SIMILAR PATTERNS OF AMINO ACIDS FOR 5XDQ_C_CHDC308_0

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.
1a0e XYLOSE ISOMERASE

(Thermotoga
neapolitana) 		PF01261
(AP_endonuc_2) 		4 PHE A 228
PHE A 262
LEU A 253
PHE A 252
 None
 1.24A 5xdqC-1a0eA:
0.0
5xdqJ-1a0eA:
0.0		 5xdqC-1a0eA:
18.69
5xdqJ-1a0eA:
9.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bc5 CHEMOTAXIS RECEPTOR
METHYLTRANSFERASE

(Salmonella
enterica) 		PF01739
(CheR)
PF03705
(CheR_N) 		4 PHE A 103
PHE A  97
LEU A 176
PHE A 185
 None
 1.20A 5xdqC-1bc5A:
undetectable
5xdqJ-1bc5A:
0.0		 5xdqC-1bc5A:
21.93
5xdqJ-1bc5A:
15.70
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.
1cpy SERINE
CARBOXYPEPTIDASE

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		4 PHE A  32
PHE A  31
LEU A  59
PHE A  63
 None
 1.29A 5xdqC-1cpyA:
0.0
5xdqJ-1cpyA:
0.0		 5xdqC-1cpyA:
19.39
5xdqJ-1cpyA:
11.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gm5 RECG

(Thermotoga
maritima) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF17190
(RecG_N)
PF17191
(RecG_wedge) 		4 PHE A 441
PHE A 361
LEU A 365
PHE A 367
 None
None
None
ADP  A1756 (-3.3A)
 1.15A 5xdqC-1gm5A:
3.1
5xdqJ-1gm5A:
0.2		 5xdqC-1gm5A:
15.64
5xdqJ-1gm5A:
5.92
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.
1gz5 ALPHA-TREHALOSE-PHOS
PHATE SYNTHASE

(Escherichia
coli) 		PF00982
(Glyco_transf_20) 		4 PHE A  97
PHE A  79
LEU A  84
PHE A  88
 None
 1.16A 5xdqC-1gz5A:
0.0
5xdqJ-1gz5A:
0.0		 5xdqC-1gz5A:
19.91
5xdqJ-1gz5A:
8.65
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.
1hbr PROTEIN (HEMOGLOBIN
D)

(Gallus gallus) 		PF00042
(Globin) 		4 PHE A 128
PHE A 125
LEU A 109
PHE A  24
 None
 1.33A 5xdqC-1hbrA:
0.8
5xdqJ-1hbrA:
0.0		 5xdqC-1hbrA:
18.99
5xdqJ-1hbrA:
17.73
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.
1kl7 THREONINE SYNTHASE

(Saccharomyces
cerevisiae) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		4 ARG A 319
PHE A 311
PHE A 376
LEU A 370
 None
 1.27A 5xdqC-1kl7A:
0.0
5xdqJ-1kl7A:
0.0		 5xdqC-1kl7A:
21.24
5xdqJ-1kl7A:
8.44
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.
1lfw PEPV

(Lactobacillus
delbrueckii) 		PF01546
(Peptidase_M20) 		4 PHE A 368
PHE A 194
LEU A 345
PHE A 335
 None
 1.30A 5xdqC-1lfwA:
0.1
5xdqJ-1lfwA:
0.0		 5xdqC-1lfwA:
19.87
5xdqJ-1lfwA:
8.01
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.
1n3p LECTIN PAL

(Pterocarpus
angolensis) 		PF00139
(Lectin_legB) 		4 PHE A  90
PHE A 215
LEU A 228
PHE A  11
 None
 1.25A 5xdqC-1n3pA:
undetectable
5xdqJ-1n3pA:
0.0		 5xdqC-1n3pA:
20.47
5xdqJ-1n3pA:
12.97
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.
1tq5 PROTEIN YHHW

(Escherichia
coli) 		PF02678
(Pirin) 		4 PHE A  34
PHE A  24
LEU A  40
PHE A 226
 None
 1.29A 5xdqC-1tq5A:
undetectable
5xdqJ-1tq5A:
undetectable		 5xdqC-1tq5A:
20.88
5xdqJ-1tq5A:
13.06
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.
1vfn PURINE-NUCLEOSIDE
PHOSPHORYLASE

(Bos taurus) 		PF01048
(PNP_UDP_1) 		4 PHE A  98
PHE A  56
LEU A  68
PHE A  70
 None
 1.05A 5xdqC-1vfnA:
0.0
5xdqJ-1vfnA:
undetectable		 5xdqC-1vfnA:
24.03
5xdqJ-1vfnA:
11.03
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.
1w93 ACETYL-COENZYME A
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ARG A 533
PHE A 490
LEU A 478
PHE A 480
 None
 1.17A 5xdqC-1w93A:
undetectable
5xdqJ-1w93A:
undetectable		 5xdqC-1w93A:
18.93
5xdqJ-1w93A:
8.16
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.
1wrj METHYLATED-DNA--PROT
EIN-CYSTEINE
METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01035
(DNA_binding_1) 		4 PHE A  11
PHE A  53
LEU A  49
PHE A  45
 None
 1.27A 5xdqC-1wrjA:
undetectable
5xdqJ-1wrjA:
undetectable		 5xdqC-1wrjA:
16.60
5xdqJ-1wrjA:
18.49
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		4 PHE A 372
PHE A 301
LEU A 432
PHE A 395
 None
 1.28A 5xdqC-1yy5A:
undetectable
5xdqJ-1yy5A:
undetectable		 5xdqC-1yy5A:
19.02
5xdqJ-1yy5A:
6.63
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.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		4 PHE A 182
PHE A 240
LEU A 242
PHE A 193
 None
 1.24A 5xdqC-2avnA:
undetectable
5xdqJ-2avnA:
undetectable		 5xdqC-2avnA:
20.28
5xdqJ-2avnA:
15.19
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.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 PHE A 363
PHE A 369
LEU A 371
PHE A 356
 None
 1.31A 5xdqC-2b39A:
undetectable
5xdqJ-2b39A:
undetectable		 5xdqC-2b39A:
9.83
5xdqJ-2b39A:
3.49
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.
2bl0 MYOSIN REGULATORY
LIGHT CHAIN

(Physarum
polycephalum) 		PF13833
(EF-hand_8) 		4 PHE C 148
PHE C 132
LEU C 113
PHE C 100
 None
 1.01A 5xdqC-2bl0C:
undetectable
5xdqJ-2bl0C:
undetectable		 5xdqC-2bl0C:
21.40
5xdqJ-2bl0C:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bru NAD(P)
TRANSHYDROGENASE
SUBUNIT ALPHA

(Escherichia
coli) 		PF01262
(AlaDh_PNT_C)
PF05222
(AlaDh_PNT_N) 		4 PHE A1242
PHE A1194
LEU A1214
PHE A1216
 None
 1.28A 5xdqC-2bruA:
undetectable
5xdqJ-2bruA:
undetectable		 5xdqC-2bruA:
22.37
5xdqJ-2bruA:
9.23
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.
2cfe ALLERGEN

(Malassezia
sympodialis) 		PF00160
(Pro_isomerase) 		4 ARG A  35
PHE A 110
PHE A 127
LEU A  22
 None
 1.30A 5xdqC-2cfeA:
undetectable
5xdqJ-2cfeA:
undetectable		 5xdqC-2cfeA:
19.17
5xdqJ-2cfeA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2czo BUD EMERGENCE
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00787
(PX) 		4 PHE A 300
PHE A 321
LEU A 396
PHE A 397
 None
 1.24A 5xdqC-2czoA:
undetectable
5xdqJ-2czoA:
undetectable		 5xdqC-2czoA:
20.61
5xdqJ-2czoA:
12.90
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.
2egr HYPOTHETICAL PROTEIN
AQ_1494

(Aquifex
aeolicus) 		PF03061
(4HBT) 		4 PHE A  87
PHE A  89
LEU A  77
PHE A   3
 None
 1.10A 5xdqC-2egrA:
undetectable
5xdqJ-2egrA:
undetectable		 5xdqC-2egrA:
18.08
5xdqJ-2egrA:
22.00
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.
2i6x HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Porphyromonas
gingivalis) 		PF13419
(HAD_2) 		4 PHE A   7
PHE A 134
LEU A 130
PHE A 123
 None
 1.19A 5xdqC-2i6xA:
undetectable
5xdqJ-2i6xA:
undetectable		 5xdqC-2i6xA:
20.30
5xdqJ-2i6xA:
16.34
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.
2ice COMPLEMENT C3 BETA
CHAIN

(Homo sapiens) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		4 PHE A 342
PHE A 348
LEU A 350
PHE A 335
 None
 1.32A 5xdqC-2iceA:
undetectable
5xdqJ-2iceA:
undetectable		 5xdqC-2iceA:
17.76
5xdqJ-2iceA:
8.41
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.
2p1n SKP1-LIKE PROTEIN 1A
TRANSPORT INHIBITOR
RESPONSE 1 PROTEIN

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		PF01466
(Skp1)
PF03931
(Skp1_POZ)
PF12937
(F-box-like) 		4 PHE A  99
PHE B   9
LEU B  14
PHE B  18
 None
 0.94A 5xdqC-2p1nA:
undetectable
5xdqJ-2p1nA:
undetectable		 5xdqC-2p1nA:
18.58
5xdqJ-2p1nA:
23.02
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.
2paj PUTATIVE
CYTOSINE/GUANINE
DEAMINASE

(unidentified) 		PF01979
(Amidohydro_1) 		4 PHE A  80
PHE A 115
LEU A 153
PHE A 164
 None
 1.15A 5xdqC-2pajA:
undetectable
5xdqJ-2pajA:
undetectable		 5xdqC-2pajA:
21.47
5xdqJ-2pajA:
8.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q03 UNCHARACTERIZED
PROTEIN

(Shewanella
denitrificans) 		PF11528
(DUF3224) 		4 PHE A 111
PHE A  83
LEU A  85
PHE A 100
 None
 1.15A 5xdqC-2q03A:
undetectable
5xdqJ-2q03A:
undetectable		 5xdqC-2q03A:
20.31
5xdqJ-2q03A:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qec HISTONE
ACETYLTRANSFERASE
HPA2 AND RELATED
ACETYLTRANSFERASES

(Corynebacterium
glutamicum) 		PF00583
(Acetyltransf_1) 		4 PHE A  24
PHE A  48
LEU A  47
PHE A 101
 None
 1.23A 5xdqC-2qecA:
undetectable
5xdqJ-2qecA:
undetectable		 5xdqC-2qecA:
20.22
5xdqJ-2qecA:
17.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2toh TYROSINE
3-MONOOXYGENASE

(Rattus
norvegicus) 		PF00351
(Biopterin_H) 		4 PHE A 348
PHE A 345
LEU A 340
PHE A 309
 None
None
None
MTY  A 300 ( 3.9A)
 1.16A 5xdqC-2tohA:
undetectable
5xdqJ-2tohA:
undetectable		 5xdqC-2tohA:
21.19
5xdqJ-2tohA:
11.14
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.
2w0i TWINFILIN-2

(Homo sapiens) 		PF00241
(Cofilin_ADF) 		4 PHE A 255
PHE A 238
LEU A 190
PHE A 287
 None
 1.08A 5xdqC-2w0iA:
undetectable
5xdqJ-2w0iA:
undetectable		 5xdqC-2w0iA:
19.83
5xdqJ-2w0iA:
20.33
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.
2xsw 72 KDA INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		4 ARG A 557
PHE A 523
LEU A 510
PHE A 480
 None
 1.18A 5xdqC-2xswA:
undetectable
5xdqJ-2xswA:
undetectable		 5xdqC-2xswA:
21.62
5xdqJ-2xswA:
10.08
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.
2xvs TETRATRICOPEPTIDE
REPEAT PROTEIN 5

(Homo sapiens) 		PF16669
(TTC5_OB) 		4 ARG A 273
PHE A 343
LEU A 345
PHE A 270
 None
 1.11A 5xdqC-2xvsA:
undetectable
5xdqJ-2xvsA:
undetectable		 5xdqC-2xvsA:
19.25
5xdqJ-2xvsA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z2r NUCLEOSOME ASSEMBLY
PROTEIN

(Saccharomyces
cerevisiae) 		PF00956
(NAP) 		4 PHE A 242
PHE A 243
LEU A 248
PHE A 316
 None
 1.33A 5xdqC-2z2rA:
undetectable
5xdqJ-2z2rA:
undetectable		 5xdqC-2z2rA:
19.03
5xdqJ-2z2rA:
12.32
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.
2zfu CEREBRAL PROTEIN 1

(Homo sapiens) 		PF05148
(Methyltransf_8) 		4 PHE A 374
PHE A 362
LEU A 388
PHE A 412
 SAH  A 900 (-4.3A)
None
None
None
 1.34A 5xdqC-2zfuA:
undetectable
5xdqJ-2zfuA:
undetectable		 5xdqC-2zfuA:
19.85
5xdqJ-2zfuA:
16.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b7y E3 UBIQUITIN-PROTEIN
LIGASE NEDD4

(Homo sapiens) 		PF00168
(C2) 		4 PHE A 109
PHE A 178
LEU A 187
PHE A 189
 None
 1.28A 5xdqC-3b7yA:
undetectable
5xdqJ-3b7yA:
undetectable		 5xdqC-3b7yA:
21.35
5xdqJ-3b7yA:
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.
3e0s UNCHARACTERIZED
PROTEIN

(Chlorobaculum
tepidum) 		PF05235
(CHAD) 		4 PHE A 424
PHE A 428
LEU A 517
PHE A 514
 None
 1.20A 5xdqC-3e0sA:
4.7
5xdqJ-3e0sA:
undetectable		 5xdqC-3e0sA:
22.84
5xdqJ-3e0sA:
10.43
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.
3erw SPORULATION
THIOL-DISULFIDE
OXIDOREDUCTASE A

(Bacillus
subtilis) 		PF00578
(AhpC-TSA) 		4 PHE A  75
PHE A 115
LEU A 113
PHE A 107
 None
 1.22A 5xdqC-3erwA:
undetectable
5xdqJ-3erwA:
undetectable		 5xdqC-3erwA:
16.48
5xdqJ-3erwA:
17.24
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.
3hf8 TRYPTOPHAN
5-HYDROXYLASE 1

(Homo sapiens) 		PF00351
(Biopterin_H) 		4 PHE A 289
PHE A 286
LEU A 281
PHE A 250
 None
 1.26A 5xdqC-3hf8A:
undetectable
5xdqJ-3hf8A:
undetectable		 5xdqC-3hf8A:
21.23
5xdqJ-3hf8A:
12.68
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.
3hrv TOXIN COREGULATED
PILIN

(Vibrio cholerae) 		PF05946
(TcpA) 		4 PHE A 150
PHE A  98
LEU A 147
PHE A 141
 None
 1.31A 5xdqC-3hrvA:
undetectable
5xdqJ-3hrvA:
undetectable		 5xdqC-3hrvA:
20.00
5xdqJ-3hrvA:
13.76
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.
3iey TRNA-SPLICING
ENDONUCLEASE
NEQ261

(Nanoarchaeum
equitans;
Nanoarchaeum
equitans) 		PF01974
(tRNA_int_endo)
PF02778
(tRNA_int_endo_N)
PF01974
(tRNA_int_endo) 		4 PHE B  83
PHE B 130
LEU B 132
PHE A 118
 None
 1.27A 5xdqC-3ieyB:
undetectable
5xdqJ-3ieyB:
undetectable		 5xdqC-3ieyB:
21.43
5xdqJ-3ieyB:
17.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k94 THIAMIN
PYROPHOSPHOKINASE

(Geobacillus
thermodenitrificans) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 PHE A 199
PHE A 164
LEU A 166
PHE A 169
 None
 1.24A 5xdqC-3k94A:
undetectable
5xdqJ-3k94A:
undetectable		 5xdqC-3k94A:
22.10
5xdqJ-3k94A:
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.
3khs PURINE NUCLEOSIDE
PHOSPHORYLASE

(Singapore
grouper
iridovirus) 		PF01048
(PNP_UDP_1) 		4 PHE A  95
PHE A  53
LEU A  65
PHE A  67
 None
 1.05A 5xdqC-3khsA:
undetectable
5xdqJ-3khsA:
undetectable		 5xdqC-3khsA:
21.71
5xdqJ-3khsA:
17.93
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.
3l9t PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.31

(Streptococcus
mutans) 		PF08713
(DNA_alkylation) 		4 PHE A  97
PHE A  94
LEU A 129
PHE A 138
 None
 1.29A 5xdqC-3l9tA:
undetectable
5xdqJ-3l9tA:
undetectable		 5xdqC-3l9tA:
18.87
5xdqJ-3l9tA:
11.98
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.
3llb UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF03471
(CorC_HlyC) 		4 PHE A  61
PHE A  63
LEU A  41
PHE A  35
 None
 1.33A 5xdqC-3llbA:
undetectable
5xdqJ-3llbA:
undetectable		 5xdqC-3llbA:
15.22
5xdqJ-3llbA:
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.
3o57 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 ARG A 331
PHE A 216
LEU A 315
PHE A 312
 None
 1.20A 5xdqC-3o57A:
1.8
5xdqJ-3o57A:
undetectable		 5xdqC-3o57A:
20.05
5xdqJ-3o57A:
8.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o7t CYCLOPHILIN A

(Moniliophthora
perniciosa) 		PF00160
(Pro_isomerase) 		4 ARG A  35
PHE A 110
PHE A 127
LEU A  22
 None
 1.32A 5xdqC-3o7tA:
undetectable
5xdqJ-3o7tA:
undetectable		 5xdqC-3o7tA:
18.39
5xdqJ-3o7tA:
16.88
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 PHE A 327
PHE A 299
LEU A 296
PHE A 294
 None
 0.92A 5xdqC-3ogrA:
undetectable
5xdqJ-3ogrA:
undetectable		 5xdqC-3ogrA:
14.48
5xdqJ-3ogrA:
4.97
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.
3oox PUTATIVE 2OG-FE(II)
OXYGENASE FAMILY
PROTEIN

(Caulobacter
vibrioides) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		4 PHE A  11
PHE A  21
LEU A  25
PHE A  29
 EDO  A 320 (-4.5A)
None
None
None
 1.01A 5xdqC-3ooxA:
undetectable
5xdqJ-3ooxA:
undetectable		 5xdqC-3ooxA:
19.64
5xdqJ-3ooxA:
12.59
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.
3pao ADENOSINE DEAMINASE

(Pseudomonas
aeruginosa) 		PF00962
(A_deaminase) 		4 PHE A 158
PHE A 162
LEU A 137
PHE A 139
 None
 1.26A 5xdqC-3paoA:
undetectable
5xdqJ-3paoA:
undetectable		 5xdqC-3paoA:
20.29
5xdqJ-3paoA:
11.41
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.
3q33 HISTONE
ACETYLTRANSFERASE
RTT109

(Saccharomyces
cerevisiae) 		PF08214
(HAT_KAT11) 		4 ARG A 318
PHE A 311
LEU A 315
PHE A 321
 None
 1.14A 5xdqC-3q33A:
undetectable
5xdqJ-3q33A:
undetectable		 5xdqC-3q33A:
19.95
5xdqJ-3q33A:
8.47
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.
3q4i PHOSPHOHYDROLASE
(MUTT/NUDIX FAMILY
PROTEIN)

(Bacillus cereus) 		PF00293
(NUDIX)
PF12535
(Nudix_N) 		4 PHE A 130
PHE A 148
LEU A  94
PHE A  83
 None
 1.02A 5xdqC-3q4iA:
3.6
5xdqJ-3q4iA:
undetectable		 5xdqC-3q4iA:
20.44
5xdqJ-3q4iA:
13.86
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.
3t66 NICKEL ABC
TRANSPORTER
(NICKEL-BINDING
PROTEIN)

(Bacillus
halodurans) 		PF00496
(SBP_bac_5) 		4 PHE A  19
PHE A 193
LEU A 173
PHE A 167
 None
 1.29A 5xdqC-3t66A:
undetectable
5xdqJ-3t66A:
undetectable		 5xdqC-3t66A:
20.72
5xdqJ-3t66A:
9.15
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.
3v44 TOLL-LIKE RECEPTOR
5B AND VARIABLE
LYMPHOCYTE RECEPTOR
B.61 CHIMERIC
PROTEIN

(Eptatretus
burgeri;
Danio rerio) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 PHE A 312
PHE A 315
LEU A 289
PHE A 250
 None
 1.08A 5xdqC-3v44A:
undetectable
5xdqJ-3v44A:
undetectable		 5xdqC-3v44A:
19.86
5xdqJ-3v44A:
10.74
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.
3vu1 PUTATIVE
UNCHARACTERIZED
PROTEIN PH0242

(Pyrococcus
horikoshii) 		no annotation 4 PHE A 567
PHE A 716
LEU A 712
PHE A 708
 None
 1.31A 5xdqC-3vu1A:
undetectable
5xdqJ-3vu1A:
undetectable		 5xdqC-3vu1A:
17.84
5xdqJ-3vu1A:
10.77
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.
3vx8 UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME ATG7

(Arabidopsis
thaliana) 		no annotation 4 PHE D  28
PHE D  24
LEU D  63
PHE D 137
 None
 1.13A 5xdqC-3vx8D:
undetectable
5xdqJ-3vx8D:
undetectable		 5xdqC-3vx8D:
17.61
5xdqJ-3vx8D:
10.86
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.
3wzf ASPARTATE
AMINOTRANSFERASE,
CYTOPLASMIC

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		4 PHE A 250
PHE A 218
LEU A 119
PHE A 118
 None
 1.27A 5xdqC-3wzfA:
undetectable
5xdqJ-3wzfA:
undetectable		 5xdqC-3wzfA:
20.62
5xdqJ-3wzfA:
9.27
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.
4f2a CHOLESTERYL ESTER
TRANSFER PROTEIN

(Homo sapiens) 		PF01273
(LBP_BPI_CETP)
PF02886
(LBP_BPI_CETP_C) 		4 PHE A 463
PHE A 461
LEU A 261
PHE A 263
 2OB  A 605 (-4.6A)
2OB  A 605 (-3.9A)
0SF  A 610 ( 4.3A)
0SF  A 610 ( 4.1A)
 1.24A 5xdqC-4f2aA:
undetectable
5xdqJ-4f2aA:
undetectable		 5xdqC-4f2aA:
19.43
5xdqJ-4f2aA:
13.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j72 PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

(Aquifex
aeolicus) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		4 PHE A 180
PHE A 177
LEU A 158
PHE A 160
 None
 0.95A 5xdqC-4j72A:
undetectable
5xdqJ-4j72A:
undetectable		 5xdqC-4j72A:
22.37
5xdqJ-4j72A:
11.15
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.
4k0x BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 PHE A 180
PHE A 152
LEU A 170
PHE A 164
 None
 1.32A 5xdqC-4k0xA:
undetectable
5xdqJ-4k0xA:
undetectable		 5xdqC-4k0xA:
19.42
5xdqJ-4k0xA:
15.74
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.
4n5c CARGO-TRANSPORT
PROTEIN YPP1

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A 245
PHE A 269
LEU A 273
PHE A 277
 None
 1.08A 5xdqC-4n5cA:
undetectable
5xdqJ-4n5cA:
undetectable		 5xdqC-4n5cA:
14.04
5xdqJ-4n5cA:
6.32
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 ARG A2532
PHE A2556
LEU A2552
PHE A2548
 None
 1.33A 5xdqC-4rh7A:
undetectable
5xdqJ-4rh7A:
undetectable		 5xdqC-4rh7A:
6.13
5xdqJ-4rh7A:
3.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ud4 POLY(A) RNA
POLYMERASE PROTEIN
CID1

(Schizosaccharomyces
pombe) 		PF01909
(NTP_transf_2)
PF03828
(PAP_assoc) 		4 PHE A 153
PHE A 130
LEU A 125
PHE A 121
 None
 1.07A 5xdqC-4ud4A:
undetectable
5xdqJ-4ud4A:
undetectable		 5xdqC-4ud4A:
19.95
5xdqJ-4ud4A:
10.26
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.
4v06 TRYPTOPHAN
5-HYDROXYLASE 2

(Homo sapiens) 		PF00351
(Biopterin_H) 		4 PHE A 335
PHE A 332
LEU A 327
PHE A 296
 None
None
None
IMD  A 600 (-4.7A)
 1.28A 5xdqC-4v06A:
undetectable
5xdqJ-4v06A:
undetectable		 5xdqC-4v06A:
21.41
5xdqJ-4v06A:
11.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wpx CELL DIVISION
CONTROL PROTEIN
31-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF00036
(EF-hand_1)
PF13499
(EF-hand_7) 		4 ARG A  27
PHE A  50
PHE A  35
LEU A  34
 None
 1.03A 5xdqC-4wpxA:
undetectable
5xdqJ-4wpxA:
undetectable		 5xdqC-4wpxA:
21.84
5xdqJ-4wpxA:
14.12
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.
4wzi CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 ARG A 503
PHE A 388
LEU A 487
PHE A 484
 IOD  A 805 (-4.3A)
None
None
IOD  A 805 ( 4.9A)
 1.24A 5xdqC-4wziA:
undetectable
5xdqJ-4wziA:
undetectable		 5xdqC-4wziA:
16.59
5xdqJ-4wziA:
6.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x8q UNCHARACTERIZED
PROTEIN

(Streptococcus
mutans) 		PF08713
(DNA_alkylation) 		4 PHE A  97
PHE A  94
LEU A 129
PHE A 138
 None
 1.30A 5xdqC-4x8qA:
undetectable
5xdqJ-4x8qA:
undetectable		 5xdqC-4x8qA:
18.15
5xdqJ-4x8qA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER

(Drosophila
melanogaster) 		PF00209
(SNF) 		4 PHE A 489
PHE A 106
LEU A 105
PHE A 590
 None
 1.03A 5xdqC-4xnuA:
1.6
5xdqJ-4xnuA:
undetectable		 5xdqC-4xnuA:
20.59
5xdqJ-4xnuA:
7.52
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		4 PHE A 159
PHE A 184
LEU A 163
PHE A 192
 None
 1.30A 5xdqC-4z64A:
undetectable
5xdqJ-4z64A:
undetectable		 5xdqC-4z64A:
17.27
5xdqJ-4z64A:
7.30
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		4 PHE A 328
PHE A 352
LEU A 332
PHE A 360
 None
 1.29A 5xdqC-4z64A:
undetectable
5xdqJ-4z64A:
undetectable		 5xdqC-4z64A:
17.27
5xdqJ-4z64A:
7.30
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.
5aff RIBOSOMAL PROTEIN
L11

(Chaetomium
thermophilum) 		PF00281
(Ribosomal_L5)
PF00673
(Ribosomal_L5_C) 		4 PHE C 128
PHE C 105
LEU C  92
PHE C 163
 None
 1.23A 5xdqC-5affC:
undetectable
5xdqJ-5affC:
undetectable		 5xdqC-5affC:
19.03
5xdqJ-5affC:
16.36
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.
5aza MALTOSE-BINDING
PERIPLASMIC
PROTEIN,OLIGOSACCHAR
YL TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Escherichia
coli;
Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		4 PHE A 463
PHE A 608
LEU A 604
PHE A 600
 None
 1.26A 5xdqC-5azaA:
undetectable
5xdqJ-5azaA:
undetectable		 5xdqC-5azaA:
13.40
5xdqJ-5azaA:
5.07
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.
5b4s CHITOSANASE

(Mitsuaria
chitosanitabida) 		PF13647
(Glyco_hydro_80) 		4 PHE A  93
PHE A  85
LEU A 130
PHE A 123
 None
 0.76A 5xdqC-5b4sA:
undetectable
5xdqJ-5b4sA:
undetectable		 5xdqC-5b4sA:
22.65
5xdqJ-5b4sA:
12.85
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.
5czw MYROILYSIN

(Myroides
profundi) 		PF01400
(Astacin) 		4 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.18A 5xdqC-5czwA:
undetectable
5xdqJ-5czwA:
undetectable		 5xdqC-5czwA:
21.15
5xdqJ-5czwA:
18.08
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.
5czw MYROILYSIN

(Myroides
profundi) 		PF01400
(Astacin) 		4 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 0.98A 5xdqC-5czwA:
undetectable
5xdqJ-5czwA:
undetectable		 5xdqC-5czwA:
21.15
5xdqJ-5czwA:
18.08
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.
5e8y TGF-BETA RECEPTOR
TYPE-2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 PHE A 255
PHE A 279
LEU A 323
PHE A 294
 None
 1.15A 5xdqC-5e8yA:
2.0
5xdqJ-5e8yA:
undetectable		 5xdqC-5e8yA:
20.43
5xdqJ-5e8yA:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ejj UFM1-SPECIFIC
PROTEASE

(Caenorhabditis
elegans) 		PF07910
(Peptidase_C78) 		4 ARG A 277
PHE A  47
PHE A  49
LEU A  80
 None
 1.26A 5xdqC-5ejjA:
undetectable
5xdqJ-5ejjA:
undetectable		 5xdqC-5ejjA:
20.36
5xdqJ-5ejjA:
7.83
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.
5f8v AMINOTRANSFERASE,
CLASS V FAMILY
PROTEIN

(Trichomonas
vaginalis) 		PF00266
(Aminotran_5) 		4 PHE A 327
PHE A 324
LEU A 336
PHE A   9
 None
 1.27A 5xdqC-5f8vA:
undetectable
5xdqJ-5f8vA:
undetectable		 5xdqC-5f8vA:
21.27
5xdqJ-5f8vA:
10.51
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.
5huu ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
[UDP-FORMING]

(Candida
albicans) 		PF00982
(Glyco_transf_20) 		4 PHE A 110
PHE A  92
LEU A  97
PHE A 101
 None
 1.34A 5xdqC-5huuA:
undetectable
5xdqJ-5huuA:
undetectable		 5xdqC-5huuA:
19.58
5xdqJ-5huuA:
9.19
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.
5huu ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
[UDP-FORMING]

(Candida
albicans) 		PF00982
(Glyco_transf_20) 		4 PHE A 174
PHE A 101
LEU A  97
PHE A  92
 None
 1.03A 5xdqC-5huuA:
undetectable
5xdqJ-5huuA:
undetectable		 5xdqC-5huuA:
19.58
5xdqJ-5huuA:
9.19
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.
5hvm ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Aspergillus
fumigatus) 		PF00982
(Glyco_transf_20) 		4 PHE A 118
PHE A 100
LEU A 105
PHE A 109
 None
 1.26A 5xdqC-5hvmA:
undetectable
5xdqJ-5hvmA:
undetectable		 5xdqC-5hvmA:
18.38
5xdqJ-5hvmA:
8.18
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.
5iy2 BETA-LACTAMASE
OXA-143

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 PHE A 182
PHE A 154
LEU A 172
PHE A 166
 None
 1.29A 5xdqC-5iy2A:
undetectable
5xdqJ-5iy2A:
undetectable		 5xdqC-5iy2A:
18.01
5xdqJ-5iy2A:
12.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5iy5 CYTOCHROME C OXIDASE
SUBUNIT 3

(Bos taurus) 		PF00510
(COX3) 		4 ARG C 156
PHE C 164
PHE C 219
LEU C 223
 CHD  C 307 (-4.0A)
CHD  C 307 (-3.9A)
None
None
 0.12A 5xdqC-5iy5C:
37.6
5xdqJ-5iy5C:
undetectable		 5xdqC-5iy5C:
100.00
5xdqJ-5iy5C:
10.36
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.
5j36 BEAK AND FEATHER
DISEASE VIRUS CAPSID
PROTEIN

(Beak and
feather disease
virus) 		no annotation 4 PHE E  58
PHE E  56
LEU E 231
PHE E  79
 None
 1.32A 5xdqC-5j36E:
undetectable
5xdqJ-5j36E:
undetectable		 5xdqC-5j36E:
21.11
5xdqJ-5j36E:
12.08
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.
5jk6 PHENYLALANINE-4-HYDR
OXYLASE

(Dictyostelium
discoideum) 		PF00351
(Biopterin_H) 		4 PHE A 290
PHE A 287
LEU A 282
PHE A 251
 None
 1.21A 5xdqC-5jk6A:
undetectable
5xdqJ-5jk6A:
undetectable		 5xdqC-5jk6A:
18.65
5xdqJ-5jk6A:
11.45
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.
5kdm MAJOR TEGUMENT
PROTEIN

(Human
gammaherpesvirus
4) 		PF12818
(Tegument_dsDNA) 		4 PHE D 500
PHE D 553
LEU D 551
PHE D 578
 None
 1.12A 5xdqC-5kdmD:
undetectable
5xdqJ-5kdmD:
undetectable		 5xdqC-5kdmD:
21.64
5xdqJ-5kdmD:
13.70
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.
5l01 TRYPTOPHAN
5-HYDROXYLASE 1

(Homo sapiens) 		PF00351
(Biopterin_H) 		4 PHE A 289
PHE A 286
LEU A 281
PHE A 250
 None
 1.25A 5xdqC-5l01A:
undetectable
5xdqJ-5l01A:
undetectable		 5xdqC-5l01A:
19.02
5xdqJ-5l01A:
11.42
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.
5mjs TUBULIN BETA CHAIN

(Schizosaccharomyces
pombe) 		no annotation 4 ARG A 379
PHE A 264
PHE A 377
LEU A 380
 None
 1.30A 5xdqC-5mjsA:
undetectable
5xdqJ-5mjsA:
undetectable		 5xdqC-5mjsA:
undetectable
5xdqJ-5mjsA:
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.
5o84 GLUTATHIONE
S-TRANSFERASE U23

(Arabidopsis
thaliana) 		no annotation 4 PHE A 160
PHE A 157
LEU A 182
PHE A 179
 OMT  A  14 ( 3.8A)
None
None
None
 1.34A 5xdqC-5o84A:
undetectable
5xdqJ-5o84A:
undetectable		 5xdqC-5o84A:
17.56
5xdqJ-5o84A:
16.51
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.
5oen INTERFERON
REGULATORY FACTOR 9

(Mus musculus) 		no annotation 4 PHE A 339
PHE A 322
LEU A 326
PHE A 330
 None
 0.75A 5xdqC-5oenA:
undetectable
5xdqJ-5oenA:
undetectable		 5xdqC-5oenA:
undetectable
5xdqJ-5oenA:
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.
5owg PCYX_EBK42635

(marine
metagenome) 		no annotation 4 ARG A  51
PHE A 218
LEU A 223
PHE A 224
 None
 1.23A 5xdqC-5owgA:
undetectable
5xdqJ-5owgA:
undetectable		 5xdqC-5owgA:
21.13
5xdqJ-5owgA:
15.69
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.
5ted LMO0488 PROTEIN

(Listeria
monocytogenes) 		no annotation 4 PHE B 287
PHE B 284
LEU B  95
PHE B  97
 None
 1.00A 5xdqC-5tedB:
undetectable
5xdqJ-5tedB:
undetectable		 5xdqC-5tedB:
20.60
5xdqJ-5tedB:
12.39
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.
5tvg ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Burkholderia
vietnamiensis) 		PF00982
(Glyco_transf_20) 		4 PHE A  99
PHE A  81
LEU A  86
PHE A  90
 None
 1.27A 5xdqC-5tvgA:
undetectable
5xdqJ-5tvgA:
undetectable		 5xdqC-5tvgA:
19.11
5xdqJ-5tvgA:
8.23
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.
5ugf PURINE NUCLEOSIDE
PHOSPHORYLASE

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		4 PHE A  98
PHE A  56
LEU A  68
PHE A  70
 None
 1.13A 5xdqC-5ugfA:
undetectable
5xdqJ-5ugfA:
undetectable		 5xdqC-5ugfA:
24.48
5xdqJ-5ugfA:
11.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Paraburkholderia
xenovorans) 		PF00982
(Glyco_transf_20) 		4 PHE A 167
PHE A  98
LEU A  94
PHE A  89
 None
 0.94A 5xdqC-5v0tA:
undetectable
5xdqJ-5v0tA:
undetectable		 5xdqC-5v0tA:
20.08
5xdqJ-5v0tA:
5.97
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.
5vfd BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 PHE A 182
PHE A 154
LEU A 172
PHE A 166
 None
 1.33A 5xdqC-5vfdA:
undetectable
5xdqJ-5vfdA:
undetectable		 5xdqC-5vfdA:
18.37
5xdqJ-5vfdA:
14.35
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.
5voc ENVELOPE
GLYCOPROTEIN H
ENVELOPE
GLYCOPROTEIN L

(Human
betaherpesvirus
5;
Human
betaherpesvirus
5) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C)
PF01801
(Cytomega_gL) 		4 PHE A  90
PHE A  80
LEU B 183
PHE B 222
 None
 1.10A 5xdqC-5vocA:
2.7
5xdqJ-5vocA:
undetectable		 5xdqC-5vocA:
15.48
5xdqJ-5vocA:
6.92
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.
5xwu LEUCINE-RICH REPEAT
AND FIBRONECTIN TYPE
III
DOMAIN-CONTAINING
PROTEIN 1

(Mus musculus) 		no annotation 4 PHE B 157
PHE B 160
LEU B 136
PHE B 109
 None
 1.01A 5xdqC-5xwuB:
undetectable
5xdqJ-5xwuB:
undetectable		 5xdqC-5xwuB:
undetectable
5xdqJ-5xwuB:
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.
6bpq TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY M
MEMBER 8

(Ficedula
albicollis) 		no annotation 4 ARG A 841
PHE A 752
PHE A 748
LEU A 778
 None
 1.34A 5xdqC-6bpqA:
7.0
5xdqJ-6bpqA:
undetectable		 5xdqC-6bpqA:
undetectable
5xdqJ-6bpqA:
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.
6bxa TOLL-LIKE RECEPTOR
5B, VARIABLE
LYMPHOCYTE RECEPTOR
B CHIMERA

(Eptatretus
burgeri;
Danio rerio) 		no annotation 4 PHE A 312
PHE A 315
LEU A 289
PHE A 250
 None
 1.12A 5xdqC-6bxaA:
undetectable
5xdqJ-6bxaA:
undetectable		 5xdqC-6bxaA:
undetectable
5xdqJ-6bxaA:
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.
6c08 SODIUM-COUPLED
NEUTRAL AMINO ACID
TRANSPORTER 9

(Danio rerio) 		no annotation 4 ARG C 155
PHE C 507
LEU C 535
PHE C 531
 None
 1.12A 5xdqC-6c08C:
3.9
5xdqJ-6c08C:
undetectable		 5xdqC-6c08C:
undetectable
5xdqJ-6c08C:
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.
6ez8 HUNTINGTIN

(Homo sapiens) 		no annotation 4 PHE A3094
PHE A3056
LEU A3052
PHE A3039
 None
 1.28A 5xdqC-6ez8A:
undetectable
5xdqJ-6ez8A:
undetectable		 5xdqC-6ez8A:
undetectable
5xdqJ-6ez8A:
undetectable