SIMILAR PATTERNS OF AMINO ACIDS FOR 3ADX_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 3adxA-1ek2A:
undetectable		 3adxA-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.
1gxs P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B

(Sorghum bicolor) 		PF00450
(Peptidase_S10) 		5 GLN A 167
SER A 166
LEU A  60
LEU B 344
TYR B 341
 None
 1.30A 3adxA-1gxsA:
undetectable		 3adxA-1gxsA:
18.47
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.
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
 1.26A 3adxA-1qe0A:
0.0		 3adxA-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
 1.36A 3adxA-1qe0A:
0.0		 3adxA-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.
1qmy PROTEASE

(Foot-and-mouth
disease virus) 		PF05408
(Peptidase_C28) 		5 PHE A  68
GLN A  85
HIS A 109
PHE A  60
LEU A  89
 None
 1.33A 3adxA-1qmyA:
undetectable		 3adxA-1qmyA:
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.
1x9n DNA LIGASE I

(Homo sapiens) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		5 GLN A 465
SER A 468
LEU A 520
LEU A 331
LEU A 496
 None
 1.40A 3adxA-1x9nA:
0.0		 3adxA-1x9nA:
17.23
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.
1z1v STE50 PROTEIN

(Saccharomyces
cerevisiae) 		PF09235
(Ste50p-SAM) 		5 CYH A  78
GLN A  79
LEU A  48
LEU A  70
LEU A  86
 None
 1.50A 3adxA-1z1vA:
undetectable		 3adxA-1z1vA:
15.09
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.
1zzg GLUCOSE-6-PHOSPHATE
ISOMERASE

(Thermus
thermophilus) 		PF00342
(PGI) 		5 TYR A 362
LEU A 364
LEU A 257
HIS A 245
LEU A 388
 None
 1.29A 3adxA-1zzgA:
undetectable		 3adxA-1zzgA:
21.35
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.
2bnh RIBONUCLEASE
INHIBITOR

(Sus scrofa) 		PF13516
(LRR_6) 		5 CYH A 357
GLN A 358
SER A 361
LEU A 389
LEU A 372
 None
 1.46A 3adxA-2bnhA:
undetectable		 3adxA-2bnhA:
20.97
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.
2i05 DNA REPLICATION
TERMINUS
SITE-BINDING PROTEIN

(Escherichia
coli) 		PF05472
(Ter) 		5 GLN A  19
HIS A 116
LEU A 159
LEU A  71
HIS A 113
 None
 1.45A 3adxA-2i05A:
0.0		 3adxA-2i05A:
22.32
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		5 GLN A 276
SER A 416
LEU A 175
LEU A 222
HIS A 217
 None
 1.49A 3adxA-2i0kA:
undetectable		 3adxA-2i0kA:
19.09
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.
2nlk PROTEIN TYROSINE
PHOSPHATASE,
RECEPTOR TYPE, G
VARIANT (FRAGMENT)

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 CYH A1316
GLN A1315
HIS A1350
LEU A1361
TYR A1262
 None
 1.05A 3adxA-2nlkA:
undetectable		 3adxA-2nlkA:
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.
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
 1.47A 3adxA-2nlkA:
undetectable		 3adxA-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
GLN A 277
LEU A 321
LEU A 344
HIS A 440
LEU A 460
TYR A 464
 735  A 469 (-3.7A)
735  A 469 (-2.9A)
735  A 469 (-4.4A)
735  A 469 ( 4.3A)
735  A 469 ( 4.2A)
735  A 469 (-4.0A)
735  A 469 (-4.3A)
735  A 469 (-4.6A)
 0.89A 3adxA-2p54A:
37.2		 3adxA-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
GLN A 277
SER A 280
LEU A 321
LEU A 344
HIS A 440
LEU A 460
TYR A 464
 735  A 469 (-3.7A)
735  A 469 (-4.4A)
735  A 469 (-2.8A)
735  A 469 ( 4.3A)
735  A 469 ( 4.2A)
735  A 469 (-4.0A)
735  A 469 (-4.3A)
735  A 469 (-4.6A)
 0.66A 3adxA-2p54A:
37.2		 3adxA-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 3adxA-2pzxA:
undetectable		 3adxA-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.
2qna IMPORTIN SUBUNIT
BETA-1

(Homo sapiens) 		PF13513
(HEAT_EZ) 		5 GLN A 712
SER A 764
LEU A 739
LEU A 697
TYR A 757
 None
 1.48A 3adxA-2qnaA:
undetectable		 3adxA-2qnaA:
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.
2qx2 SEX PHEROMONE
STAPH-CAM373

(Staphylococcus
aureus) 		PF07537
(CamS) 		5 PHE A 173
GLN A 171
LEU A 229
HIS A 244
LEU A  86
 None
 1.47A 3adxA-2qx2A:
undetectable		 3adxA-2qx2A:
22.96
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.
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
 1.37A 3adxA-2ycmA:
undetectable		 3adxA-2ycmA:
23.15
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
GLN A 286
HIS A 323
TYR A 327
LEU A 330
LEU A 353
HIS A 449
LEU A 469
TYR A 473
 MC5  A   1 (-3.6A)
None
MC5  A   1 (-3.8A)
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.7A)
MC5  A   1 (-3.9A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.66A 3adxA-3b0qA:
41.4		 3adxA-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
GLN A 286
LEU A 356
HIS A 449
LEU A 469
TYR A 473
 MC5  A   1 (-3.6A)
None
None
MC5  A   1 (-3.9A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 1.39A 3adxA-3b0qA:
41.4		 3adxA-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 GLN A 286
SER A 289
HIS A 323
TYR A 327
LEU A 330
LEU A 353
HIS A 449
LEU A 469
TYR A 473
 None
MC5  A   1 (-2.6A)
MC5  A   1 (-3.8A)
None
MC5  A   1 (-4.4A)
MC5  A   1 (-4.7A)
MC5  A   1 (-3.9A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.69A 3adxA-3b0qA:
41.4		 3adxA-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 PHE A 282
CYH A 285
GLN A 286
HIS A 323
LEU A 469
TYR A 473
 MC5  A   1 (-4.4A)
MC5  A   1 (-3.6A)
None
MC5  A   1 (-3.8A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 1.07A 3adxA-3b0qA:
41.4		 3adxA-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 PHE A 282
GLN A 286
SER A 289
HIS A 323
LEU A 469
TYR A 473
 MC5  A   1 (-4.4A)
None
MC5  A   1 (-2.6A)
MC5  A   1 (-3.8A)
MC5  A   1 (-4.1A)
MC5  A   1 (-4.9A)
 0.89A 3adxA-3b0qA:
41.4		 3adxA-3b0qA:
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.
3czp PUTATIVE
POLYPHOSPHATE KINASE
2

(Pseudomonas
aeruginosa) 		PF03976
(PPK2) 		5 PHE A  91
GLN A 111
SER A 110
LEU A 147
LEU A  76
 None
 1.11A 3adxA-3czpA:
undetectable		 3adxA-3czpA:
20.94
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.
3czp PUTATIVE
POLYPHOSPHATE KINASE
2

(Pseudomonas
aeruginosa) 		PF03976
(PPK2) 		5 PHE A  91
GLN A 111
SER A 110
PHE A 104
LEU A  76
 None
 1.26A 3adxA-3czpA:
undetectable		 3adxA-3czpA:
20.94
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) 		5 CYH A 285
GLN A 286
LEU A 353
PHE A 360
LEU A 469
 L41  A 501 (-3.5A)
None
None
None
L41  A 501 (-3.8A)
 1.33A 3adxA-3d5fA:
36.3		 3adxA-3d5fA:
62.92
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
GLN A 286
HIS A 323
LEU A 330
LEU A 353
HIS A 449
LEU A 469
TYR A 473
 L41  A 501 ( 4.9A)
L41  A 501 (-3.5A)
None
L41  A 501 (-3.8A)
L41  A 501 (-4.9A)
None
L41  A 501 (-3.9A)
L41  A 501 (-3.8A)
L41  A 501 (-4.8A)
 0.84A 3adxA-3d5fA:
36.3		 3adxA-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) 		7 CYH D 285
GLN D 286
SER D 289
LEU D 330
LEU D 353
PHE D 363
LEU D 469
 PLB  D 701 (-3.2A)
None
PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
None
None
None
 0.79A 3adxA-3dzuD:
37.0		 3adxA-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) 		8 CYH D 285
GLN D 286
SER D 289
TYR D 327
LEU D 330
LEU D 353
HIS D 449
LEU D 469
 PLB  D 701 (-3.2A)
None
PLB  D 701 ( 3.9A)
None
PLB  D 701 ( 4.1A)
None
None
None
 0.74A 3adxA-3dzuD:
37.0		 3adxA-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) 		5 CYH D 285
HIS D 323
TYR D 327
HIS D 449
TYR D 473
 PLB  D 701 (-3.2A)
None
None
None
None
 1.26A 3adxA-3dzuD:
37.0		 3adxA-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 CYH D 285
SER D 289
LEU D 330
LEU D 353
PHE D 363
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
 0.68A 3adxA-3dzuD:
37.0		 3adxA-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) 		8 CYH D 285
SER D 289
TYR D 327
LEU D 330
LEU D 353
HIS D 449
LEU D 469
TYR D 473
 PLB  D 701 (-3.2A)
PLB  D 701 ( 3.9A)
None
PLB  D 701 ( 4.1A)
None
None
None
None
 0.78A 3adxA-3dzuD:
37.0		 3adxA-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) 		6 PHE D 282
GLN D 286
SER D 289
LEU D 353
PHE D 363
LEU D 469
 None
None
PLB  D 701 ( 3.9A)
None
None
None
 1.03A 3adxA-3dzuD:
37.0		 3adxA-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
GLN D 286
SER D 289
TYR D 327
LEU D 353
HIS D 449
LEU D 469
 None
None
PLB  D 701 ( 3.9A)
None
None
None
None
 0.84A 3adxA-3dzuD:
37.0		 3adxA-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.
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
 1.35A 3adxA-3i4xA:
undetectable		 3adxA-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.
3if2 AMINOTRANSFERASE

(Psychrobacter
arcticus) 		PF00155
(Aminotran_1_2) 		5 SER A 395
TYR A 188
LEU A 356
HIS A 409
TYR A 407
 None
 1.38A 3adxA-3if2A:
undetectable		 3adxA-3if2A:
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.
3k25 SLR1438 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF01263
(Aldose_epim) 		5 GLN A 147
LEU A  34
LEU A  25
PHE A 284
LEU A 161
 None
 1.30A 3adxA-3k25A:
undetectable		 3adxA-3k25A:
23.73
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.
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
 1.35A 3adxA-3sr7A:
undetectable		 3adxA-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.
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
 1.46A 3adxA-3vueA:
undetectable		 3adxA-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.
4bi3 SSP1

(Serratia
marcescens) 		PF14113
(Tae4) 		5 PHE A 123
TYR A   5
LEU A 162
LEU A  92
LEU A 144
 None
 1.37A 3adxA-4bi3A:
undetectable		 3adxA-4bi3A:
20.49
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.
4d72 GLYCOSIDE HYDROLASE

(Streptococcus
pneumoniae) 		PF08306
(Glyco_hydro_98M)
PF08307
(Glyco_hydro_98C) 		5 PHE A 493
TYR A 548
LEU A 551
LEU A 536
LEU A 459
 None
 1.40A 3adxA-4d72A:
undetectable		 3adxA-4d72A:
19.20
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.
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
 1.49A 3adxA-4exlA:
undetectable		 3adxA-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.
4gkh AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB

(Acinetobacter
baumannii) 		PF01636
(APH) 		5 GLN A 227
TYR A 251
LEU A 247
LEU A 204
HIS A 132
 None
 1.24A 3adxA-4gkhA:
undetectable		 3adxA-4gkhA:
24.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lgc BILE ACID-COENZYME A
LIGASE

([Clostridium]
scindens) 		PF00501
(AMP-binding) 		5 PHE A 264
GLN A 217
LEU A 275
LEU A 311
LEU A 219
 None
 1.43A 3adxA-4lgcA:
undetectable		 3adxA-4lgcA:
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.
4lmv GLUTATHIONE
TRANSFERASE

(Phanerochaete
chrysosporium) 		PF13417
(GST_N_3) 		5 PHE A 246
CYH A 243
GLN A 245
LEU A 231
LEU A 194
 None
 1.30A 3adxA-4lmvA:
undetectable		 3adxA-4lmvA:
22.60
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.
4lz6 BH2163 PROTEIN

(Bacillus
halodurans) 		PF01554
(MatE) 		5 PHE A 154
GLN A 206
TYR A 139
LEU A 140
TYR A  36
 None
 1.33A 3adxA-4lz6A:
2.2		 3adxA-4lz6A:
20.44
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.
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
 1.34A 3adxA-4n02A:
undetectable		 3adxA-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.
4pde PROTEIN FDHD

(Escherichia
coli) 		PF02634
(FdhD-NarQ) 		5 SER A 228
LEU A 198
LEU A 157
PHE A 237
LEU A 255
 None
 1.40A 3adxA-4pdeA:
undetectable		 3adxA-4pdeA:
21.04
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 GLN A 111
SER A 112
TYR A 120
LEU A  56
LEU A 239
 None
GOL  A 401 (-3.6A)
None
None
None
 1.33A 3adxA-5hc4A:
undetectable		 3adxA-5hc4A:
23.45
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.
5hc4 LIPOLYTIC ENZYME

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 SER A 112
HIS A 106
TYR A 120
LEU A  56
LEU A 239
 GOL  A 401 (-3.6A)
None
None
None
None
 1.23A 3adxA-5hc4A:
undetectable		 3adxA-5hc4A:
23.45
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.
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
 1.31A 3adxA-5jmdA:
undetectable		 3adxA-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.
5ns8 -

(-) 		no annotation 5 PHE A 248
TYR A 307
LEU A 239
LEU A 174
TYR A 175
 None
GOL  A 504 (-3.3A)
None
None
GOL  A 504 (-4.4A)
 1.37A 3adxA-5ns8A:
undetectable		 3adxA-5ns8A:
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.
5um6 UBIQUITIN-ACTIVATING
ENZYME E1 1

(Schizosaccharomyces
pombe) 		PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		5 TYR A 385
LEU A 338
PHE A 334
HIS A 292
LEU A 133
 None
 1.49A 3adxA-5um6A:
undetectable		 3adxA-5um6A:
15.66
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.
5xfa NAD-REDUCING
HYDROGENASE

(Hydrogenophilus
thermoluteolus) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6) 		5 GLN D 281
HIS D 402
TYR D 413
HIS C 123
TYR D 279
 None
 1.34A 3adxA-5xfaD:
undetectable		 3adxA-5xfaD:
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.
6cc2 CELL DIVISION
CONTROL PROTEIN 45
CDC45 PUTATIVE

(Entamoeba
histolytica) 		no annotation 5 GLN A 307
LEU A 259
LEU A 281
PHE A 272
HIS A 273
 None
 1.20A 3adxA-6cc2A:
undetectable		 3adxA-6cc2A:
13.77