusE) 		4 PHE A 340
GLY A 289
PHE A 314
PHE A 379
 None
 0.96A 3ko0B-4fchA:
undetectable
3ko0J-4fchA:
undetectable		 3ko0B-4fchA:
15.07
3ko0J-4fchA:
15.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fe9 OUTER MEMBRANE
PROTEIN SUSF

(Bacteroides
thetaiotaomicron) 		PF16411
(SusF_SusE)
PF17142
(DUF5115) 		4 PHE A 446
GLY A 389
PHE A 416
PHE A 477
 None
None
None
EDO  A 511 ( 4.9A)
 1.02A 3ko0B-4fe9A:
undetectable
3ko0J-4fe9A:
undetectable		 3ko0B-4fe9A:
11.54
3ko0J-4fe9A:
11.54
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.
4fem OUTER MEMBRANE
PROTEIN SUSE

(Bacteroides
thetaiotaomicron) 		PF16411
(SusF_SusE) 		4 PHE A 340
GLY A 289
PHE A 314
PHE A 379
 None
 0.93A 3ko0B-4femA:
undetectable
3ko0J-4femA:
undetectable		 3ko0B-4femA:
15.73
3ko0J-4femA:
15.73
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.
4ieg RNA-DEPENDENT RNA
POLYMERASE P2

(Pseudomonas
phage phi12) 		no annotation 4 PHE A  97
GLY A  86
PHE A 531
PHE A 101
 None
 1.06A 3ko0B-4iegA:
undetectable
3ko0J-4iegA:
undetectable		 3ko0B-4iegA:
9.77
3ko0J-4iegA:
9.77
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.
4iss ALLOPHANATE
HYDROLASE

(Kluyveromyces
lactis) 		PF01425
(Amidase) 		4 PHE A 144
GLY A 156
CYH A 378
PHE A 419
 None
 0.96A 3ko0B-4issA:
undetectable
3ko0J-4issA:
undetectable		 3ko0B-4issA:
9.94
3ko0J-4issA:
9.94
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.
4jre NITRITE EXTRUSION
PROTEIN 1

(Escherichia
coli) 		PF07690
(MFS_1) 		4 PHE A 285
GLY A 343
PHE A 352
PHE A 277
 None
 1.08A 3ko0B-4jreA:
2.0
3ko0J-4jreA:
1.0		 3ko0B-4jreA:
12.10
3ko0J-4jreA:
12.10
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.
4n54 INOSITOL
DEHYDROGENASE

(Lactobacillus
casei) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 PHE A 170
PHE A 167
GLY A  14
MET A 183
 NAI  A 401 (-4.1A)
None
NAI  A 401 (-3.1A)
2H3  A 402 (-3.5A)
 0.97A 3ko0B-4n54A:
undetectable
3ko0J-4n54A:
undetectable		 3ko0B-4n54A:
13.88
3ko0J-4n54A:
13.88
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.
4pu5 TOXIN-ANTITOXIN
SYSTEM TOXIN HIPA
FAMILY

(Shewanella
oneidensis) 		PF07804
(HipA_C)
PF13657
(Couple_hipA) 		4 PHE A 179
GLY A  73
PHE A 164
PHE A 211
 None
 1.06A 3ko0B-4pu5A:
undetectable
3ko0J-4pu5A:
undetectable		 3ko0B-4pu5A:
12.61
3ko0J-4pu5A:
12.61
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.
4rcm METHYLATED
RNA-BINDING PROTEIN
1

(Saccharomyces
cerevisiae) 		PF04146
(YTH) 		4 GLY A 175
CYH A 213
PHE A 212
PHE A 290
 UNX  A 405 ( 4.2A)
None
None
None
 1.10A 3ko0B-4rcmA:
undetectable
3ko0J-4rcmA:
undetectable		 3ko0B-4rcmA:
22.02
3ko0J-4rcmA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u8h CRYPTOCHROME-2

(Mus musculus) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		4 PHE A 427
GLY A 386
CYH A 333
PHE A 423
 None
 1.02A 3ko0B-4u8hA:
undetectable
3ko0J-4u8hA:
undetectable		 3ko0B-4u8hA:
11.93
3ko0J-4u8hA:
11.93
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.
4u8t ZYRO0G01672P

(Zygosaccharomyces
rouxii) 		PF04146
(YTH) 		4 GLY A 198
CYH A 236
PHE A 235
PHE A 313
 None
 1.00A 3ko0B-4u8tA:
undetectable
3ko0J-4u8tA:
undetectable		 3ko0B-4u8tA:
19.21
3ko0J-4u8tA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x5s CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)

(Sulfurihydrogenibium
azorense) 		PF00194
(Carb_anhydrase) 		4 PHE A 201
PHE A 138
GLY A  63
MET A 107
 None
 1.01A 3ko0B-4x5sA:
undetectable
3ko0J-4x5sA:
undetectable		 3ko0B-4x5sA:
19.90
3ko0J-4x5sA:
19.90
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.
4xdq GLYCOSIDE HYDROLASE
FAMILY PROTEIN

(Mycolicibacterium
thermoresistibile) 		PF00722
(Glyco_hydro_16) 		4 PHE A 195
PHE A 206
GLY A 192
PHE A 147
 None
 0.90A 3ko0B-4xdqA:
undetectable
3ko0J-4xdqA:
undetectable		 3ko0B-4xdqA:
14.87
3ko0J-4xdqA:
14.87
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.
4ysw XANTHINE
DEHYDROGENASE/OXIDAS
E

(Rattus
norvegicus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 GLY A 588
CYH A  48
CYH A 147
PHE A 798
 None
FES  A3002 (-2.2A)
FES  A3001 (-2.3A)
None
 1.05A 3ko0B-4yswA:
undetectable
3ko0J-4yswA:
undetectable		 3ko0B-4yswA:
6.15
3ko0J-4yswA:
6.15
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.
4zoh PUTATIVE
OXIDOREDUCTASE
IRON-SULFUR SUBUNIT
PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT

(Sulfurisphaera
tokodaii) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY A  18
CYH C  52
CYH C 141
PHE A 215
 None
FES  C 201 (-2.1A)
FES  C 202 (-2.3A)
MCN  A 801 (-3.5A)
 1.08A 3ko0B-4zohA:
undetectable
3ko0J-4zohA:
undetectable		 3ko0B-4zohA:
8.96
3ko0J-4zohA:
8.96
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.
5cvz COAT PROTEIN

(Panicum
papanivirus 1) 		no annotation 4 PHE A 147
GLY A  51
PHE A  39
PHE A  60
 None
 0.92A 3ko0B-5cvzA:
undetectable
3ko0J-5cvzA:
undetectable		 3ko0B-5cvzA:
16.77
3ko0J-5cvzA:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ei0 SERPIN A12

(Homo sapiens) 		PF00079
(Serpin) 		4 PHE A 102
PHE A 104
GLY A 327
PHE A 116
 None
 0.83A 3ko0B-5ei0A:
undetectable
3ko0J-5ei0A:
undetectable		 3ko0B-5ei0A:
13.45
3ko0J-5ei0A:
13.45
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.
5f17 NON-STRUCTURAL
PROTEIN 11

(Equine
arteritis virus) 		no annotation 4 PHE A 142
GLY A  65
CYH A 205
PHE A 215
 None
 1.07A 3ko0B-5f17A:
undetectable
3ko0J-5f17A:
undetectable		 3ko0B-5f17A:
18.78
3ko0J-5f17A:
18.78
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.
5f17 NON-STRUCTURAL
PROTEIN 11

(Equine
arteritis virus) 		no annotation 4 PHE A 142
GLY A 103
CYH A 205
PHE A 215
 None
 1.06A 3ko0B-5f17A:
undetectable
3ko0J-5f17A:
undetectable		 3ko0B-5f17A:
18.78
3ko0J-5f17A:
18.78
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.
5f1c PUTATIVE
UNCHARACTERIZED
PROTEIN

(Amblyomma
maculatum) 		PF00864
(P2X_receptor) 		4 PHE A 333
PHE A 110
GLY A 270
PHE A 250
 None
 0.95A 3ko0B-5f1cA:
undetectable
3ko0J-5f1cA:
undetectable		 3ko0B-5f1cA:
12.78
3ko0J-5f1cA:
12.78
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.
5f2o FATTY ACID
O-METHYLTRANSFERASE

(Mycobacterium
marinum) 		PF03492
(Methyltransf_7) 		4 PHE A 195
GLY A  64
PHE A 274
PHE A 268
 None
SAH  A 400 (-3.8A)
None
None
 1.06A 3ko0B-5f2oA:
undetectable
3ko0J-5f2oA:
undetectable		 3ko0B-5f2oA:
13.62
3ko0J-5f2oA:
13.62
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.
5fsz MACRODOMAIN

(Trypanosoma
cruzi) 		PF01661
(Macro) 		4 GLY A 172
CYH A 200
PHE A 199
PHE A 238
 None
 1.09A 3ko0B-5fszA:
undetectable
3ko0J-5fszA:
undetectable		 3ko0B-5fszA:
16.67
3ko0J-5fszA:
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT
PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT

(Escherichia
coli) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 GLY C  33
CYH A 104
CYH A 208
PHE C 242
 None
FES  A 231 (-2.2A)
FES  A 230 (-2.2A)
MCN  C 921 (-3.6A)
 1.08A 3ko0B-5g5gC:
undetectable
3ko0J-5g5gC:
undetectable		 3ko0B-5g5gC:
8.04
3ko0J-5g5gC:
8.04
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.
5i6r SLIT-ROBO RHO
GTPASE-ACTIVATING
PROTEIN 2

(Homo sapiens) 		PF00611
(FCH) 		4 PHE A 128
GLY A 283
PHE A 295
PHE A  53
 None
 1.10A 3ko0B-5i6rA:
undetectable
3ko0J-5i6rA:
undetectable		 3ko0B-5i6rA:
11.97
3ko0J-5i6rA:
11.97
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 GLY A1621
CYH A1351
PHE A1331
PHE A1271
 None
 1.10A 3ko0B-5i8iA:
undetectable
3ko0J-5i8iA:
undetectable		 3ko0B-5i8iA:
4.13
3ko0J-5i8iA:
4.13
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 PHE A 144
GLY A 156
CYH A 378
PHE A 419
 None
 0.96A 3ko0B-5i8iA:
undetectable
3ko0J-5i8iA:
undetectable		 3ko0B-5i8iA:
4.13
3ko0J-5i8iA:
4.13
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A

(Aspergillus
niger) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 PHE A  82
GLY A  89
PHE A  95
PHE A 120
 None
 1.06A 3ko0B-5ihrA:
undetectable
3ko0J-5ihrA:
undetectable		 3ko0B-5ihrA:
6.99
3ko0J-5ihrA:
6.99
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.
5mdx PHOTOSYSTEM II CP43
REACTION CENTER
PROTEIN
PHOTOSYSTEM II
PROTEIN D1

(Arabidopsis
thaliana) 		PF00124
(Photo_RC)
PF00421
(PSII) 		4 PHE C 292
GLY A  90
CYH C 287
PHE C 289
 None
None
None
CLA  C 503 (-3.5A)
 1.03A 3ko0B-5mdxC:
undetectable
3ko0J-5mdxC:
undetectable		 3ko0B-5mdxC:
12.11
3ko0J-5mdxC:
12.11
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.
5mzh DYNEIN ASSEMBLY
FACTOR WITH WDR
REPEAT DOMAINS 1

(Chlamydomonas
reinhardtii) 		PF00400
(WD40) 		4 PHE A 109
PHE A 102
GLY A 112
PHE A  87
 None
 1.02A 3ko0B-5mzhA:
undetectable
3ko0J-5mzhA:
undetectable		 3ko0B-5mzhA:
12.61
3ko0J-5mzhA:
12.61
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.
5o7g ALPHA/BETA HYDROLASE
FAMILY PROTEIN

(Bacillus
coagulans) 		no annotation 4 PHE A  38
PHE A 221
GLY A  78
PHE A 143
 None
 1.11A 3ko0B-5o7gA:
undetectable
3ko0J-5o7gA:
undetectable		 3ko0B-5o7gA:
19.23
3ko0J-5o7gA:
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 5 PHE B 301
PHE B 332
GLY B 298
PHE B 317
PHE B 314
 None
 1.32A 3ko0B-5swiB:
undetectable
3ko0J-5swiB:
undetectable		 3ko0B-5swiB:
10.84
3ko0J-5swiB:
10.84
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 4 PHE B 317
PHE B 314
PHE B 301
PHE B 332
 None
 1.09A 3ko0B-5swiB:
undetectable
3ko0J-5swiB:
undetectable		 3ko0B-5swiB:
10.84
3ko0J-5swiB:
10.84
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 4 PHE B 328
GLY B 361
PHE B 270
PHE B  33
 None
 1.05A 3ko0B-5swiB:
undetectable
3ko0J-5swiB:
undetectable		 3ko0B-5swiB:
10.84
3ko0J-5swiB:
10.84
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.
5u1w P2X PURINOCEPTOR

(Ailuropoda
melanoleuca) 		PF00864
(P2X_receptor) 		4 PHE A 317
PHE A 102
GLY A 249
PHE A 229
 None
 0.84A 3ko0B-5u1wA:
undetectable
3ko0J-5u1wA:
undetectable		 3ko0B-5u1wA:
12.43
3ko0J-5u1wA:
12.43
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.
5x2q TASTE RECEPTOR, TYPE
1, MEMBER 2A

(Oryzias latipes) 		PF01094
(ANF_receptor) 		5 PHE A 420
GLY A 135
CYH A 164
PHE A 367
PHE A 428
 None
None
GLY  A 951 (-4.7A)
None
None
 1.29A 3ko0B-5x2qA:
undetectable
3ko0J-5x2qA:
undetectable		 3ko0B-5x2qA:
12.11
3ko0J-5x2qA:
12.11
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.
5xw6 P2X PURINOCEPTOR

(Gallus gallus) 		no annotation 4 PHE C 304
PHE C  90
GLY C 237
PHE C 217
 None
 0.88A 3ko0B-5xw6C:
undetectable
3ko0J-5xw6C:
undetectable		 3ko0B-5xw6C:
13.15
3ko0J-5xw6C:
13.15
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.
5y6q ALDEHYDE OXIDASE
LARGE SUBUNIT
ALDEHYDE OXIDASE
SMALL SUBUNIT

(Methylobacillus
sp. KY4400) 		no annotation 4 GLY C  49
CYH A  48
CYH A 138
PHE C 262
 None
FES  A 201 (-2.2A)
FES  A 202 (-2.2A)
MCN  C 802 (-3.3A)
 1.05A 3ko0B-5y6qC:
undetectable
3ko0J-5y6qC:
undetectable		 3ko0B-5y6qC:
20.00
3ko0J-5y6qC:
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.
6acd -

(-) 		no annotation 4 PHE A1034
GLY A1026
PHE A 782
PHE A 784
 None
 1.08A 3ko0B-6acdA:
1.2
3ko0J-6acdA:
1.2		 3ko0B-6acdA:
undetectable
3ko0J-6acdA:
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.
6c5x SUPPRESSOR OF
CYTOKINE SIGNALLING
1

(Xenopus laevis) 		no annotation 4 PHE D  79
GLY D  99
PHE D 209
PHE D 207
 None
 0.89A 3ko0B-6c5xD:
undetectable
3ko0J-6c5xD:
undetectable		 3ko0B-6c5xD:
21.78
3ko0J-6c5xD:
21.78