SIMILAR PATTERNS OF AMINO ACIDS FOR 2YGN_A_ACTA1181

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.
1am5 PEPSIN

(Gadus morhua) 		PF00026
(Asp) 		3 TYR A 310
VAL A 170
THR A 311
 None
 0.83A 2ygnA-1am5A:
undetectable		 2ygnA-1am5A:
18.07
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.
1dpp DIPEPTIDE BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		3 TYR A 389
VAL A 401
THR A 383
 None
 0.74A 2ygnA-1dppA:
0.2		 2ygnA-1dppA:
16.20
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.
1dxj CLASS II CHITINASE

(Canavalia
ensiformis) 		PF00182
(Glyco_hydro_19) 		3 TYR A 124
VAL A 142
THR A 119
 None
 0.57A 2ygnA-1dxjA:
undetectable		 2ygnA-1dxjA:
19.68
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.
1g84 IMMUNOGLOBULIN E

(Homo sapiens) 		PF07654
(C1-set) 		3 TYR A  92
VAL A  32
THR A  96
 None
 0.74A 2ygnA-1g84A:
1.9		 2ygnA-1g84A:
20.26
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.
1i1q ANTHRANILATE
SYNTHASE COMPONENT I

(Salmonella
enterica) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		3 TYR A 173
VAL A 123
THR A  62
 None
 0.73A 2ygnA-1i1qA:
undetectable		 2ygnA-1i1qA:
14.56
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.
1iq4 50S RIBOSOMAL
PROTEIN L5

(Geobacillus
stearothermophilus) 		PF00281
(Ribosomal_L5)
PF00673
(Ribosomal_L5_C) 		3 TYR A 128
VAL A 117
THR A 129
 None
 0.58A 2ygnA-1iq4A:
undetectable		 2ygnA-1iq4A:
20.43
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.
1iug PUTATIVE ASPARTATE
AMINOTRANSFERASE

(Thermus
thermophilus) 		PF00266
(Aminotran_5) 		3 TYR A  83
VAL A 128
THR A 111
 None
 0.80A 2ygnA-1iugA:
undetectable		 2ygnA-1iugA:
17.00
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.
1jqi SHORT CHAIN ACYL-COA
DEHYDROGENASE

(Rattus
norvegicus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 TYR A 367
VAL A  90
THR A 364
 CAA  A 400 (-3.8A)
None
None
 0.70A 2ygnA-1jqiA:
undetectable		 2ygnA-1jqiA:
17.74
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.
1poy SPERMIDINE/PUTRESCIN
E-BINDING PROTEIN

(Escherichia
coli) 		PF13416
(SBP_bac_8) 		3 TYR 1  59
VAL 1  80
THR 1  58
 None
 0.84A 2ygnA-1poy1:
undetectable		 2ygnA-1poy1:
18.52
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.
1r0v TRNA-INTRON
ENDONUCLEASE

(Archaeoglobus
fulgidus) 		PF01974
(tRNA_int_endo)
PF02778
(tRNA_int_endo_N) 		3 TYR A 130
VAL A  69
THR A 129
 None
 0.82A 2ygnA-1r0vA:
0.0		 2ygnA-1r0vA:
20.66
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.
1r8g HYPOTHETICAL PROTEIN
YBDK

(Escherichia
coli) 		PF04107
(GCS2) 		3 TYR A 170
VAL A 352
THR A 174
 None
 0.82A 2ygnA-1r8gA:
undetectable		 2ygnA-1r8gA:
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.
1rzg FAB 412D LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TYR A  32
VAL A   2
THR A  28
 None
 0.89A 2ygnA-1rzgA:
undetectable		 2ygnA-1rzgA:
20.82
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.
1wd3 ALPHA-L-ARABINOFURAN
OSIDASE B

(Aspergillus
kawachii) 		PF05270
(AbfB)
PF09206
(ArabFuran-catal) 		3 TYR A 146
VAL A 138
THR A  89
 None
 0.77A 2ygnA-1wd3A:
undetectable		 2ygnA-1wd3A:
14.97
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.
1xvs PROTEIN APAG

(Vibrio cholerae) 		PF04379
(DUF525) 		3 TYR A  81
VAL A  68
THR A  82
 None
 0.81A 2ygnA-1xvsA:
4.8		 2ygnA-1xvsA:
24.00
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.
1y0y FRV OPERON PROTEIN
FRVX

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		3 TYR A 188
VAL A   7
THR A 189
 None
 0.86A 2ygnA-1y0yA:
undetectable		 2ygnA-1y0yA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2av9 THIOESTERASE

(Pseudomonas
aeruginosa) 		PF03061
(4HBT) 		3 TYR A  36
VAL A  76
THR A  35
 None
 0.69A 2ygnA-2av9A:
undetectable		 2ygnA-2av9A:
18.35
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.
2c2v STIP1 HOMOLOGY AND U
BOX-CONTAINING
PROTEIN 1

(Mus musculus) 		PF04564
(U-box) 		3 TYR S 253
VAL S 271
THR S 252
 None
 0.88A 2ygnA-2c2vS:
undetectable		 2ygnA-2c2vS:
17.65
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.
2dhz RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR (GEF)-LIKE 1

(Homo sapiens) 		no annotation 3 TYR A  21
VAL A 107
THR A  23
 None
 0.82A 2ygnA-2dhzA:
undetectable		 2ygnA-2dhzA:
20.13
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.
2gaf POLY(A) POLYMERASE
CATALYTIC SUBUNIT

(Vaccinia virus) 		PF03296
(Pox_polyA_pol)
PF12629
(Pox_polyA_pol_C)
PF12630
(Pox_polyA_pol_N) 		3 TYR D 108
VAL D  56
THR D 109
 None
 0.88A 2ygnA-2gafD:
undetectable		 2ygnA-2gafD:
13.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		3 TYR A  54
VAL A  66
THR A 270
 None
 0.79A 2ygnA-2hnhA:
undetectable		 2ygnA-2hnhA:
10.02
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.
2olt HYPOTHETICAL PROTEIN

(Shewanella
oneidensis) 		PF01865
(PhoU_div) 		3 TYR A 124
VAL A 205
THR A 172
 None
 0.79A 2ygnA-2oltA:
undetectable		 2ygnA-2oltA:
18.42
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.
2qvs CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-ALPHA REGULATORY
SUBUNIT

(Mus musculus) 		PF00027
(cNMP_binding) 		3 TYR B 180
VAL B 156
THR B 179
 TYR  B 180 ( 1.3A)
VAL  B 156 ( 0.6A)
THR  B 179 ( 0.8A)
 0.80A 2ygnA-2qvsB:
undetectable		 2ygnA-2qvsB:
18.21
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.
2vda TRANSLOCASE SUBUNIT
SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		3 TYR A 326
VAL A 357
THR A 321
 None
 0.87A 2ygnA-2vdaA:
undetectable		 2ygnA-2vdaA:
10.41
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.
2vsa MOSQUITOCIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		3 TYR A 349
VAL A 296
THR A 388
 None
 0.69A 2ygnA-2vsaA:
undetectable		 2ygnA-2vsaA:
10.71
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.
2wfg CYTOSOLIC
LEUCYL-TRNA
SYNTHETASE

(Candida
albicans) 		PF00133
(tRNA-synt_1) 		3 TYR A 336
VAL A 330
THR A 349
 None
 0.77A 2ygnA-2wfgA:
undetectable		 2ygnA-2wfgA:
23.68
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.
2wn2 DISCOIDIN-1 SUBUNIT
A

(Dictyostelium
discoideum) 		PF00754
(F5_F8_type_C)
PF09458
(H_lectin) 		3 TYR A  89
VAL A  74
THR A 110
 None
None
GOL  A 500 (-4.0A)
 0.87A 2ygnA-2wn2A:
undetectable		 2ygnA-2wn2A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x46 ALLERGEN ARG R 1

(Argas reflexus) 		PF02098
(His_binding) 		3 TYR A  69
VAL A  94
THR A  82
 None
 0.83A 2ygnA-2x46A:
undetectable		 2ygnA-2x46A:
17.90
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.
2xtl CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF16569
(GramPos_pilinBB)
PF16570
(GramPos_pilinD3) 		3 TYR A 273
VAL A 261
THR A 271
 None
 0.85A 2ygnA-2xtlA:
2.9		 2ygnA-2xtlA:
15.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ygn WNT INHIBITORY
FACTOR 1

(Homo sapiens) 		PF02019
(WIF) 		3 TYR A 101
VAL A 121
THR A 126
 None
ACT  A1181 ( 4.4A)
ACT  A1181 (-4.8A)
 0.17A 2ygnA-2ygnA:
29.7		 2ygnA-2ygnA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ygo WNT INHIBITORY
FACTOR 1

(Homo sapiens) 		PF02019
(WIF) 		3 TYR A 101
VAL A 121
THR A 126
 None
 0.10A 2ygnA-2ygoA:
28.2		 2ygnA-2ygoA:
82.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ygq WNT INHIBITORY
FACTOR 1

(Homo sapiens) 		PF02019
(WIF)
PF12661
(hEGF) 		3 TYR A 101
VAL A 121
THR A 126
 None
 0.30A 2ygnA-2ygqA:
26.1		 2ygnA-2ygqA:
48.15
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.
2zmf CAMP AND
CAMP-INHIBITED CGMP
3',5'-CYCLIC
PHOSPHODIESTERASE
10A

(Homo sapiens) 		PF01590
(GAF) 		3 TYR A 362
VAL A 385
THR A 363
 CMP  A2001 ( 4.3A)
None
None
 0.75A 2ygnA-2zmfA:
undetectable		 2ygnA-2zmfA:
21.08
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.
2zyz PUTATIVE
UNCHARACTERIZED
PROTEIN PAE0789

(Pyrobaculum
aerophilum) 		no annotation 3 TYR A  79
VAL A   8
THR A  78
 None
 0.77A 2ygnA-2zyzA:
undetectable		 2ygnA-2zyzA:
21.92
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.
3a55 PROTEIN-GLUTAMINASE

(Chryseobacterium
proteolyticum) 		no annotation 3 TYR A 157
VAL A 276
THR A  46
 None
 0.83A 2ygnA-3a55A:
undetectable		 2ygnA-3a55A:
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.
3ajv PUTATIVE
UNCHARACTERIZED
PROTEIN

(Aeropyrum
pernix) 		PF01974
(tRNA_int_endo) 		3 TYR A 160
VAL A  88
THR A 159
 GOL  A 172 (-4.7A)
None
None
 0.77A 2ygnA-3ajvA:
undetectable		 2ygnA-3ajvA:
20.71
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.
3aoe GLUTAMATE
DEHYDROGENASE

(Thermus
thermophilus) 		no annotation 3 TYR E  38
VAL E 417
THR E  35
 LEU  E 500 (-4.4A)
LEU  E 500 (-3.8A)
None
 0.78A 2ygnA-3aoeE:
undetectable		 2ygnA-3aoeE:
17.39
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.
3bb7 INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		3 TYR A 235
VAL A 229
THR A 152
 None
 0.83A 2ygnA-3bb7A:
undetectable		 2ygnA-3bb7A:
19.56
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.
3bba INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10) 		3 TYR A 235
VAL A 229
THR A 152
 None
 0.80A 2ygnA-3bbaA:
undetectable		 2ygnA-3bbaA:
20.66
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.
3dkh LACCASE-1

(Melanocarpus
albomyces) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 TYR A 416
VAL A 346
THR A 415
 None
 0.68A 2ygnA-3dkhA:
2.0		 2ygnA-3dkhA:
14.37
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.
3j4j TRANSLATION
INITIATION FACTOR
IF-2

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF04760
(IF2_N)
PF11987
(IF-2) 		3 TYR A  92
VAL A 223
THR A 219
 None
 0.90A 2ygnA-3j4jA:
undetectable		 2ygnA-3j4jA:
13.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j4r CAMP-DEPENDENT
PROTEIN KINASE TYPE
II-ALPHA REGULATORY
SUBUNIT

(Mus musculus) 		PF00027
(cNMP_binding)
PF02197
(RIIa) 		3 TYR B 182
VAL B 158
THR B 181
 None
 0.79A 2ygnA-3j4rB:
undetectable		 2ygnA-3j4rB:
15.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jci CAPSID PROTEIN

(Porcine
circovirus 2) 		PF02443
(Circo_capsid) 		3 TYR A 141
VAL A 130
THR A 200
 None
 0.63A 2ygnA-3jciA:
undetectable		 2ygnA-3jciA:
18.87
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.
3jrq PUTATIVE
UNCHARACTERIZED
PROTEIN AT5G46790

(Arabidopsis
thaliana) 		PF10604
(Polyketide_cyc2) 		3 TYR B  50
VAL B 150
THR B  49
 None
 0.81A 2ygnA-3jrqB:
undetectable		 2ygnA-3jrqB:
21.32
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.
3n0w ABC BRANCHED CHAIN
AMINO ACID FAMILY
TRANSPORTER,
PERIPLASMIC LIGAND
BINDING PROTEIN

(Paraburkholderia
xenovorans) 		PF13458
(Peripla_BP_6) 		3 TYR A  74
VAL A 101
THR A  78
 None
 0.52A 2ygnA-3n0wA:
undetectable		 2ygnA-3n0wA:
15.45
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.
3ngo CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		3 TYR A 422
VAL A 379
THR A 461
 None
 0.53A 2ygnA-3ngoA:
undetectable		 2ygnA-3ngoA:
18.07
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.
3nvn PLEXIN-C1

(Homo sapiens) 		PF01437
(PSI) 		3 TYR B 183
VAL B 179
THR B 182
 None
 0.86A 2ygnA-3nvnB:
undetectable		 2ygnA-3nvnB:
14.19
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.
3p1z PUTATIVE
UNCHARACTERIZED
PROTEIN

(Aeropyrum
pernix) 		PF01974
(tRNA_int_endo) 		3 TYR A 160
VAL A  88
THR A 159
 None
 0.76A 2ygnA-3p1zA:
undetectable		 2ygnA-3p1zA:
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.
3r0r PORCINE CIRCOVIRUS 2
(PCV2) CAPSID
PROTEIN

(Porcine
circovirus 2) 		PF02443
(Circo_capsid) 		3 TYR A 136
VAL A 125
THR A 195
 None
 0.61A 2ygnA-3r0rA:
undetectable		 2ygnA-3r0rA:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rl3 METALLOPHOSPHOESTERA
SE MPPED2

(Rattus
norvegicus) 		PF00149
(Metallophos) 		3 TYR A 267
VAL A 239
THR A 266
 None
 0.90A 2ygnA-3rl3A:
undetectable		 2ygnA-3rl3A:
17.85
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.
3saj GLUTAMATE RECEPTOR 1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		3 TYR A 167
VAL A 157
THR A 163
 None
 0.89A 2ygnA-3sajA:
undetectable		 2ygnA-3sajA:
17.49
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.
3shs HOC HEAD OUTER
CAPSID PROTEIN

(Escherichia
virus RB49) 		no annotation 3 TYR A 206
VAL A 186
THR A 294
 None
 0.88A 2ygnA-3shsA:
undetectable		 2ygnA-3shsA:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t05 PYRUVATE KINASE

(Staphylococcus
aureus) 		PF00224
(PK)
PF00391
(PEP-utilizers)
PF02887
(PK_C) 		3 TYR A 391
VAL A 351
THR A 387
 None
 0.90A 2ygnA-3t05A:
undetectable		 2ygnA-3t05A:
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.
3tov GLYCOSYL TRANSFERASE
FAMILY 9

(Veillonella
parvula) 		PF01075
(Glyco_transf_9) 		3 TYR A  40
VAL A  19
THR A  11
 None
 0.68A 2ygnA-3tovA:
undetectable		 2ygnA-3tovA:
17.89
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.
3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE

(Coxiella
burnetii) 		PF00155
(Aminotran_1_2) 		3 TYR A 251
VAL A 213
THR A 237
 None
 0.78A 2ygnA-3tqxA:
undetectable		 2ygnA-3tqxA:
15.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tzu GLYCINE CLEAVAGE
SYSTEM H PROTEIN 1

(Mycobacterium
marinum) 		PF01597
(GCV_H) 		3 TYR A 126
VAL A  39
THR A  13
 None
 0.73A 2ygnA-3tzuA:
undetectable		 2ygnA-3tzuA:
19.88
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.
3w3e COTYLEDONEOUS
YIELDIN-LIKE PROTEIN

(Vigna
unguiculata) 		PF00182
(Glyco_hydro_19) 		3 TYR A 124
VAL A 142
THR A 119
 None
 0.56A 2ygnA-3w3eA:
undetectable		 2ygnA-3w3eA:
20.90
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.
3zc4 SSO1398

(Sulfolobus
solfataricus) 		no annotation 3 TYR A 107
VAL A 122
THR A 105
 None
 0.61A 2ygnA-3zc4A:
undetectable		 2ygnA-3zc4A:
24.16
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.
3zyv AOX3

(Mus musculus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		3 TYR A 659
VAL A 819
THR A 643
 None
 0.73A 2ygnA-3zyvA:
undetectable		 2ygnA-3zyvA:
8.06
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.
4cdp PUTATIVE
HEME/HEMOGLOBIN
TRANSPORT PROTEIN

(Escherichia
coli) 		PF05171
(HemS) 		3 TYR A 315
VAL A 192
THR A 299
 HEM  A 402 (-3.8A)
HEM  A 402 (-4.6A)
None
 0.65A 2ygnA-4cdpA:
undetectable		 2ygnA-4cdpA:
19.44
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.
4ex5 LYSINE--TRNA LIGASE

(Burkholderia
thailandensis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		3 TYR A 109
VAL A  79
THR A 100
 None
 0.74A 2ygnA-4ex5A:
undetectable		 2ygnA-4ex5A:
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.
4fdw LEUCINE RICH
HYPOTHETICAL PROTEIN

(Bacteroides
ovatus) 		PF07523
(Big_3)
PF13306
(LRR_5) 		3 TYR A 412
VAL A 379
THR A 383
 None
 0.76A 2ygnA-4fdwA:
undetectable		 2ygnA-4fdwA:
16.80
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.
4fzn BACTERIOCIN

(Pseudomonas
syringae group
genomosp. 3) 		PF14859
(Colicin_M) 		3 TYR A   9
VAL A 126
THR A  11
 None
 0.75A 2ygnA-4fznA:
undetectable		 2ygnA-4fznA:
21.48
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.
4glw DNA LIGASE

(Streptococcus
pneumoniae) 		PF01653
(DNA_ligase_aden) 		3 TYR A 104
VAL A  95
THR A 103
 None
 0.88A 2ygnA-4glwA:
undetectable		 2ygnA-4glwA:
21.09
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.
4hcy THIAMINASE-I

(Naegleria
gruberi) 		no annotation 3 TYR A  47
VAL A 281
THR A  38
 None
 0.89A 2ygnA-4hcyA:
undetectable		 2ygnA-4hcyA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hes BETA-LACTAMASE CLASS
A-LIKE PROTEIN

(Veillonella
parvula) 		PF13354
(Beta-lactamase2) 		3 TYR A 106
VAL A 128
THR A  80
 None
 0.83A 2ygnA-4hesA:
undetectable		 2ygnA-4hesA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iyp IMMUNOGLOBULIN-BINDI
NG PROTEIN 1

(Homo sapiens) 		PF04177
(TAP42) 		3 TYR A 193
VAL A 179
THR A  74
 None
 0.73A 2ygnA-4iypA:
undetectable		 2ygnA-4iypA:
17.35
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.
4jtm TYPE II SECRETION
SYSTEM PROTEIN D

(Escherichia
coli) 		no annotation 3 TYR A  52
VAL A  21
THR A   6
 None
 0.72A 2ygnA-4jtmA:
undetectable		 2ygnA-4jtmA:
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.
4l0m PUTATIVE
5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Borreliella
burgdorferi) 		PF01048
(PNP_UDP_1) 		3 TYR A 103
VAL A 159
THR A 154
 None
ADE  A 301 (-4.0A)
None
 0.44A 2ygnA-4l0mA:
undetectable		 2ygnA-4l0mA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l3r UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		PF16139
(DUF4847) 		3 TYR A 147
VAL A  32
THR A 118
 None
 0.82A 2ygnA-4l3rA:
undetectable		 2ygnA-4l3rA:
25.75
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.
4lr4 HYPOTHETICAL PROTEIN

([Eubacterium]
rectale) 		no annotation 3 TYR A 385
VAL A  57
THR A 254
 None
 0.61A 2ygnA-4lr4A:
2.1		 2ygnA-4lr4A:
15.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4myr CPAE2 PILUS ASSEMBLY
PROTEIN

(Sinorhizobium
meliloti) 		no annotation 3 TYR A  74
VAL A  83
THR A  78
 None
 0.87A 2ygnA-4myrA:
undetectable		 2ygnA-4myrA:
21.08
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.
4oht SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE

(Streptococcus
pyogenes) 		PF00171
(Aldedh) 		3 TYR A 357
VAL A 380
THR A 351
 None
 0.84A 2ygnA-4ohtA:
undetectable		 2ygnA-4ohtA:
14.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvs VHH DOMAIN BS-1

(Vicugna pacos) 		PF05609
(LAP1C) 		3 TYR a  33
VAL a   3
THR a 100
 None
 0.90A 2ygnA-4tvsa:
undetectable		 2ygnA-4tvsa:
23.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uzg SURFACE PROTEIN SPB1

(Streptococcus
agalactiae) 		no annotation 3 TYR A 194
VAL A 189
THR A 199
 None
 0.51A 2ygnA-4uzgA:
undetectable		 2ygnA-4uzgA:
20.74
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.
4z81 EGF FAMILY
DOMAIN-CONTAINING
PROTEIN

(Toxoplasma
gondii) 		PF02430
(AMA-1)
PF07974
(EGF_2) 		3 TYR A  97
VAL A 234
THR A  96
 None
 0.90A 2ygnA-4z81A:
undetectable		 2ygnA-4z81A:
13.58
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.
4zaa FDC1

(Aspergillus
niger) 		PF01977
(UbiD) 		3 TYR A 298
VAL A 186
THR A 183
 None
 0.90A 2ygnA-4zaaA:
undetectable		 2ygnA-4zaaA:
15.91
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.
4zc0 REPLICATIVE DNA
HELICASE

(Helicobacter
pylori) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		3 TYR A 189
VAL A 453
THR A 450
 None
 0.76A 2ygnA-4zc0A:
undetectable		 2ygnA-4zc0A:
14.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c5y DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Colwellia
psychrerythraea) 		PF01791
(DeoC) 		3 TYR A 212
VAL A 203
THR A 177
 None
 0.90A 2ygnA-5c5yA:
undetectable		 2ygnA-5c5yA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fml PA SUBUNIT OF
INFLUENZA B
POLYMERASE

(Influenza B
virus) 		PF00603
(Flu_PA) 		3 TYR B 150
VAL B  40
THR B 124
 None
 0.80A 2ygnA-5fmlB:
undetectable		 2ygnA-5fmlB:
21.15
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.
5gha SULFUR TRANSFERASE
TTUA

(Thermus
thermophilus) 		PF01171
(ATP_bind_3) 		3 TYR A 209
VAL A  66
THR A 210
 None
 0.77A 2ygnA-5ghaA:
undetectable		 2ygnA-5ghaA:
16.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k94 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,PROTEIN
TRANSLOCASE SUBUNIT
SECA,MALTOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF01547
(SBP_bac_1)
PF13416
(SBP_bac_8) 		3 TYR A 326
VAL A 357
THR A 321
 None
 0.83A 2ygnA-5k94A:
undetectable		 2ygnA-5k94A:
15.48
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.
5k9t PROTEIN TRANSLOCASE
SUBUNIT SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07517
(SecA_DEAD) 		3 TYR A 326
VAL A 357
THR A 321
 None
 0.79A 2ygnA-5k9tA:
undetectable		 2ygnA-5k9tA:
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.
5lxz SECRETED PROTEIN

(Streptomyces
lividans) 		PF07646
(Kelch_2)
PF09118
(DUF1929) 		3 TYR B 540
VAL B 492
THR B 541
 None
 0.88A 2ygnA-5lxzB:
undetectable		 2ygnA-5lxzB:
12.04
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.
5mdn DNA POLYMERASE

(Pyrobaculum
calidifontis) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 TYR A 230
VAL A 282
THR A 292
 None
 0.82A 2ygnA-5mdnA:
undetectable		 2ygnA-5mdnA:
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.
5mmx CSPYL1_ABA

(Citrus sinensis) 		no annotation 3 TYR B  52
VAL B 152
THR B  51
 None
 0.90A 2ygnA-5mmxB:
undetectable		 2ygnA-5mmxB:
22.84
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.
5mtz RIBONUCLEASE Z

(Saccharomyces
cerevisiae) 		PF13691
(Lactamase_B_4) 		3 TYR A  88
VAL A 192
THR A  58
 None
 0.76A 2ygnA-5mtzA:
undetectable		 2ygnA-5mtzA:
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.
5oup PERFORIN-LIKE
PROTEIN 1

(Toxoplasma
gondii) 		no annotation 3 TYR A 677
VAL A 745
THR A 676
 None
 0.88A 2ygnA-5oupA:
undetectable		 2ygnA-5oupA:
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.
5u47 PENICILLIN BINDING
PROTEIN 2X

(Streptococcus
thermophilus) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF03793
(PASTA) 		3 TYR A 724
VAL A 711
THR A 723
 None
 0.87A 2ygnA-5u47A:
undetectable		 2ygnA-5u47A:
12.91
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.
5u4q DTDP-GLUCOSE
4,6-DEHYDRATASE

(Klebsiella
pneumoniae) 		PF16363
(GDP_Man_Dehyd) 		3 TYR A 182
VAL A 317
THR A 218
 None
 0.64A 2ygnA-5u4qA:
undetectable		 2ygnA-5u4qA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u6k DNA TOPOISOMERASE
2-BINDING PROTEIN 1

(Mus musculus) 		PF12738
(PTCB-BRCT) 		3 TYR A 708
VAL A 741
THR A 704
 None
 0.87A 2ygnA-5u6kA:
undetectable		 2ygnA-5u6kA:
19.31
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.
5uz8 CADHERIN-23

(Mus musculus) 		no annotation 3 TYR A2320
VAL A2342
THR A2336
 None
 0.87A 2ygnA-5uz8A:
2.5		 2ygnA-5uz8A:
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.
5vhi 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 6

(Homo sapiens) 		PF01399
(PCI)
PF10602
(RPN7) 		3 TYR Y 225
VAL Y 278
THR Y 221
 None
 0.70A 2ygnA-5vhiY:
undetectable		 2ygnA-5vhiY:
16.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vl1 LYSINE--TRNA LIGASE

(Mycobacterium
ulcerans) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		3 TYR A 323
VAL A 403
THR A 335
 None
 0.83A 2ygnA-5vl1A:
undetectable		 2ygnA-5vl1A:
14.03
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.
5vym BETA-GALACTOSIDASE
BGAB

(Bifidobacterium
adolescentis) 		PF08532
(Glyco_hydro_42M) 		3 TYR A  58
VAL A  49
THR A   4
 None
 0.88A 2ygnA-5vymA:
undetectable		 2ygnA-5vymA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wc8 SIAD

(Mannheimia
haemolytica) 		no annotation 3 TYR M 158
VAL M 209
THR M 155
 None
 0.89A 2ygnA-5wc8M:
undetectable		 2ygnA-5wc8M:
14.67
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.
5x5v GD

(Suid
alphaherpesvirus
1) 		PF01537
(Herpes_glycop_D) 		3 TYR A 238
VAL A  68
THR A 244
 None
 0.56A 2ygnA-5x5vA:
undetectable		 2ygnA-5x5vA:
14.89
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.
5xey PHLORETIN HYDROLASE

(Mycobacteroides
abscessus) 		no annotation 3 TYR A  17
VAL A  45
THR A  15
 None
 0.61A 2ygnA-5xeyA:
undetectable		 2ygnA-5xeyA:
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 TYR C3791
VAL C3764
THR C3790
 None
 0.81A 2ygnA-5y3rC:
undetectable		 2ygnA-5y3rC:
3.37
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.
5yb7 L-AMINO ACID
OXIDASE/MONOOXYGENAS
E

(Pseudomonas sp.
AIU 813) 		no annotation 3 TYR A  74
VAL A 314
THR A 299
 None
 0.88A 2ygnA-5yb7A:
undetectable		 2ygnA-5yb7A:
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.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 3 TYR A 482
VAL A 491
THR A 624
 None
 0.76A 2ygnA-5yfbA:
undetectable		 2ygnA-5yfbA:
undetectable