SIMILAR PATTERNS OF AMINO ACIDS FOR 3EM0_A_CHDA153

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.
1ce7 PROTEIN
(RIBOSOME-INACTIVATI
NG PROTEIN TYPE II)

(Viscum album) 		PF00161
(RIP) 		4 ILE A 151
THR A  66
PHE A  97
PHE A  87
 None
 1.34A 3em0A-1ce7A:
0.0		 3em0A-1ce7A:
21.22
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.
1dy6 CARBAPENEM-HYDROLYSI
NG BETA-LACTAMASE
SME-1

(Serratia
marcescens) 		PF13354
(Beta-lactamase2) 		4 ILE A 285
THR A 265
PHE A  66
TYR A  60
 None
 1.05A 3em0A-1dy6A:
undetectable		 3em0A-1dy6A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ex0 COAGULATION FACTOR
XIII A CHAIN

(Homo sapiens) 		PF00868
(Transglut_N)
PF00927
(Transglut_C)
PF01841
(Transglut_core) 		4 THR A 625
PHE A 606
PHE A 568
TYR A 594
 None
 1.32A 3em0A-1ex0A:
0.2		 3em0A-1ex0A:
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.
1fi6 EH DOMAIN PROTEIN
REPS1

(Mus musculus) 		PF12763
(EF-hand_4) 		4 ILE A   8
PHE A  40
PHE A  20
TYR A  16
 None
 1.29A 3em0A-1fi6A:
undetectable		 3em0A-1fi6A:
18.92
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.
1h2t 80 KDA NUCLEAR CAP
BINDING PROTEIN

(Homo sapiens) 		PF02854
(MIF4G)
PF09088
(MIF4G_like)
PF09090
(MIF4G_like_2) 		4 ILE C 544
THR C 550
PHE C 508
PHE C 569
 None
 1.34A 3em0A-1h2tC:
0.0		 3em0A-1h2tC:
10.72
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.
1id2 AMICYANIN

(Paracoccus
versutus) 		PF00127
(Copper-bind) 		4 ILE A  26
PHE A  83
PHE A  58
TYR A  91
 None
 1.39A 3em0A-1id2A:
0.0		 3em0A-1id2A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m72 CASPASE-1

(Spodoptera
frugiperda) 		PF00656
(Peptidase_C14) 		4 ILE A  65
THR A 118
PHE A 158
PHE A 173
 None
 1.30A 3em0A-1m72A:
0.0		 3em0A-1m72A:
19.12
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.
1q1q SULFOTRANSFERASE
FAMILY, CYTOSOLIC,
2B, MEMBER 1 ISOFORM
A

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		4 ILE A 113
PHE A 292
PHE A 192
TYR A 129
 None
 1.32A 3em0A-1q1qA:
undetectable		 3em0A-1q1qA:
16.95
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.
1qot CHITIN BINDING
LECTIN, UEA-II

(Ulex europaeus) 		PF00139
(Lectin_legB) 		4 ILE A 123
THR A  71
PHE A  73
PHE A 127
 None
 1.27A 3em0A-1qotA:
1.0		 3em0A-1qotA:
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.
1qox BETA-GLUCOSIDASE

(Bacillus
circulans) 		PF00232
(Glyco_hydro_1) 		4 ILE A 219
THR A 342
PHE A 256
TYR A 255
 None
 1.18A 3em0A-1qoxA:
undetectable		 3em0A-1qoxA:
15.61
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.
1tve HOMOSERINE
DEHYDROGENASE

(Saccharomyces
cerevisiae) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		4 ILE A 110
THR A 114
PHE A 120
PHE A 131
 None
 1.34A 3em0A-1tveA:
undetectable		 3em0A-1tveA:
16.25
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.
1u2x ADP-SPECIFIC
PHOSPHOFRUCTOKINASE

(Pyrococcus
horikoshii) 		PF04587
(ADP_PFK_GK) 		4 ILE A 202
THR A  48
PHE A 109
PHE A 185
 None
 1.25A 3em0A-1u2xA:
undetectable		 3em0A-1u2xA:
16.91
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.
1xcr HYPOTHETICAL PROTEIN
PTD012

(Homo sapiens) 		PF08925
(DUF1907) 		4 ILE A  59
THR A 267
PHE A 207
PHE A 294
 None
 1.35A 3em0A-1xcrA:
undetectable		 3em0A-1xcrA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ytu HYPOTHETICAL PROTEIN
AF1318

(Archaeoglobus
fulgidus) 		PF02171
(Piwi) 		4 ILE A 267
THR A 185
PHE A 198
TYR A 222
 None
 1.25A 3em0A-1ytuA:
undetectable		 3em0A-1ytuA:
16.26
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.
2aey FRUCTAN
1-EXOHYDROLASE IIA

(Cichorium
intybus) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 THR A 240
PHE A 251
PHE A 205
TYR A 206
 None
 1.33A 3em0A-2aeyA:
undetectable		 3em0A-2aeyA:
15.67
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.
2bjs ISOPENICILLIN N
SYNTHETASE

(Aspergillus
nidulans) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		4 ILE A 220
THR A 261
PHE A 297
PHE A 170
 None
 1.26A 3em0A-2bjsA:
undetectable		 3em0A-2bjsA:
17.53
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.
2dpg GLUCOSE 6-PHOSPHATE
DEHYDROGENASE

(Leuconostoc
mesenteroides) 		PF00479
(G6PD_N)
PF02781
(G6PD_C) 		4 ILE A 146
THR A 422
PHE A  10
TYR A 115
 None
 1.23A 3em0A-2dpgA:
0.7		 3em0A-2dpgA:
15.08
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.
2hi6 UPF0107 PROTEIN
AF0055

(Archaeoglobus
fulgidus) 		PF01989
(DUF126) 		4 ILE A  36
THR A  20
PHE A  55
PHE A  26
 None
 1.34A 3em0A-2hi6A:
undetectable		 3em0A-2hi6A:
23.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jj7 HEMOLYSIN II
REGULATORY PROTEIN

(Bacillus cereus) 		PF00440
(TetR_N) 		4 ILE A 154
THR A  91
PHE A  71
TYR A  86
 None
 1.35A 3em0A-2jj7A:
undetectable		 3em0A-2jj7A:
21.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2lba BABP PROTEIN

(Gallus gallus) 		PF14651
(Lipocalin_7) 		5 ILE A  21
THR A  73
PHE A  79
PHE A  94
TYR A  97
 CHO  A 201 ( 4.3A)
CHO  A 201 (-2.8A)
CHO  A 201 (-3.5A)
CHO  A 201 (-2.9A)
CHO  A 201 (-2.6A)
 1.15A 3em0A-2lbaA:
19.2		 3em0A-2lbaA:
60.00
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.
2nn3 CASPASE-1

(Spodoptera
frugiperda) 		PF00656
(Peptidase_C14) 		4 ILE C  65
THR C 118
PHE C 158
PHE C 173
 None
 1.32A 3em0A-2nn3C:
undetectable		 3em0A-2nn3C:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nrh TRANSCRIPTIONAL
ACTIVATOR, PUTATIVE,
BAF FAMILY

(Campylobacter
jejuni) 		PF03309
(Pan_kinase) 		4 ILE A  73
PHE A  27
PHE A  55
TYR A  38
 None
 1.37A 3em0A-2nrhA:
undetectable		 3em0A-2nrhA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pbg 6-PHOSPHO-BETA-D-GAL
ACTOSIDASE

(Lactococcus
lactis) 		PF00232
(Glyco_hydro_1) 		4 ILE A 246
THR A 157
PHE A 138
PHE A 129
 None
 0.86A 3em0A-2pbgA:
undetectable		 3em0A-2pbgA:
16.03
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.
2pft EXOCYTOSIS PROTEIN

(Mus musculus) 		PF03081
(Exo70) 		4 ILE A 174
THR A 360
PHE A 364
PHE A 289
 None
 1.35A 3em0A-2pftA:
undetectable		 3em0A-2pftA:
13.33
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.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron) 		PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		4 ILE A 529
THR A 404
PHE A 427
PHE A 476
 None
 1.05A 3em0A-2q1fA:
3.5		 3em0A-2q1fA:
9.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qpx PREDICTED
METAL-DEPENDENT
HYDROLASE OF THE
TIM-BARREL FOLD

(Lactobacillus
paracasei) 		PF04909
(Amidohydro_2) 		4 ILE A  99
PHE A 314
PHE A  94
TYR A 325
 None
 1.38A 3em0A-2qpxA:
undetectable		 3em0A-2qpxA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r17 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 35

(Homo sapiens) 		PF03635
(Vps35) 		4 ILE C 560
THR C 567
PHE C 534
TYR C 537
 None
 1.21A 3em0A-2r17C:
undetectable		 3em0A-2r17C:
16.01
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		4 ILE A 101
PHE A 257
PHE A  87
TYR A 141
 BOG  A 800 ( 4.0A)
None
None
None
 1.35A 3em0A-2r4jA:
undetectable		 3em0A-2r4jA:
15.92
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.
2wbv FIBER PROTEIN

(Canine
mastadenovirus
A) 		no annotation 4 ILE A 387
THR A 530
PHE A 528
PHE A 418
 None
 1.28A 3em0A-2wbvA:
undetectable		 3em0A-2wbvA:
21.13
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.
2xtq COLICIN-M

(Escherichia
coli) 		PF14859
(Colicin_M) 		4 ILE A 166
THR A 179
PHE A 181
TYR A 217
 None
 1.35A 3em0A-2xtqA:
3.0		 3em0A-2xtqA:
19.93
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.
3ahx BETA-GLUCOSIDASE A

(Clostridium
cellulovorans) 		PF00232
(Glyco_hydro_1) 		4 ILE A 293
PHE A   6
PHE A  12
TYR A 396
 None
 1.08A 3em0A-3ahxA:
undetectable		 3em0A-3ahxA:
14.45
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.
3b81 TRANSCRIPTIONAL
REGULATOR, ACRR
FAMILY

(Clostridium
acetobutylicum) 		PF00440
(TetR_N) 		4 ILE A 107
THR A  31
PHE A  23
PHE A 115
 None
 1.30A 3em0A-3b81A:
undetectable		 3em0A-3b81A:
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.
3c75 AMICYANIN

(Paracoccus
versutus) 		PF00127
(Copper-bind) 		4 ILE A  26
PHE A  83
PHE A  58
TYR A  91
 None
 1.37A 3em0A-3c75A:
undetectable		 3em0A-3c75A:
23.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3elz ILEAL BILE
ACID-BINDING PROTEIN

(Danio rerio) 		PF14651
(Lipocalin_7) 		4 ILE A  21
THR A  73
PHE A  79
TYR A  97
 CHD  A 153 ( 4.1A)
CHD  A 200 (-3.1A)
CHD  A 153 ( 4.9A)
CHD  A 153 (-4.2A)
 0.75A 3em0A-3elzA:
24.6		 3em0A-3elzA:
100.00
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.
3frw PUTATIVE TRP
REPRESSOR PROTEIN

(Blautia obeum) 		PF01371
(Trp_repressor) 		4 ILE A  72
THR A  53
PHE A  90
PHE A  46
 None
 1.17A 3em0A-3frwA:
undetectable		 3em0A-3frwA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fsn RETINAL PIGMENT
EPITHELIUM-SPECIFIC
65 KDA PROTEIN

(Bos taurus) 		PF03055
(RPE65) 		4 ILE A 100
THR A 147
PHE A 103
TYR A 275
 None
 1.26A 3em0A-3fsnA:
2.2		 3em0A-3fsnA:
15.53
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.
3fxa SIS DOMAIN PROTEIN

(Listeria
monocytogenes) 		PF01380
(SIS) 		4 ILE A  21
THR A  28
PHE A 140
PHE A 166
 None
 1.20A 3em0A-3fxaA:
undetectable		 3em0A-3fxaA:
22.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k88 CHLOROPHENOL-4-MONOO
XYGENASE COMPONENT 1

(Burkholderia
cepacia) 		PF01613
(Flavin_Reduct) 		4 ILE A1066
THR A1038
PHE A1110
PHE A1098
 FAD  A1500 (-4.3A)
None
None
None
 1.29A 3em0A-3k88A:
undetectable		 3em0A-3k88A:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lpn RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE

(Thermoplasma
volcanium) 		PF00156
(Pribosyltran)
PF13793
(Pribosyltran_N) 		4 ILE A 106
THR A 128
PHE A 136
TYR A 111
 None
 1.35A 3em0A-3lpnA:
undetectable		 3em0A-3lpnA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n5l BINDING PROTEIN
COMPONENT OF ABC
PHOSPHONATE
TRANSPORTER

(Pseudomonas
aeruginosa) 		PF12974
(Phosphonate-bd) 		4 ILE A  35
THR A 107
PHE A 270
PHE A  50
 None
 1.37A 3em0A-3n5lA:
undetectable		 3em0A-3n5lA:
19.35
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.
3nvx PROTEIN A39

(Vaccinia virus) 		PF01403
(Sema) 		4 ILE A 352
THR A 362
PHE A 321
PHE A 245
 None
 1.38A 3em0A-3nvxA:
2.0		 3em0A-3nvxA:
15.67
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.
3o66 GLYCINE
BETAINE/CARNITINE/CH
OLINE ABC
TRANSPORTER

(Staphylococcus
aureus) 		PF04069
(OpuAC) 		4 ILE A 226
THR A 139
PHE A 241
PHE A 142
 None
 1.14A 3em0A-3o66A:
undetectable		 3em0A-3o66A:
18.44
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE GAMMA-SUBUNIT

(Komagataella
pastoris) 		no annotation 4 THR I  26
PHE I  23
PHE I 137
TYR I 140
 None
 1.25A 3em0A-3opyI:
undetectable		 3em0A-3opyI:
18.02
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.
3p0u NUCLEAR RECEPTOR
SUBFAMILY 2 GROUP C
MEMBER 2

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 ILE A 491
THR A 447
PHE A 446
PHE A 582
 None
 1.34A 3em0A-3p0uA:
undetectable		 3em0A-3p0uA:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pf7 BENZOYL-COA
OXYGENASE COMPONENT
B

(Azoarcus
evansii) 		no annotation 4 ILE A 251
THR A 197
PHE A 290
TYR A 287
 None
 1.18A 3em0A-3pf7A:
undetectable		 3em0A-3pf7A:
14.85
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.
3ppo GLYCINE
BETAINE/CARNITINE/CH
OLINE-BINDING
PROTEIN

(Bacillus
subtilis) 		PF04069
(OpuAC) 		4 ILE A 223
THR A 136
PHE A 238
PHE A 139
 None
 1.18A 3em0A-3ppoA:
undetectable		 3em0A-3ppoA:
17.19
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.
3qpm PEROXIREDOXIN

(Larimichthys
crocea) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 ILE A 203
THR A 217
PHE A 120
PHE A 103
 None
 1.35A 3em0A-3qpmA:
undetectable		 3em0A-3qpmA:
19.01
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.
3s6b METHIONINE
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF00557
(Peptidase_M24) 		4 ILE A 346
THR A 361
PHE A 359
PHE A 333
 None
 1.38A 3em0A-3s6bA:
undetectable		 3em0A-3s6bA:
18.16
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.
3tze TRYPTOPHANYL-TRNA
SYNTHETASE

(Encephalitozoon
cuniculi) 		PF00579
(tRNA-synt_1b) 		4 ILE A 114
THR A  85
PHE A 215
TYR A  82
 None
TRP  A 386 (-4.3A)
None
None
 1.32A 3em0A-3tzeA:
undetectable		 3em0A-3tzeA:
18.09
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.
3upu ATP-DEPENDENT DNA
HELICASE DDA

(Escherichia
virus T4) 		PF13604
(AAA_30) 		4 THR A  29
PHE A 168
PHE A 125
TYR A 120
 None
 0.99A 3em0A-3upuA:
undetectable		 3em0A-3upuA:
14.73
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.
3zef PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		4 ILE B1556
THR B1613
PHE B1383
PHE B1388
 None
 1.10A 3em0A-3zefB:
1.3		 3em0A-3zefB:
6.79
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.
4apw ALP12

(Clostridium
tetani) 		no annotation 4 ILE A 305
THR A 289
PHE A 179
PHE A 186
 None
 1.31A 3em0A-4apwA:
1.4		 3em0A-4apwA:
19.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ar9 COLLAGENASE COLT

(Clostridium
tetani) 		PF01752
(Peptidase_M9) 		4 ILE A 494
THR A 468
PHE A 505
PHE A 566
 None
 1.34A 3em0A-4ar9A:
undetectable		 3em0A-4ar9A:
15.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c0t LIKELY PROTEIN
KINASE

(Candida
albicans) 		PF00069
(Pkinase) 		4 ILE A 302
PHE A 240
PHE A 306
TYR A 305
 None
 1.07A 3em0A-4c0tA:
undetectable		 3em0A-4c0tA:
8.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c2x GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE 2

(Homo sapiens) 		PF01233
(NMT)
PF02799
(NMT_C) 		4 ILE A 138
THR A 122
PHE A 119
TYR A 479
 None
None
None
NHW  A1000 ( 4.1A)
 1.33A 3em0A-4c2xA:
undetectable		 3em0A-4c2xA:
17.07
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.
4d8m PESTICIDAL CRYSTAL
PROTEIN CRY5BA

(Bacillus
thuringiensis) 		PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		4 ILE A 697
PHE A 674
PHE A 693
TYR A 611
 None
 1.38A 3em0A-4d8mA:
undetectable		 3em0A-4d8mA:
13.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4doi CHALCONE--FLAVONONE
ISOMERASE 1

(Arabidopsis
thaliana) 		PF02431
(Chalcone) 		4 ILE A  61
PHE A 175
PHE A 155
TYR A 117
 None
None
None
NO3  A 301 ( 4.6A)
 1.10A 3em0A-4doiA:
undetectable		 3em0A-4doiA:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eqv INVERTASE 2

(Saccharomyces
cerevisiae) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 ILE A 327
PHE A 312
PHE A 224
TYR A 240
 None
 1.34A 3em0A-4eqvA:
undetectable		 3em0A-4eqvA:
12.60
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.
4ex5 LYSINE--TRNA LIGASE

(Burkholderia
thailandensis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 ILE A 482
THR A 293
PHE A 292
PHE A 202
 None
 1.34A 3em0A-4ex5A:
undetectable		 3em0A-4ex5A:
14.07
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.
4f53 SUSD HOMOLOG

(Bacteroides
ovatus) 		PF12741
(SusD-like) 		4 ILE A 186
THR A 210
PHE A 198
PHE A 132
 None
 1.14A 3em0A-4f53A:
undetectable		 3em0A-4f53A:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f7z RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 4

(Mus musculus) 		PF00027
(cNMP_binding)
PF00610
(DEP)
PF00617
(RasGEF)
PF00618
(RasGEF_N) 		4 ILE A 975
THR A 746
PHE A 750
PHE A 829
 None
 1.12A 3em0A-4f7zA:
undetectable		 3em0A-4f7zA:
9.18
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.
4fi9 SUN
DOMAIN-CONTAINING
PROTEIN 2

(Homo sapiens) 		PF07738
(Sad1_UNC) 		4 ILE A 544
THR A 622
PHE A 679
PHE A 665
 None
 1.20A 3em0A-4fi9A:
undetectable		 3em0A-4fi9A:
18.59
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.
4ftw PHOSPHOLIPASE/CARBOX
YLESTERASE

(Rhodobacter
sphaeroides) 		PF02230
(Abhydrolase_2) 		4 ILE A 182
THR A  96
PHE A  98
PHE A  71
 None
 1.36A 3em0A-4ftwA:
undetectable		 3em0A-4ftwA:
17.42
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.
4hjw URACIL-5-CARBOXYLATE
DECARBOXYLASE

(Metarhizium
anisopliae) 		PF04909
(Amidohydro_2) 		4 ILE A 330
THR A  71
PHE A  74
PHE A 326
 None
 1.08A 3em0A-4hjwA:
undetectable		 3em0A-4hjwA:
15.24
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.
4j0x RIBOSOMAL
RNA-PROCESSING
PROTEIN 9

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 ILE A 402
THR A 435
PHE A 508
PHE A 487
 None
 1.37A 3em0A-4j0xA:
2.3		 3em0A-4j0xA:
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.
4kpn NUCLEOSIDE
N-RIBOHYDROLASE 1

(Physcomitrella
patens) 		PF01156
(IU_nuc_hydro) 		4 ILE A 138
THR A 145
PHE A  82
PHE A 120
 None
 1.21A 3em0A-4kpnA:
undetectable		 3em0A-4kpnA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mh0 RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 4

(Mus musculus) 		PF00027
(cNMP_binding)
PF00617
(RasGEF)
PF00618
(RasGEF_N) 		4 ILE E 975
THR E 746
PHE E 750
PHE E 829
 None
 1.07A 3em0A-4mh0E:
undetectable		 3em0A-4mh0E:
12.15
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.
4nen INTEGRIN ALPHA-X

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 ILE A 263
THR A 167
PHE A 169
PHE A 135
 None
 1.23A 3em0A-4nenA:
undetectable		 3em0A-4nenA:
9.34
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.
4oc9 PUTATIVE
O-ACETYLHOMOSERINE
(THIOL)-LYASE

(Campylobacter
jejuni) 		PF01053
(Cys_Met_Meta_PP) 		4 ILE A  78
THR A 264
PHE A  88
TYR A  89
 None
 1.29A 3em0A-4oc9A:
undetectable		 3em0A-4oc9A:
17.88
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.
4oht SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE

(Streptococcus
pyogenes) 		PF00171
(Aldedh) 		4 ILE A  91
THR A 419
PHE A 133
TYR A 136
 None
 1.34A 3em0A-4ohtA:
undetectable		 3em0A-4ohtA:
13.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pfi TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT

(Marinobacter
hydrocarbonoclasticus) 		PF03480
(DctP) 		4 THR A 190
PHE A 188
PHE A 183
TYR A 203
 None
 1.21A 3em0A-4pfiA:
undetectable		 3em0A-4pfiA:
17.63
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.
4qei GLYCINE--TRNA LIGASE

(Homo sapiens) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		4 ILE A 107
THR A 538
PHE A 551
PHE A  79
 None
 1.17A 3em0A-4qeiA:
undetectable		 3em0A-4qeiA:
12.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ue0 FIBER

(Bovine
atadenovirus D) 		no annotation 4 ILE A 496
PHE A 456
PHE A 514
TYR A 499
 None
 1.38A 3em0A-4ue0A:
undetectable		 3em0A-4ue0A:
25.18
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.
4w99 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH, B-SPECIFIC]
1, MITOCHONDRIAL

(Candida
tropicalis) 		no annotation 4 ILE A 169
THR A 131
PHE A 129
PHE A 143
 None
 1.31A 3em0A-4w99A:
undetectable		 3em0A-4w99A:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		4 ILE A 584
THR A 560
PHE A 535
PHE A 556
 None
 1.36A 3em0A-4xhbA:
undetectable		 3em0A-4xhbA:
14.24
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.
4xru HEN1

(Capnocytophaga
gingivalis) 		no annotation 4 ILE C 144
THR C 174
PHE C 170
PHE C 139
 None
 1.31A 3em0A-4xruC:
undetectable		 3em0A-4xruC:
14.42
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.
4xru HEN1

(Capnocytophaga
gingivalis) 		no annotation 4 THR C 174
PHE C 170
PHE C 139
TYR C 138
 None
 1.29A 3em0A-4xruC:
undetectable		 3em0A-4xruC:
14.42
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.
4y9d C
ALPHA-DEHYDROGENASE

(Sphingobium sp.
SYK-6) 		PF00106
(adh_short) 		4 ILE A 120
THR A  12
PHE A  10
PHE A 126
 None
 1.31A 3em0A-4y9dA:
undetectable		 3em0A-4y9dA:
19.67
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.
4yeh LECTIN

(Cicer arietinum) 		PF00045
(Hemopexin) 		4 ILE A  98
THR A  70
PHE A  68
PHE A  78
 None
 1.33A 3em0A-4yehA:
undetectable		 3em0A-4yehA:
24.32
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.
4z8z UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 4 ILE A 248
THR A 257
PHE A 259
PHE A 194
 None
 1.14A 3em0A-4z8zA:
undetectable		 3em0A-4z8zA:
17.10
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.
5c77 PROTEIN ARGININE
N-METHYLTRANSFERASE
SFM1

(Saccharomyces
cerevisiae) 		PF04252
(RNA_Me_trans) 		4 ILE A  23
THR A 146
PHE A 102
TYR A   3
 None
 1.21A 3em0A-5c77A:
undetectable		 3em0A-5c77A:
18.67
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		4 ILE A 776
THR A 730
PHE A 771
PHE A 763
 None
BCO  A1103 (-3.2A)
None
None
 1.28A 3em0A-5cjuA:
undetectable		 3em0A-5cjuA:
8.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum) 		PF13354
(Beta-lactamase2) 		4 ILE A 286
THR A 266
PHE A  66
TYR A  60
 None
 1.05A 3em0A-5e43A:
1.2		 3em0A-5e43A:
17.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5epd GLYCEROL TRINITRATE
REDUCTASE

(Agrobacterium
tumefaciens) 		PF00724
(Oxidored_FMN) 		4 ILE A 107
THR A  27
PHE A 345
PHE A 137
 None
 1.22A 3em0A-5epdA:
undetectable		 3em0A-5epdA:
15.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ev7 CONSERVED DOMAIN
PROTEIN

(Bacillus
anthracis) 		PF13402
(Peptidase_M60)
PF17291
(M60-like_N) 		4 ILE A 431
THR A 392
PHE A 388
PHE A 350
 None
 1.16A 3em0A-5ev7A:
undetectable		 3em0A-5ev7A:
13.85
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.
5hr4 MMEI

(Methylophilus
methylotrophus) 		no annotation 4 ILE C 833
THR C 792
PHE C 882
TYR C 880
 None
 1.13A 3em0A-5hr4C:
undetectable		 3em0A-5hr4C:
9.36
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.
5mnd GRANULIN

(Cydia pomonella
granulovirus) 		PF00738
(Polyhedrin) 		4 ILE A 118
THR A 101
PHE A  97
PHE A 179
 None
 1.36A 3em0A-5mndA:
undetectable		 3em0A-5mndA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nmp ISATIN HYDROLASE

(Ralstonia
solanacearum) 		no annotation 4 ILE A 197
THR A 150
PHE A 148
PHE A 192
 None
 1.35A 3em0A-5nmpA:
undetectable		 3em0A-5nmpA:
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.
5nva PUTATIVE
SODIUM:SOLUTE
SYMPORTER

(Proteus
mirabilis) 		no annotation 4 ILE A  88
THR A 419
PHE A 100
TYR A  96
 None
 1.34A 3em0A-5nvaA:
undetectable		 3em0A-5nvaA:
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.
5nxy OSMOTICALLY
ACTIVATED
L-CARNITINE/CHOLINE
ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN OPUCC

(Bacillus
subtilis) 		no annotation 4 ILE A 195
THR A 108
PHE A 210
PHE A 111
 None
 1.18A 3em0A-5nxyA:
undetectable		 3em0A-5nxyA:
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.
5oar BETA-HEXOSAMINIDASE

(Aspergillus
oryzae) 		no annotation 4 ILE B 161
THR B 155
PHE B 564
TYR B 567
 None
 1.13A 3em0A-5oarB:
undetectable		 3em0A-5oarB:
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.
5ta1 GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		no annotation 4 ILE A 265
THR A 300
PHE A 600
PHE A 254
 None
 1.03A 3em0A-5ta1A:
undetectable		 3em0A-5ta1A:
12.52
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.
5ubj ALPHA-L-ARABINOFURAN
OSIDASE AXHA-2

(Aspergillus
nidulans) 		PF03664
(Glyco_hydro_62) 		4 ILE A 186
THR A 216
PHE A 171
TYR A 169
 None
 1.37A 3em0A-5ubjA:
undetectable		 3em0A-5ubjA:
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.
5y4j XYLOSE ISOMERASE

(Streptomyces
rubiginosus) 		PF01261
(AP_endonuc_2) 		4 ILE A 176
THR A 119
PHE A 104
PHE A 162
 None
 1.39A 3em0A-5y4jA:
undetectable		 3em0A-5y4jA:
14.84
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.
5y9d ACYL-COENZYME A
OXIDASE 1

(Yarrowia
lipolytica) 		no annotation 4 ILE A 514
THR A 549
PHE A 403
PHE A 542
 None
 1.33A 3em0A-5y9dA:
undetectable		 3em0A-5y9dA:
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.
5ys9 ACYL-COENZYME A
OXIDASE 3

(Yarrowia
lipolytica) 		no annotation 4 ILE A 522
THR A 558
PHE A 414
PHE A 551
 None
 1.25A 3em0A-5ys9A:
undetectable		 3em0A-5ys9A:
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.
6djw RBR-TYPE E3
UBIQUITIN
TRANSFERASE,RBR-TYPE
E3 UBIQUITIN
TRANSFERASE

(Bactrocera
dorsalis) 		no annotation 4 THR A 321
PHE A 339
PHE A 299
TYR A 302
 None
 1.35A 3em0A-6djwA:
undetectable		 3em0A-6djwA:
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.
6djx RBR-TYPE E3
UBIQUITIN
TRANSFERASE,RBR-TYPE
E3 UBIQUITIN
TRANSFERASE

(Bactrocera
dorsalis) 		no annotation 4 THR A 321
PHE A 339
PHE A 299
TYR A 302
 None
 1.35A 3em0A-6djxA:
undetectable		 3em0A-6djxA:
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.
6fhv GLUCOAMYLASE

(Penicillium
oxalicum) 		no annotation 4 ILE A 513
THR A 573
PHE A 575
PHE A 518
 None
 1.29A 3em0A-6fhvA:
undetectable		 3em0A-6fhvA:
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.
6g1k TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY C
MEMBER 4A

(Danio rerio) 		no annotation 4 THR A 567
PHE A 561
PHE A 601
TYR A 604
 None
 1.30A 3em0A-6g1kA:
undetectable		 3em0A-6g1kA:
undetectable