SIMILAR PATTERNS OF AMINO ACIDS FOR 3ADS_A_IMNA2_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ek2 EPOXIDE HYDROLASE

(Mus musculus) 		PF00561
(Abhydrolase_1)
PF13419
(HAD_2) 		5 PHE A 403
SER A 271
HIS A 263
PHE A 406
TYR A 294
 None
None
None
CDU  A1100 (-4.6A)
None
 1.32A 3adsA-1ek2A:
0.0		 3adsA-1ek2A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gnz GSI-B4 ISOLECTIN

(Griffonia
simplicifolia) 		PF00139
(Lectin_legB) 		5 LEU A 226
LEU A 108
PHE A 129
LEU A 188
TYR A 190
 None
 1.45A 3adsA-1gnzA:
undetectable		 3adsA-1gnzA:
20.58
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.
1jeq KU70

(Homo sapiens) 		PF02037
(SAP)
PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N) 		5 LEU A 437
LEU A 353
PHE A 350
LEU A 347
LEU A 345
 None
 1.30A 3adsA-1jeqA:
0.0		 3adsA-1jeqA:
20.03
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.
1q1n HYPOTHETICAL
ZINC-TYPE ALCOHOL
DEHYDROGENASE-LIKE
PROTEIN IN PRE5-FET4
INTERGENIC REGION

(Saccharomyces
cerevisiae) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 HIS A  34
LEU A  85
PHE A 145
HIS A 142
LEU A 101
 None
 1.44A 3adsA-1q1nA:
0.0		 3adsA-1q1nA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qe0 HISTIDINE--TRNA
LIGASE

(Staphylococcus
aureus) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		5 PHE A 127
HIS A 149
LEU A 159
LEU A  29
TYR A  33
 None
 1.25A 3adsA-1qe0A:
0.0		 3adsA-1qe0A:
23.56
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.
1qe0 HISTIDINE--TRNA
LIGASE

(Staphylococcus
aureus) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		5 PHE A 127
HIS A 149
LEU A 159
PHE A 306
TYR A  33
 None
 1.39A 3adsA-1qe0A:
0.0		 3adsA-1qe0A:
23.56
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.
1rro RAT ONCOMODULIN

(Rattus rattus) 		PF13499
(EF-hand_7) 		5 PHE A  30
LEU A  15
PHE A  24
LEU A  85
LEU A  58
 None
 1.25A 3adsA-1rroA:
undetectable		 3adsA-1rroA:
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.
1v0b CELL DIVISION
CONTROL PROTEIN 2
HOMOLOG

(Plasmodium
falciparum) 		PF00069
(Pkinase) 		5 LEU A 131
LEU A  97
PHE A 191
LEU A 260
LEU A 279
 None
 1.38A 3adsA-1v0bA:
undetectable		 3adsA-1v0bA:
21.34
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.
1y0g PROTEIN YCEI

(Escherichia
coli) 		PF04264
(YceI) 		5 PHE A  96
LEU A 181
LEU A 127
LEU A 172
LEU A  48
 8PP  A 320 (-4.5A)
None
None
8PP  A 320 (-4.0A)
8PP  A 320 (-4.3A)
 1.36A 3adsA-1y0gA:
undetectable		 3adsA-1y0gA:
22.03
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.
1ya0 SMG-7 TRANSCRIPT
VARIANT 2

(Homo sapiens) 		PF10373
(EST1_DNA_bind)
PF10374
(EST1) 		5 LEU A 203
PHE A 256
HIS A 257
LEU A 331
LEU A 302
 None
 1.23A 3adsA-1ya0A:
0.0		 3adsA-1ya0A:
22.47
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.
1yqq XANTHOSINE
PHOSPHORYLASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		5 LEU A  32
LEU A  74
PHE A 272
LEU A 172
LEU A 130
 None
 1.39A 3adsA-1yqqA:
undetectable		 3adsA-1yqqA:
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.
2ass S-PHASE
KINASE-ASSOCIATED
PROTEIN 2

(Homo sapiens) 		PF12937
(F-box-like) 		5 CYH B2165
SER B2168
LEU B2147
LEU B2156
LEU B2216
 None
 1.27A 3adsA-2assB:
undetectable		 3adsA-2assB:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fn9 RIBOSE ABC
TRANSPORTER,
PERIPLASMIC
RIBOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13407
(Peripla_BP_4) 		5 PHE A 220
LEU A 185
LEU A 136
LEU A 121
TYR A 125
 None
 1.21A 3adsA-2fn9A:
undetectable		 3adsA-2fn9A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iag PROSTACYCLIN
SYNTHASE

(Homo sapiens) 		PF00067
(p450) 		5 HIS A 461
LEU A 313
LEU A 295
PHE A 454
LEU A 148
 None
 1.40A 3adsA-2iagA:
undetectable		 3adsA-2iagA:
19.02
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.
2iag PROSTACYCLIN
SYNTHASE

(Homo sapiens) 		PF00067
(p450) 		5 PHE A 167
HIS A 461
LEU A 313
LEU A 295
LEU A 148
 None
 1.49A 3adsA-2iagA:
undetectable		 3adsA-2iagA:
19.02
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.
2jm1 TRANSCRIPTIONAL
REGULATOR ATRX

(Homo sapiens) 		no annotation 5 PHE A 239
CYH A 243
HIS A 189
LEU A 192
LEU A 276
 None
ZN  A   2 (-2.3A)
None
None
None
 1.44A 3adsA-2jm1A:
undetectable		 3adsA-2jm1A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nlk PROTEIN TYROSINE
PHOSPHATASE,
RECEPTOR TYPE, G
VARIANT (FRAGMENT)

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 CYH A1316
HIS A1350
LEU A1285
HIS A1313
TYR A1262
 None
 1.48A 3adsA-2nlkA:
undetectable		 3adsA-2nlkA:
19.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 PHE A 273
CYH A 276
LEU A 321
LEU A 344
LYS A 358
HIS A 440
LEU A 460
TYR A 464
 735  A 469 (-3.7A)
735  A 469 (-2.9A)
735  A 469 ( 4.3A)
735  A 469 ( 4.2A)
None
735  A 469 (-4.0A)
735  A 469 (-4.3A)
735  A 469 (-4.6A)
 0.87A 3adsA-2p54A:
37.1		 3adsA-2p54A:
61.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 PHE A 273
SER A 280
LEU A 321
LEU A 344
LYS A 358
HIS A 440
LEU A 460
TYR A 464
 735  A 469 (-3.7A)
735  A 469 (-2.8A)
735  A 469 ( 4.3A)
735  A 469 ( 4.2A)
None
735  A 469 (-4.0A)
735  A 469 (-4.3A)
735  A 469 (-4.6A)
 0.64A 3adsA-2p54A:
37.1		 3adsA-2p54A:
61.94
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.
2pzx G-PROTEIN COUPLED
RECEPTOR MTH

(Drosophila
melanogaster) 		PF06652
(Methuselah_N) 		5 PHE A 144
LEU A 132
LEU A 158
PHE A 150
HIS A 152
 None
 1.42A 3adsA-2pzxA:
undetectable		 3adsA-2pzxA:
22.42
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.
2v95 CORTICOSTEROID-BINDI
NG GLOBULIN

(Rattus
norvegicus) 		PF00079
(Serpin) 		5 PHE A 352
LEU A 222
PHE A 235
LEU A 322
LEU A  37
 None
 1.49A 3adsA-2v95A:
undetectable		 3adsA-2v95A:
21.90
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.
2w2j CARBONIC
ANHYDRASE-RELATED
PROTEIN

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 LEU A 222
HIS A 144
LEU A 112
LEU A 206
TYR A  74
 None
 1.42A 3adsA-2w2jA:
undetectable		 3adsA-2w2jA:
24.42
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.
2x6k PHOSPHOTIDYLINOSITOL
3 KINASE 59F

(Drosophila
melanogaster) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka) 		5 LEU A 871
LEU A 729
LEU A 396
LEU A 881
TYR A 397
 None
 1.39A 3adsA-2x6kA:
undetectable		 3adsA-2x6kA:
18.65
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.
2ycm 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE
, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF01128
(IspD) 		5 SER A 112
HIS A 178
LEU A 184
LEU A 291
LEU A  83
 None
 1.36A 3adsA-2ycmA:
undetectable		 3adsA-2ycmA:
23.15
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.
2yhm NUCLEOPROTEIN

(Human
orthopneumovirus) 		PF03246
(Pneumo_ncap) 		5 PHE A 111
SER A 131
HIS A 151
LEU A  51
LEU A 119
 None
 1.50A 3adsA-2yhmA:
undetectable		 3adsA-2yhmA:
23.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 CYH A 285
HIS A 323
LEU A 330
LEU A 353
LYS A 367
HIS A 449
LEU A 453
LEU A 469
TYR A 473
 MC5  A   1 (-3.6A)
MC5  A   1 (-3.8A)
MC5  A   1 (-4.4A)
MC5  A   1 (-4.7A)
None
MC5  A   1 (-3.9A)
MC5  A   1 (-4.2A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.62A 3adsA-3b0qA:
42.0		 3adsA-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 CYH A 285
LEU A 356
HIS A 449
LEU A 453
LEU A 469
TYR A 473
 MC5  A   1 (-3.6A)
None
MC5  A   1 (-3.9A)
MC5  A   1 (-4.2A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 1.32A 3adsA-3b0qA:
42.0		 3adsA-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 282
CYH A 285
HIS A 323
LEU A 469
TYR A 473
 MC5  A   1 (-4.4A)
MC5  A   1 (-3.6A)
MC5  A   1 (-3.8A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 1.13A 3adsA-3b0qA:
42.0		 3adsA-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 282
SER A 289
HIS A 323
LEU A 469
TYR A 473
 MC5  A   1 (-4.4A)
MC5  A   1 (-2.6A)
MC5  A   1 (-3.8A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.87A 3adsA-3b0qA:
42.0		 3adsA-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 SER A 289
HIS A 323
LEU A 330
LEU A 353
LYS A 367
HIS A 449
LEU A 453
LEU A 469
TYR A 473
 MC5  A   1 (-2.6A)
MC5  A   1 (-3.8A)
MC5  A   1 (-4.4A)
MC5  A   1 (-4.7A)
None
MC5  A   1 (-3.9A)
MC5  A   1 (-4.2A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.59A 3adsA-3b0qA:
42.0		 3adsA-3b0qA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3d5f PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 PHE A 282
CYH A 285
HIS A 323
LEU A 330
LEU A 353
LYS A 367
HIS A 449
LEU A 469
TYR A 473
 L41  A 501 ( 4.9A)
L41  A 501 (-3.5A)
L41  A 501 (-3.8A)
L41  A 501 (-4.9A)
None
None
L41  A 501 (-3.9A)
L41  A 501 (-3.8A)
L41  A 501 (-4.8A)
 0.85A 3adsA-3d5fA:
36.3		 3adsA-3d5fA:
62.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		8 CYH D 285
SER D 289
LEU D 330
LEU D 353
PHE D 363
HIS D 449
LEU D 469
TYR D 473
 PLB  D 701 (-3.2A)
PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
None
None
None
None
None
 0.85A 3adsA-3dzuD:
37.2		 3adsA-3dzuD:
94.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		7 PHE D 282
CYH D 285
SER D 289
LEU D 353
PHE D 363
HIS D 449
LEU D 469
 None
PLB  D 701 (-3.2A)
PLB  D 701 ( 3.9A)
None
None
None
None
 1.00A 3adsA-3dzuD:
37.2		 3adsA-3dzuD:
94.41
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.
3etc AMP-BINDING PROTEIN

(Methanosarcina
acetivorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 PHE A 101
HIS A 230
LEU A  69
LEU A 206
TYR A 226
 None
 1.40A 3adsA-3etcA:
undetectable		 3adsA-3etcA:
20.68
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.
3hhs PHENOLOXIDASE
SUBUNIT 2

(Manduca sexta) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		5 LEU A 357
PHE A 224
LEU A  87
LEU A 220
TYR A 132
 None
 1.49A 3adsA-3hhsA:
undetectable		 3adsA-3hhsA:
17.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i4x TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Aspergillus
fumigatus) 		PF11991
(Trp_DMAT) 		5 CYH A 248
SER A 256
LEU A 214
LEU A 148
PHE A 141
 None
 1.34A 3adsA-3i4xA:
undetectable		 3adsA-3i4xA:
22.22
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.
3k8p PROTEIN TRANSPORT
PROTEIN SEC39

(Saccharomyces
cerevisiae) 		PF08314
(Sec39) 		5 PHE D 367
LEU D 411
LEU D 377
LEU D 385
TYR D 381
 None
 1.49A 3adsA-3k8pD:
undetectable		 3adsA-3k8pD:
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.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 PHE A 428
SER A 155
HIS A 152
LEU A  70
TYR A  66
 None
 1.47A 3adsA-3lewA:
undetectable		 3adsA-3lewA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qpi CHLORITE DISMUTASE

(Nitrobacter
winogradskyi) 		PF06778
(Chlor_dismutase) 		5 PHE A 155
SER A 118
HIS A 114
LEU A  70
LEU A 162
 None
HEM  A1001 (-4.1A)
HEM  A1001 (-3.3A)
HEM  A1001 (-4.9A)
HEM  A1001 (-4.9A)
 1.41A 3adsA-3qpiA:
undetectable		 3adsA-3qpiA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qz3 FERRITIN

(Vibrio cholerae) 		PF00210
(Ferritin) 		5 PHE A  86
LEU A 144
LEU A  29
LEU A  49
TYR A  30
 None
 1.31A 3adsA-3qz3A:
undetectable		 3adsA-3qz3A:
19.79
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.
3sr7 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Streptococcus
mutans) 		PF01070
(FMN_dh) 		5 PHE A  53
LEU A 248
LEU A 263
PHE A  55
LEU A 112
 None
 1.36A 3adsA-3sr7A:
undetectable		 3adsA-3sr7A:
25.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v7n THREONINE SYNTHASE

(Burkholderia
thailandensis) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		5 PHE A 304
LEU A  31
PHE A 337
LEU A 341
LEU A 352
 None
 1.43A 3adsA-3v7nA:
undetectable		 3adsA-3v7nA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 HIS A2270
LEU A2266
PHE A2395
LEU A2367
LEU A2387
 None
 1.35A 3adsA-3vkgA:
undetectable		 3adsA-3vkgA:
6.84
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.
3vue GRANULE-BOUND STARCH
SYNTHASE 1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 CYH A 232
LEU A 201
LEU A 105
LEU A 244
TYR A 254
 None
 1.44A 3adsA-3vueA:
undetectable		 3adsA-3vueA:
20.51
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.
3wvo CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY

(Thermobifida
fusca) 		PF09481
(CRISPR_Cse1) 		5 LEU A 214
PHE A 220
HIS A  63
LEU A 257
TYR A 261
 None
 1.45A 3adsA-3wvoA:
undetectable		 3adsA-3wvoA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dnx SULFATE
ADENYLYLTRANSFERASE

(Allochromatium
vinosum) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		5 PHE A 267
LEU A  10
PHE A 283
LEU A 279
LEU A  83
 None
 1.47A 3adsA-4dnxA:
undetectable		 3adsA-4dnxA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4doo CHALCONE-FLAVANONE
ISOMERASE FAMILY
PROTEIN

(Arabidopsis
thaliana) 		PF16035
(Chalcone_2) 		5 PHE A 130
SER A 110
LEU A 148
LEU A 180
TYR A 181
 None
DAO  A 301 (-2.8A)
None
None
None
 1.39A 3adsA-4dooA:
undetectable		 3adsA-4dooA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4exl PHOSPHATE-BINDING
PROTEIN PSTS 1

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		5 SER A  68
LEU A 110
HIS A 236
LEU A  72
TYR A 238
 None
 1.48A 3adsA-4exlA:
undetectable		 3adsA-4exlA:
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.
4f3n UNCHARACTERIZED ACR,
COG1565 SUPERFAMILY

(Burkholderia
thailandensis) 		PF02636
(Methyltransf_28) 		5 LEU A 267
LEU A 336
LEU A 133
LEU A 144
TYR A 147
 None
 1.39A 3adsA-4f3nA:
undetectable		 3adsA-4f3nA:
21.52
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.
4gox POLYKETIDE SYNTHASE

(Synechococcus
sp. PCC 7002) 		PF13469
(Sulfotransfer_3) 		5 LEU A 173
PHE A 269
LEU A  44
LEU A 279
TYR A 218
 None
A3P  A 401 (-4.7A)
A3P  A 401 (-3.8A)
A3P  A 401 (-3.9A)
A3P  A 401 (-4.8A)
 1.49A 3adsA-4goxA:
undetectable		 3adsA-4goxA:
20.83
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.
4imi SYMPLEKIN

(Drosophila
melanogaster) 		PF11935
(DUF3453) 		5 LEU A 276
LEU A 319
PHE A 269
HIS A 234
LEU A 251
 None
 1.38A 3adsA-4imiA:
undetectable		 3adsA-4imiA:
22.34
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.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC

([Bacillus]
selenitireducens) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 LEU A 494
PHE A 492
HIS A 488
LEU A 601
TYR A 602
 None
 1.36A 3adsA-4ktpA:
undetectable		 3adsA-4ktpA:
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.
4n02 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Streptococcus
pneumoniae) 		PF01070
(FMN_dh) 		5 PHE A  54
LEU A 249
LEU A 264
PHE A  56
LEU A 113
 SO4  A 401 (-4.6A)
None
None
None
None
 1.35A 3adsA-4n02A:
undetectable		 3adsA-4n02A:
23.92
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.
4onq DNA
METHYLTRANSFERASE

(Nicotiana
tabacum) 		PF00145
(DNA_methylase) 		5 LEU A 471
LEU A 505
LEU A 487
LEU A 596
TYR A 592
 None
 1.31A 3adsA-4onqA:
undetectable		 3adsA-4onqA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ox9 16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE

(Escherichia
coli) 		PF02390
(Methyltransf_4) 		5 PHE Y 135
LEU Y 110
LEU Y 128
LEU Y 172
TYR Y 168
 None
SFG  Y 301 (-4.0A)
None
None
None
 1.22A 3adsA-4ox9Y:
undetectable		 3adsA-4ox9Y:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pju COHESIN SUBUNIT SA-2

(Homo sapiens) 		PF08514
(STAG) 		5 LEU A 589
LEU A 657
LEU A 609
LEU A 597
TYR A 600
 None
 1.39A 3adsA-4pjuA:
undetectable		 3adsA-4pjuA:
14.92
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.
4q38 PUTATIVE
UNCHARACTERIZED
PROTEIN TCP24

(Actinoplanes
teichomyceticus) 		no annotation 5 HIS A  79
LEU A  35
LEU A  45
PHE A 115
LEU A 169
 None
 1.47A 3adsA-4q38A:
undetectable		 3adsA-4q38A:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r81 NADH DEHYDROGENASE

(Methanothermobacter
marburgensis) 		PF02525
(Flavodoxin_2) 		5 PHE A 101
LEU A  65
LEU A  48
LEU A   6
TYR A   4
 None
 1.23A 3adsA-4r81A:
undetectable		 3adsA-4r81A:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rzl RESTRICTION
ENDONUCLEASE LPNPI

(Legionella
pneumophila) 		no annotation 5 LEU A 107
LEU A  60
PHE A 125
LEU A 203
TYR A 207
 None
None
None
None
1PE  A 301 (-3.6A)
 1.50A 3adsA-4rzlA:
undetectable		 3adsA-4rzlA:
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.
4txa ROQUIN-1

(Mus musculus) 		PF13445
(zf-RING_UBOX) 		5 HIS A 389
LEU A 337
LEU A 129
LEU A 106
TYR A 109
 None
 1.25A 3adsA-4txaA:
undetectable		 3adsA-4txaA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4txa ROQUIN-1

(Mus musculus) 		PF13445
(zf-RING_UBOX) 		5 HIS A 389
LEU A 353
LEU A 129
LEU A 106
TYR A 109
 None
 1.22A 3adsA-4txaA:
undetectable		 3adsA-4txaA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ueg GLYCOGENIN-2

(Homo sapiens) 		PF01501
(Glyco_transf_8) 		5 LEU A  94
LEU A  11
HIS A 148
LEU A 152
TYR A  71
 None
 1.29A 3adsA-4uegA:
undetectable		 3adsA-4uegA:
20.77
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.
4uwm 3,6-DIKETOCAMPHANE
1,6 MONOOXYGENASE

(Pseudomonas
putida) 		PF00296
(Bac_luciferase) 		5 PHE A 319
SER A 256
HIS A  10
LEU A 285
TYR A  12
 PGE  A 404 (-4.6A)
PGE  A 404 ( 4.1A)
FMN  A 400 (-3.7A)
None
PGE  A 404 (-4.5A)
 1.46A 3adsA-4uwmA:
undetectable		 3adsA-4uwmA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5icl LIPOATE--PROTEIN
LIGASE

(Enterococcus
faecalis) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		5 PHE A 145
HIS A  77
LEU A  82
LEU A  32
LEU A  15
 None
LAQ  A 401 (-4.5A)
None
None
None
 1.16A 3adsA-5iclA:
undetectable		 3adsA-5iclA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5igu MACROLIDE
2'-PHOSPHOTRANSFERAS
E II

(Escherichia
coli) 		PF01636
(APH) 		5 LEU A 269
PHE A 232
HIS A 135
LEU A 131
LEU A 217
 None
 1.46A 3adsA-5iguA:
undetectable		 3adsA-5iguA:
21.39
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.
5iso 5'-AMP-ACTIVATED
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA-2

(Homo sapiens) 		PF00069
(Pkinase)
PF16579
(AdenylateSensor) 		5 LEU A 147
LEU A 207
HIS A  75
LEU A 276
TYR A 275
 None
 1.45A 3adsA-5isoA:
undetectable		 3adsA-5isoA:
19.96
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.
5it9 RIBOSOMAL PROTEIN
RACK1

(Kluyveromyces
lactis) 		PF01092
(Ribosomal_S6e) 		5 SER g  36
LEU g  14
LEU g  95
LEU g  43
TYR g  62
 None
 1.46A 3adsA-5it9g:
undetectable		 3adsA-5it9g:
22.22
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.
5jmd HEPARINASE III
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07940
(Hepar_II_III)
PF16889
(Hepar_II_III_N) 		5 PHE A 210
LEU A 203
PHE A 262
LEU A  59
TYR A  62
 None
 1.33A 3adsA-5jmdA:
undetectable		 3adsA-5jmdA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k3j ACYL-COENZYME A
OXIDASE

(Caenorhabditis
elegans) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		5 PHE A 174
LEU A 199
HIS A 214
LEU A 204
TYR A 276
 None
 1.45A 3adsA-5k3jA:
undetectable		 3adsA-5k3jA:
20.03
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.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 PHE A 171
LEU A 177
LEU A  36
LEU A  87
TYR A  91
 None
 1.47A 3adsA-5k6oA:
undetectable		 3adsA-5k6oA:
15.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u8z CAROTENOID OXYGENASE
1

(Neurospora
crassa) 		PF03055
(RPE65) 		5 PHE A 102
LEU A 177
PHE A  72
LEU A 484
LEU A  58
 None
 1.47A 3adsA-5u8zA:
undetectable		 3adsA-5u8zA:
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.
5uc7 ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(environmental
samples) 		PF00202
(Aminotran_3) 		5 PHE A 258
CYH A 260
LEU A 210
LEU A 272
LEU A 103
 None
 1.28A 3adsA-5uc7A:
undetectable		 3adsA-5uc7A:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ufl PROTEIN CIP2A

(Homo sapiens) 		no annotation 5 PHE A 189
SER A 214
LEU A 257
LEU A 197
LEU A 166
 None
 1.26A 3adsA-5uflA:
undetectable		 3adsA-5uflA:
20.42
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.
5v2d DIOXYGENASE

(Pseudomonas
brassicacearum) 		no annotation 5 PHE A  72
LEU A 148
PHE A  42
LEU A 448
LEU A  28
 None
 1.44A 3adsA-5v2dA:
undetectable		 3adsA-5v2dA:
13.84
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.
5xpz FERMITIN FAMILY
HOMOLOG 2

(Mus musculus) 		PF00373
(FERM_M) 		5 CYH A 127
HIS A 134
LEU A 140
PHE A 120
LEU A 667
 None
 1.33A 3adsA-5xpzA:
undetectable		 3adsA-5xpzA:
19.74