SIMILAR PATTERNS OF AMINO ACIDS FOR 2YGN_A_PCFA1179

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.
1a5z L-LACTATE
DEHYDROGENASE

(Thermotoga
maritima) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 LEU A 150
ILE A  95
LEU A  40
MET A  22
VAL A 298
 None
 1.10A 2ygnA-1a5zA:
undetectable		 2ygnA-1a5zA:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ikp EXOTOXIN A

(Pseudomonas
aeruginosa) 		PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target) 		5 LEU A  49
ILE A  66
ARG A 154
ILE A 167
MET A  47
 None
None
CL  A 701 (-4.1A)
None
None
 1.12A 2ygnA-1ikpA:
0.0		 2ygnA-1ikpA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1klp MEROMYCOLATE
EXTENSION ACYL
CARRIER PROTEIN

(Mycobacterium
tuberculosis) 		PF00550
(PP-binding) 		5 ILE A  16
LEU A  37
ILE A  27
MET A  44
VAL A  57
 None
 1.01A 2ygnA-1klpA:
undetectable		 2ygnA-1klpA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ogo DEXTRANASE

(Talaromyces
minioluteus) 		PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N) 		5 ILE X 494
ILE X 526
MET X 423
VAL X 479
VAL X 482
 None
 1.08A 2ygnA-1ogoX:
0.0		 2ygnA-1ogoX:
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.
1pe9 PECTATE LYASE A

(Dickeya
chrysanthemi) 		PF00544
(Pec_lyase_C) 		5 LEU A 361
ILE A 123
ILE A 162
ILE A 106
VAL A 116
 None
 1.04A 2ygnA-1pe9A:
undetectable		 2ygnA-1pe9A:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q9j POLYKETIDE SYNTHASE
ASSOCIATED PROTEIN 5

(Mycobacterium
tuberculosis) 		PF00668
(Condensation)
PF16911
(PapA_C) 		5 LEU A 285
ILE A 307
LEU A 303
ARG A 253
ILE A 300
 None
 1.13A 2ygnA-1q9jA:
0.0		 2ygnA-1q9jA:
16.41
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.
1qhv PROTEIN (ADENOVIRUS
FIBRE)

(Human
mastadenovirus
C) 		PF00541
(Adeno_knob) 		5 ILE A 534
LEU A 536
ILE A 516
MET A 553
PHE A 555
 None
 1.07A 2ygnA-1qhvA:
0.0		 2ygnA-1qhvA:
19.80
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.
1qvr CLPB PROTEIN

(Thermus
thermophilus) 		PF00004
(AAA)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		5 ILE A 266
LEU A 224
ARG A 189
ILE A 183
VAL A 327
 None
 1.11A 2ygnA-1qvrA:
undetectable		 2ygnA-1qvrA:
9.64
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.
1twy ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Vibrio cholerae) 		PF12727
(PBP_like) 		5 ILE A 126
LEU A 118
ILE A 131
ILE A 216
VAL A 194
 None
 1.07A 2ygnA-1twyA:
undetectable		 2ygnA-1twyA:
23.18
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.
1u2v ARP2/3 COMPLEX 34KDA
SUBUNIT

(Bos taurus) 		PF04045
(P34-Arc) 		5 LEU D 207
ILE D 223
LEU D 251
MET D 182
PHE D 200
 None
 1.10A 2ygnA-1u2vD:
0.0		 2ygnA-1u2vD:
19.03
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.
1uf2 CORE PROTEIN P3

(Rice dwarf
virus) 		PF09231
(RDV-p3) 		5 LEU A 118
ILE A 706
LEU A 710
ILE A 754
VAL A 761
 None
 0.95A 2ygnA-1uf2A:
undetectable		 2ygnA-1uf2A:
10.24
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.
1ul7 MAP/MICROTUBULE
AFFINITY-REGULATING
KINASE 3

(Mus musculus) 		PF02149
(KA1) 		5 LEU A  32
ILE A  92
ILE A  28
MET A  64
PHE A  79
 None
 1.13A 2ygnA-1ul7A:
undetectable		 2ygnA-1ul7A:
18.06
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.
1xdq BACTERIAL SULFITE
OXIDASE

(Escherichia
coli) 		PF00174
(Oxidored_molyb) 		5 ILE A 212
LEU A 214
ILE A  72
PHE A 135
VAL A 197
 None
 1.12A 2ygnA-1xdqA:
undetectable		 2ygnA-1xdqA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a0u INITIATION FACTOR 2B

(Leishmania
major) 		PF01008
(IF-2B) 		5 LEU A  98
ILE A  51
LEU A  30
ILE A  21
VAL A 148
 None
 1.07A 2ygnA-2a0uA:
undetectable		 2ygnA-2a0uA:
18.06
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.
2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN

(Bulinus
truncatus) 		PF02931
(Neur_chan_LBD) 		5 ILE A 137
LEU A  33
ILE A 196
ILE A  36
PHE A 120
 None
 1.14A 2ygnA-2bj0A:
undetectable		 2ygnA-2bj0A:
21.03
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.
2bp5 CLATHRIN COAT
ASSEMBLY PROTEIN
AP50

(Rattus
norvegicus) 		PF00928
(Adap_comp_sub) 		6 LEU M 206
ILE M 263
ILE M 243
MET M 216
PHE M 214
VAL M 177
 None
 1.46A 2ygnA-2bp5M:
undetectable		 2ygnA-2bp5M:
16.43
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.
2dt8 DEGV FAMILY PROTEIN

(Thermus
thermophilus) 		PF02645
(DegV) 		5 LEU A  28
ILE A  88
PHE A  69
VAL A 112
VAL A 110
 None
 0.93A 2ygnA-2dt8A:
undetectable		 2ygnA-2dt8A:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g02 NISIN BIOSYNTHESIS
PROTEIN NISC

(Lactococcus
lactis) 		PF05147
(LANC_like) 		5 ILE A 290
LEU A 293
ILE A 313
ILE A 241
VAL A 272
 None
 1.05A 2ygnA-2g02A:
undetectable		 2ygnA-2g02A:
14.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g4r MOLYBDOPTERIN
BIOSYNTHESIS MOG
PROTEIN

(Mycobacterium
tuberculosis) 		PF00994
(MoCF_biosynth) 		5 ILE A  67
LEU A 128
ILE A  28
ILE A  99
VAL A 145
 None
 1.15A 2ygnA-2g4rA:
undetectable		 2ygnA-2g4rA:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		5 ILE A 113
ILE A 205
ILE A 128
MET A 161
PHE A 115
 None
 1.01A 2ygnA-2gnpA:
undetectable		 2ygnA-2gnpA:
22.75
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.
2h0e TRANSTHYRETIN-LIKE
PROTEIN PUCM

(Bacillus
subtilis) 		PF00576
(Transthyretin) 		5 ILE A  29
LEU A  54
MET A  67
PHE A  69
VAL A 117
 None
 0.98A 2ygnA-2h0eA:
undetectable		 2ygnA-2h0eA:
19.64
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.
2hk0 D-PSICOSE
3-EPIMERASE

(Agrobacterium
tumefaciens) 		PF01261
(AP_endonuc_2) 		5 LEU A 182
ILE A 104
LEU A  93
ILE A  66
VAL A 170
 LEU  A 182 ( 0.6A)
ILE  A 104 ( 0.7A)
LEU  A  93 ( 0.6A)
ILE  A  66 ( 0.7A)
VAL  A 170 ( 0.6A)
 1.11A 2ygnA-2hk0A:
undetectable		 2ygnA-2hk0A:
17.09
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.
2hsm GLUTAMYL-TRNA
SYNTHETASE,
CYTOPLASMIC

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 130
ILE A  84
ILE A  51
PHE A  85
VAL A  97
 None
 1.11A 2ygnA-2hsmA:
undetectable		 2ygnA-2hsmA:
23.30
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.
2j43 SPYDX

(Streptococcus
pyogenes) 		PF03714
(PUD) 		5 ILE A  75
LEU A  16
MET A  47
VAL A  61
VAL A  33
 None
 1.14A 2ygnA-2j43A:
undetectable		 2ygnA-2j43A:
19.82
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.
2kii PUTATIVE
UNCHARACTERIZED
PROTEIN

(Shewanella
oneidensis) 		PF07700
(HNOB) 		5 ILE A 176
LEU A 130
ILE A 159
ILE A  98
PHE A  91
 None
None
None
HEM  A 182 (-4.0A)
None
 0.95A 2ygnA-2kiiA:
undetectable		 2ygnA-2kiiA:
21.81
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.
2mdt PUTATIVE
UNCHARACTERIZED
PROTEIN

(Sulfolobus
solfataricus) 		no annotation 5 LEU A  97
ILE A   5
LEU A  13
ILE A  84
ILE A  40
 None
 1.06A 2ygnA-2mdtA:
undetectable		 2ygnA-2mdtA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oi2 MEVALONATE KINASE

(Streptococcus
pneumoniae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 LEU A 258
ILE A  14
LEU A  31
ILE A 263
VAL A  22
 None
None
None
None
DP6  A 300 (-4.6A)
 1.14A 2ygnA-2oi2A:
undetectable		 2ygnA-2oi2A:
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.
2p88 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Bacillus cereus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 122
ILE A 103
LEU A  66
ILE A  32
VAL A 301
 None
 1.08A 2ygnA-2p88A:
undetectable		 2ygnA-2p88A:
17.34
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.
2r66 GLYCOSYL
TRANSFERASE, GROUP 1

(Halothermothrix
orenii) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 LEU A  36
ILE A 195
ILE A 226
ARG A 450
ILE A 459
 None
 1.13A 2ygnA-2r66A:
undetectable		 2ygnA-2r66A:
15.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y6v PEROXISOMAL MEMBRANE
PROTEIN LPX1

(Saccharomyces
cerevisiae) 		PF12697
(Abhydrolase_6) 		5 LEU A 324
ILE A 142
ILE A 166
ILE A  86
PHE A  57
 None
 1.05A 2ygnA-2y6vA:
undetectable		 2ygnA-2y6vA:
18.89
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) 		12 LEU A  36
ILE A  40
LEU A  48
ILE A  55
MET A  63
ARG A  76
MET A  77
ILE A  80
MET A  87
PHE A  89
VAL A 152
VAL A 154
 PCF  A1179 ( 4.0A)
None
PCF  A1179 (-4.1A)
PCF  A1179 ( 4.5A)
PCF  A1179 ( 4.1A)
MLY  A  72 (-4.5A)
PCF  A1179 (-4.0A)
None
PCF  A1179 (-3.6A)
PCF  A1179 ( 3.8A)
PCF  A1179 (-4.4A)
PCF  A1179 ( 4.7A)
 0.00A 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) 		8 ILE A  40
ILE A  55
ARG A  76
MET A  77
ILE A  80
MET A  87
PHE A  89
VAL A 152
 None
PCF  A1213 (-4.0A)
PCF  A1213 (-3.6A)
PCF  A1213 (-3.5A)
None
PCF  A1213 ( 3.8A)
PCF  A1213 (-4.1A)
PCF  A1213 ( 4.7A)
 1.08A 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.
2ygo WNT INHIBITORY
FACTOR 1

(Homo sapiens) 		PF02019
(WIF) 		11 LEU A  36
ILE A  40
LEU A  48
ILE A  55
MET A  63
MET A  77
ILE A  80
MET A  87
PHE A  89
VAL A 152
VAL A 154
 PCF  A1213 ( 4.2A)
None
PCF  A1213 (-4.3A)
PCF  A1213 (-4.0A)
PCF  A1213 ( 4.2A)
PCF  A1213 (-3.5A)
None
PCF  A1213 ( 3.8A)
PCF  A1213 (-4.1A)
PCF  A1213 ( 4.7A)
PCF  A1213 ( 4.7A)
 0.13A 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) 		10 LEU A  36
ILE A  40
ILE A  55
MET A  63
MET A  77
ILE A  80
MET A  87
PHE A  89
VAL A 152
VAL A 154
 None
None
PCF  A1275 ( 4.4A)
PCF  A1275 ( 4.1A)
PCF  A1275 (-3.2A)
PCF  A1275 (-4.7A)
PCF  A1275 (-3.2A)
PCF  A1275 (-4.6A)
PCF  A1275 (-3.6A)
PCF  A1275 (-4.9A)
 0.42A 2ygnA-2ygqA:
26.1		 2ygnA-2ygqA:
48.15
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) 		10 LEU A  36
ILE A  40
LEU A  48
ILE A  55
MET A  63
MET A  77
MET A  87
PHE A  89
VAL A 152
VAL A 154
 None
None
PCF  A1275 (-4.6A)
PCF  A1275 ( 4.4A)
PCF  A1275 ( 4.1A)
PCF  A1275 (-3.2A)
PCF  A1275 (-3.2A)
PCF  A1275 (-4.6A)
PCF  A1275 (-3.6A)
PCF  A1275 (-4.9A)
 0.69A 2ygnA-2ygqA:
26.1		 2ygnA-2ygqA:
48.15
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) 		6 LEU A 165
ILE A  40
ILE A  55
ILE A  80
MET A  87
PHE A  89
 None
None
PCF  A1275 ( 4.4A)
PCF  A1275 (-4.7A)
PCF  A1275 (-3.2A)
PCF  A1275 (-4.6A)
 1.38A 2ygnA-2ygqA:
26.1		 2ygnA-2ygqA:
48.15
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) 		6 LEU A 165
ILE A  40
ILE A  55
ILE A  84
MET A  87
PHE A  89
 None
None
PCF  A1275 ( 4.4A)
None
PCF  A1275 (-3.2A)
PCF  A1275 (-4.6A)
 1.33A 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.
2zu8 MANNOSYL-3-PHOSPHOGL
YCERATE SYNTHASE

(Pyrococcus
horikoshii) 		PF09488
(Osmo_MPGsynth) 		5 LEU A  66
ILE A 112
LEU A 394
VAL A 181
VAL A 177
 None
 1.14A 2ygnA-2zu8A:
undetectable		 2ygnA-2zu8A:
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.
3a31 PROBABLE
THREONYL-TRNA
SYNTHETASE 1

(Aeropyrum
pernix) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		5 LEU A 187
LEU A 325
ILE A  18
MET A 332
VAL A  58
 None
 1.02A 2ygnA-3a31A:
undetectable		 2ygnA-3a31A:
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.
3a45 FORMAMIDOPYRIMIDINE-
DNA GLYCOSYLASE

(Acanthamoeba
polyphaga
mimivirus) 		PF01149
(Fapy_DNA_glyco)
PF06831
(H2TH) 		5 ILE A 206
LEU A 202
ILE A 179
ILE A 150
PHE A 139
 None
 1.09A 2ygnA-3a45A:
undetectable		 2ygnA-3a45A:
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.
3btz ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE ALKB
HOMOLOG 2

(Homo sapiens) 		PF13532
(2OG-FeII_Oxy_2) 		5 LEU A 178
ILE A 158
LEU A  85
ILE A  81
VAL A 145
 None
 1.15A 2ygnA-3btzA:
1.3		 2ygnA-3btzA:
19.90
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.
3eb8 CYSTEINE
PROTEASE-LIKE VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		5 LEU A 374
ILE A 186
ILE A 216
VAL A 344
VAL A 369
 None
 1.06A 2ygnA-3eb8A:
undetectable		 2ygnA-3eb8A:
18.00
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.
3ee1 EFFECTOR PROTEIN
VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		5 LEU A 374
ILE A 186
ILE A 216
VAL A 344
VAL A 369
 None
 0.95A 2ygnA-3ee1A:
undetectable		 2ygnA-3ee1A:
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.
3ez1 AMINOTRANSFERASE
MOCR FAMILY

(Deinococcus
geothermalis) 		PF12897
(Aminotran_MocR) 		5 LEU A 143
ILE A 175
ILE A 127
MET A 152
ILE A 189
 None
 1.11A 2ygnA-3ez1A:
undetectable		 2ygnA-3ez1A:
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.
3fdb PUTATIVE
PLP-DEPENDENT
BETA-CYSTATHIONASE

(Corynebacterium
diphtheriae) 		PF00155
(Aminotran_1_2) 		5 ILE A 313
LEU A 352
ILE A 302
PHE A 315
VAL A 372
 None
 1.15A 2ygnA-3fdbA:
undetectable		 2ygnA-3fdbA:
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.
3flt SAP-LIKE PENTRAXIN

(Limulus
polyphemus) 		PF00354
(Pentaxin) 		5 ILE A 194
ILE A   4
PHE A 201
VAL A 209
VAL A 207
 None
 1.10A 2ygnA-3fltA:
undetectable		 2ygnA-3fltA:
21.27
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.
3gfo COBALT IMPORT
ATP-BINDING PROTEIN
CBIO 1

(Clostridium
perfringens) 		PF00005
(ABC_tran) 		5 LEU A 207
LEU A  48
ILE A 196
ILE A  25
VAL A 229
 None
 1.12A 2ygnA-3gfoA:
undetectable		 2ygnA-3gfoA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l6a EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4
GAMMA 2

(Homo sapiens) 		PF02020
(W2)
PF02847
(MA3) 		5 LEU A  69
LEU A 124
ILE A 114
PHE A  81
VAL A  48
 None
 1.04A 2ygnA-3l6aA:
undetectable		 2ygnA-3l6aA:
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.
3lov PROTOPORPHYRINOGEN
OXIDASE

(Exiguobacterium
sibiricum) 		PF01593
(Amino_oxidase) 		5 ILE A 284
LEU A 256
ILE A 259
VAL A 427
VAL A 423
 FAD  A 500 (-3.7A)
FAD  A 500 (-4.9A)
None
None
None
 1.12A 2ygnA-3lovA:
undetectable		 2ygnA-3lovA:
15.34
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.
3m19 VARIABLE LYMPHOCYTE
RECEPTOR A DIVERSITY
REGION

(Petromyzon
marinus) 		PF13855
(LRR_8) 		5 LEU A  63
LEU A 161
ILE A 145
VAL A 125
VAL A 101
 None
 1.10A 2ygnA-3m19A:
undetectable		 2ygnA-3m19A:
19.84
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.
3m19 VARIABLE LYMPHOCYTE
RECEPTOR A DIVERSITY
REGION

(Petromyzon
marinus) 		PF13855
(LRR_8) 		5 LEU A  65
LEU A 161
ILE A 145
VAL A 125
VAL A 101
 None
 1.00A 2ygnA-3m19A:
undetectable		 2ygnA-3m19A:
19.84
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.
3mdq EXOPOLYPHOSPHATASE

(Cytophaga
hutchinsonii) 		PF02541
(Ppx-GppA) 		5 LEU A 206
ILE A 198
ILE A 279
MET A 135
PHE A 144
 None
 1.10A 2ygnA-3mdqA:
undetectable		 2ygnA-3mdqA:
20.06
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.
3n2q SEX PHEROMONE
STAPH-CAM373

(Bacillus cereus) 		PF07537
(CamS) 		5 ILE A 252
LEU A 294
ILE A 261
PHE A 248
VAL A 312
 None
 1.07A 2ygnA-3n2qA:
undetectable		 2ygnA-3n2qA:
20.64
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.
3oce FUMARATE LYASE:DELTA
CRYSTALLIN

(Brucella
abortus) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 ILE A 390
LEU A 294
ILE A 308
ARG A 185
ILE A 290
 None
 1.06A 2ygnA-3oceA:
undetectable		 2ygnA-3oceA:
14.64
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.
3ojl CAP5O

(Staphylococcus
aureus) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 ILE A  78
LEU A 101
MET A 125
ILE A 133
VAL A 183
 None
 1.06A 2ygnA-3ojlA:
undetectable		 2ygnA-3ojlA:
16.71
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.
3wo9 VARIABLE LYMPHOCYTE
RECEPTOR C

(Lethenteron
camtschaticum) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		5 LEU A  73
LEU A 169
ILE A 153
VAL A 133
VAL A 109
 None
 1.09A 2ygnA-3wo9A:
undetectable		 2ygnA-3wo9A:
19.76
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.
4afr METACASPASE

(Trypanosoma
brucei) 		PF00656
(Peptidase_C14) 		5 LEU A 100
ILE A 255
LEU A 322
ILE A 328
MET A 253
 None
 0.97A 2ygnA-4afrA:
undetectable		 2ygnA-4afrA:
16.89
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.
4ao7 ESTERASE

(unidentified) 		PF12146
(Hydrolase_4) 		5 LEU A 192
LEU A 126
ILE A 160
ILE A 129
VAL A  65
 None
 1.10A 2ygnA-4ao7A:
undetectable		 2ygnA-4ao7A:
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.
4blp PACKAGING ENZYME P4

(Pseudomonas
phage phi13) 		PF11602
(NTPase_P4) 		5 ILE A 212
LEU A 253
ILE A 172
PHE A 215
VAL A  70
 None
 1.13A 2ygnA-4blpA:
undetectable		 2ygnA-4blpA:
17.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dy0 GLIA-DERIVED NEXIN

(Homo sapiens) 		PF00079
(Serpin) 		5 ILE A 236
LEU A 274
ILE A 223
MET A 262
VAL A 370
 None
 1.06A 2ygnA-4dy0A:
undetectable		 2ygnA-4dy0A:
19.73
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.
4emy AMINOTRANSFERASE
CLASS I AND II

(Anaerococcus
prevotii) 		PF00155
(Aminotran_1_2) 		5 ILE A 375
LEU A 403
ILE A  37
ARG A 332
ILE A 358
 None
 1.12A 2ygnA-4emyA:
undetectable		 2ygnA-4emyA:
16.71
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.
4h2k SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20) 		5 ILE A  29
LEU A  12
ILE A 109
MET A 101
VAL A 145
 None
None
None
ZN  A1001 ( 4.4A)
None
 1.10A 2ygnA-4h2kA:
undetectable		 2ygnA-4h2kA:
20.08
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.
4jo0 CMLA

(Streptomyces
venezuelae) 		PF12706
(Lactamase_B_2) 		5 LEU A 458
ILE A 303
LEU A 301
ILE A 319
VAL A 492
 None
 1.02A 2ygnA-4jo0A:
undetectable		 2ygnA-4jo0A:
15.12
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.
4kjd INTESTINAL-TYPE
ALKALINE PHOSPHATASE
1

(Rattus
norvegicus) 		PF00245
(Alk_phosphatase) 		5 LEU A 328
LEU A  38
ARG A 442
ILE A 458
VAL A 437
 None
 0.90A 2ygnA-4kjdA:
undetectable		 2ygnA-4kjdA:
16.74
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.
4m7e PROTEIN
BRASSINOSTEROID
INSENSITIVE 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		6 ILE A 674
LEU A 683
ILE A 670
MET A 661
MET A 677
PHE A 581
 None
 1.20A 2ygnA-4m7eA:
undetectable		 2ygnA-4m7eA:
10.82
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.
4mf6 GLUTATHIONE
S-TRANSFERASE DOMAIN

(Paraburkholderia
graminis) 		PF00043
(GST_C)
PF02798
(GST_N) 		5 LEU A 161
ILE A 126
ILE A 205
VAL A 219
VAL A 224
 None
 1.08A 2ygnA-4mf6A:
undetectable		 2ygnA-4mf6A:
18.85
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.
4mki ENERGY-COUPLING
FACTOR TRANSPORTER
ATP-BINDING PROTEIN
ECFA2

(Caldanaerobacter
subterraneus) 		no annotation 5 LEU B 267
ILE B  38
LEU B  49
ILE B  26
MET B 217
 None
 1.15A 2ygnA-4mkiB:
undetectable		 2ygnA-4mkiB:
21.45
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.
4mps BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE 1

(Rattus
norvegicus) 		PF00777
(Glyco_transf_29) 		5 LEU A 395
MET A 375
ILE A 325
MET A 329
PHE A 398
 None
 0.93A 2ygnA-4mpsA:
undetectable		 2ygnA-4mpsA:
18.36
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.
4q7l UNCHARACTERIZED ABC
TRANSPORTER
ATP-BINDING PROTEIN
TM_0288

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 ILE A 412
ILE A 419
ARG A 428
ILE A 544
PHE A 357
 None
 1.11A 2ygnA-4q7lA:
undetectable		 2ygnA-4q7lA:
18.97
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.
4q7l UNCHARACTERIZED ABC
TRANSPORTER
ATP-BINDING PROTEIN
TM_0288

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 ILE A 412
ILE A 419
ARG A 428
ILE A 544
VAL A 370
 None
 1.15A 2ygnA-4q7lA:
undetectable		 2ygnA-4q7lA:
18.97
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.
4qdg PUTATIVE ADHESIN

(Bacteroides
thetaiotaomicron) 		PF08842
(Mfa2) 		5 LEU A 284
ILE A 181
MET A 309
PHE A 311
VAL A 266
 None
 1.12A 2ygnA-4qdgA:
undetectable		 2ygnA-4qdgA:
17.52
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.
4r6f LEUCINE RICH REPEAT
DLRR_I

(synthetic
construct) 		PF12354
(Internalin_N)
PF13855
(LRR_8) 		5 LEU A  67
LEU A 163
ILE A 147
VAL A 127
VAL A 103
 None
 1.14A 2ygnA-4r6fA:
undetectable		 2ygnA-4r6fA:
16.94
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.
4r9n LMO0547 PROTEIN

(Listeria
monocytogenes) 		PF04198
(Sugar-bind) 		5 LEU A  68
ARG A 305
MET A 306
ILE A 300
VAL A 238
 None
 1.13A 2ygnA-4r9nA:
undetectable		 2ygnA-4r9nA:
18.36
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.
4rns PCP DEGRADATION
TRANSCRIPTIONAL
ACTIVATION PROTEIN

(Sphingobium
chlorophenolicum) 		PF03466
(LysR_substrate) 		5 ILE A 101
LEU A 115
ILE A 299
MET A 111
VAL A 275
 None
 1.06A 2ygnA-4rnsA:
undetectable		 2ygnA-4rnsA:
21.19
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.
4s1w GLUTAMINE--FRUCTOSE-
6-PHOSPHATE
AMINOTRANSFERASE
[ISOMERIZING]

(Staphylococcus
aureus) 		PF01380
(SIS) 		5 ILE A 371
LEU A 389
ILE A 345
ILE A 267
VAL A 417
 None
 1.11A 2ygnA-4s1wA:
undetectable		 2ygnA-4s1wA:
20.17
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.
4ud4 POLY(A) RNA
POLYMERASE PROTEIN
CID1

(Schizosaccharomyces
pombe) 		PF01909
(NTP_transf_2)
PF03828
(PAP_assoc) 		5 ILE A 328
LEU A 326
ILE A 350
VAL A 192
VAL A 189
 None
 1.04A 2ygnA-4ud4A:
undetectable		 2ygnA-4ud4A:
18.73
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.
4uir OLEATE HYDRATASE

(Elizabethkingia
meningoseptica) 		PF06100
(MCRA) 		5 ILE A  67
ILE A 327
ILE A  82
PHE A  94
VAL A 270
 None
 1.06A 2ygnA-4uirA:
undetectable		 2ygnA-4uirA:
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.
4yis MEGANUCLEASE I-CPAMI

(Cryphonectria
parasitica) 		PF00961
(LAGLIDADG_1) 		5 LEU A 105
ILE A  86
LEU A  60
ILE A  56
PHE A  41
 None
 0.98A 2ygnA-4yisA:
undetectable		 2ygnA-4yisA:
20.34
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.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		5 LEU A 170
ILE A 134
LEU A 105
ILE A 221
PHE A 132
 None
 1.10A 2ygnA-4yw5A:
undetectable		 2ygnA-4yw5A:
13.51
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.
4z7y DIPHOSPHOMEVALONATE
DECARBOXYLASE

(Sulfolobus
solfataricus) 		PF00288
(GHMP_kinases_N) 		5 LEU A 305
ILE A 182
LEU A  39
ILE A 311
ILE A  37
 None
 1.11A 2ygnA-4z7yA:
undetectable		 2ygnA-4z7yA:
17.59
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.
5by3 BTGH115A

(Bacteroides
thetaiotaomicron) 		PF15979
(Glyco_hydro_115) 		6 LEU A 202
MET A 364
ILE A 373
MET A 418
PHE A 447
VAL A 434
 None
 1.26A 2ygnA-5by3A:
undetectable		 2ygnA-5by3A:
10.89
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.
5d55 HDAB,HDAA (ADHESIN),
HUS-ASSOCIATED
DIFFUSE ADHERENCE

(Escherichia
coli) 		PF05775
(AfaD) 		5 LEU A 130
ILE A   3
LEU A   5
ILE A  96
VAL A  83
 None
 1.09A 2ygnA-5d55A:
undetectable		 2ygnA-5d55A:
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.
5e31 PENICILLIN BINDING
PROTEIN 2 PRIME

(Enterococcus
faecium) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF05223
(MecA_N) 		5 LEU A 568
ILE A 505
ILE A 427
VAL A 650
VAL A 367
 None
 1.03A 2ygnA-5e31A:
undetectable		 2ygnA-5e31A:
11.54
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.
5e5b FACT COMPLEX SUBUNIT
SPT16

(Homo sapiens) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 ILE A 247
LEU A 217
ILE A 205
MET A 266
VAL A 292
 None
 0.96A 2ygnA-5e5bA:
undetectable		 2ygnA-5e5bA:
16.13
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.
5e8c UL31

(Suid
alphaherpesvirus
1) 		PF02718
(Herpes_UL31) 		5 LEU A  65
LEU A 115
ILE A 118
VAL A 164
VAL A 180
 None
 1.13A 2ygnA-5e8cA:
undetectable		 2ygnA-5e8cA:
20.24
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Pseudomonas
aeruginosa) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		5 LEU A 459
ILE A 487
MET A 492
PHE A 491
VAL A 542
 None
 1.04A 2ygnA-5im3A:
undetectable		 2ygnA-5im3A:
9.30
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.
5ksd ATPASE 2, PLASMA
MEMBRANE-TYPE

(Arabidopsis
thaliana) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		5 ILE A 287
LEU A 103
ILE A  99
MET A  73
VAL A 657
 None
 1.08A 2ygnA-5ksdA:
undetectable		 2ygnA-5ksdA:
12.41
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.
5lbh CAIP

(Helicobacter
cinaedi) 		PF00210
(Ferritin) 		5 ILE A  77
ILE A  42
PHE A 101
VAL A  49
VAL A  53
 None
 1.15A 2ygnA-5lbhA:
undetectable		 2ygnA-5lbhA:
22.41
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.
5m6p TYROCIDINE SYNTHASE
2

(Brevibacillus
parabrevis) 		no annotation 5 LEU A3511
LEU A3550
ILE A3525
ILE A3553
VAL A3389
 None
 1.10A 2ygnA-5m6pA:
undetectable		 2ygnA-5m6pA:
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.
5nbo GLYCOSYL HYDROLASE
FAMILY 16

(Bacteroides
ovatus) 		no annotation 5 ILE A 265
LEU A  84
ILE A 115
PHE A  41
VAL A  48
 None
 1.10A 2ygnA-5nboA:
undetectable		 2ygnA-5nboA:
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.
5wk4 VARIABLE LYMPHOCYTE
RECEPTOR 39

(Petromyzon
marinus) 		no annotation 5 LEU D  54
LEU D 152
ILE D 136
VAL D 116
VAL D  92
 None
 1.12A 2ygnA-5wk4D:
undetectable		 2ygnA-5wk4D:
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.
5wk4 VARIABLE LYMPHOCYTE
RECEPTOR 39

(Petromyzon
marinus) 		no annotation 5 LEU D  56
LEU D 152
ILE D 136
VAL D 116
VAL D  92
 None
 1.03A 2ygnA-5wk4D:
undetectable		 2ygnA-5wk4D:
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.
5wrk AP-2 COMPLEX SUBUNIT
MU

(Rattus
norvegicus) 		no annotation 5 ILE A 263
ILE A 220
MET A 216
PHE A 214
VAL A 177
 None
 1.08A 2ygnA-5wrkA:
2.0		 2ygnA-5wrkA:
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.
5wrl AP-2 COMPLEX SUBUNIT
MU

(Rattus
norvegicus) 		no annotation 6 LEU A 206
ILE A 263
ILE A 243
MET A 216
PHE A 214
VAL A 177
 None
 1.33A 2ygnA-5wrlA:
undetectable		 2ygnA-5wrlA:
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.
6b9u DNA GYRASE, SUBUNIT
B:SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE
SDR:GLUCOSE/RIBITOL
DEHYDROGENASE

(Brucella
abortus) 		no annotation 5 LEU A   4
MET A  22
ILE A  83
VAL A 183
VAL A 243
 None
 1.12A 2ygnA-6b9uA:
undetectable		 2ygnA-6b9uA:
21.24
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.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA

(Escherichia
coli) 		no annotation 5 ILE A 726
LEU A 722
ARG A 129
ILE A 784
PHE A 751
 None
 0.96A 2ygnA-6bogA:
undetectable		 2ygnA-6bogA:
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 VARIABLE LYMPHOCYTE
RECEPTOR 2

(Petromyzon
marinus) 		no annotation 5 LEU C  54
LEU C 152
ILE C 136
VAL C 116
VAL C  92
 None
 1.05A 2ygnA-6bxaC:
undetectable		 2ygnA-6bxaC:
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.
6ckb -

(-) 		no annotation 5 LEU A 187
ILE A 219
ILE A 132
MET A 184
VAL A 197
 None
 0.92A 2ygnA-6ckbA:
undetectable		 2ygnA-6ckbA:
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.
6egx STRUCTURAL PROTEIN
VP2

(Sacbrood virus) 		no annotation 5 ILE B  64
ILE B 169
MET B 114
PHE B 116
VAL B 128
 None
 1.13A 2ygnA-6egxB:
undetectable		 2ygnA-6egxB:
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.
6ejj WLAC PROTEIN

(Campylobacter
jejuni) 		no annotation 5 LEU A 165
ILE A 114
LEU A 113
ILE A  92
ILE A 103
 None
 1.14A 2ygnA-6ejjA:
undetectable		 2ygnA-6ejjA:
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.
1et6 SUPERANTIGEN SMEZ-2

(Streptococcus
pyogenes) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		4 ILE A  16
PHE A  69
PRO A  72
VAL A 105
 None
 1.20A 2ygnA-1et6A:
0.0		 2ygnA-1et6A:
19.81
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.
1fft UBIQUINOL OXIDASE

(Escherichia
coli) 		PF00116
(COX2)
PF06481
(COX_ARM) 		4 ILE B 196
PHE B 163
VAL B 263
PHE B 231
 None
 1.20A 2ygnA-1fftB:
0.0		 2ygnA-1fftB:
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.
1g8x MYOSIN II HEAVY
CHAIN FUSED TO
ALPHA-ACTININ 3

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF00435
(Spectrin)
PF02736
(Myosin_N) 		4 ILE A 326
PRO A 220
VAL A 381
PHE A 225
 None
 1.27A 2ygnA-1g8xA:
0.0		 2ygnA-1g8xA:
10.39
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.
1jne IMAGINAL DISC GROWTH
FACTOR-2

(Drosophila
melanogaster) 		PF00704
(Glyco_hydro_18) 		4 ILE A  98
PHE A 173
VAL A  37
PHE A 111
 None
 1.22A 2ygnA-1jneA:
0.0		 2ygnA-1jneA:
17.75
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.
1jx2 MYOSIN-2 HEAVY
CHAIN,DYNAMIN-A

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		4 ILE A 337
PRO A 231
VAL A 392
PHE A 236
 None
 1.28A 2ygnA-1jx2A:
0.0		 2ygnA-1jx2A:
9.09
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.
1lwd ISOCITRATE
DEHYDROGENASE

(Sus scrofa) 		PF00180
(Iso_dh) 		4 PHE A 227
PRO A 298
VAL A 258
PHE A 109
 None
 1.25A 2ygnA-1lwdA:
undetectable		 2ygnA-1lwdA:
17.91
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.
1m1j FIBRINOGEN GAMMA
CHAIN

(Gallus gallus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		4 ILE C 145
PRO C 220
VAL C 267
PHE C 226
 None
 1.27A 2ygnA-1m1jC:
0.0		 2ygnA-1m1jC:
14.88
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.
1mxs KDPG ALDOLASE

(Pseudomonas
putida) 		PF01081
(Aldolase) 		4 ILE A 112
PRO A 125
VAL A  71
PHE A 102
 None
 1.16A 2ygnA-1mxsA:
undetectable		 2ygnA-1mxsA:
23.11
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN

(Oligotropha
carboxidovorans) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 PHE B 271
PRO B 734
VAL B 298
PHE B 728
 MCN  B4920 ( 3.5A)
None
None
None
 1.28A 2ygnA-1n60B:
undetectable		 2ygnA-1n60B:
10.52
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.
1pm2 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
BETA CHAIN

(Escherichia
coli) 		PF00268
(Ribonuc_red_sm) 		4 ILE A 161
PRO A  97
VAL A 319
PHE A  18
 None
 0.84A 2ygnA-1pm2A:
undetectable		 2ygnA-1pm2A:
17.26
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.
1s68 RNA LIGASE 2

(Escherichia
virus T4) 		PF09414
(RNA_ligase) 		4 ILE A  36
PHE A 116
PRO A 151
VAL A 130
 AMP  A 301 (-4.9A)
None
None
None
 1.15A 2ygnA-1s68A:
undetectable		 2ygnA-1s68A:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vrb PUTATIVE ASPARAGINYL
HYDROXYLASE

(Bacillus
subtilis) 		PF08007
(Cupin_4) 		4 ILE A 114
PRO A  44
VAL A 208
PHE A  40
 None
 1.26A 2ygnA-1vrbA:
undetectable		 2ygnA-1vrbA:
21.10
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.
1wch PROTEIN TYROSINE
PHOSPHATASE,
NON-RECEPTOR TYPE 13

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 ILE A2405
PRO A2403
VAL A2467
PHE A2277
 None
 1.22A 2ygnA-1wchA:
undetectable		 2ygnA-1wchA:
17.71
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.
1wl7 ARABINANASE-TS

(Geobacillus
thermodenitrificans) 		PF04616
(Glyco_hydro_43) 		4 ILE A 300
PHE A   7
PRO A  28
PHE A  40
 None
 1.22A 2ygnA-1wl7A:
undetectable		 2ygnA-1wl7A:
19.17
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.
1x9n DNA LIGASE I

(Homo sapiens) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		4 ILE A 602
PRO A 606
VAL A 671
PHE A 686
 None
 1.02A 2ygnA-1x9nA:
undetectable		 2ygnA-1x9nA:
13.10
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 ILE A 177
PHE A  95
PRO A 137
VAL A  55
 None
 1.27A 2ygnA-1xc6A:
undetectable		 2ygnA-1xc6A:
10.54
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.
1xdn RNA EDITING LIGASE
MP52

(Trypanosoma
brucei) 		PF09414
(RNA_ligase) 		4 PHE A 262
PRO A 267
VAL A 290
PHE A 207
 None
 1.27A 2ygnA-1xdnA:
undetectable		 2ygnA-1xdnA:
19.43
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.
1yre HYPOTHETICAL PROTEIN
PA3270

(Pseudomonas
aeruginosa) 		PF13302
(Acetyltransf_3) 		4 ILE A  13
PHE A  88
PRO A  24
VAL A 174
 None
 1.26A 2ygnA-1yreA:
undetectable		 2ygnA-1yreA:
24.27
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.
2bfu COWPEA MOSAIC VIRUS,
LARGE (L) SUBUNIT
COWPEA MOSAIC VIRUS,
SMALL (S) SUBUNIT

(Cowpea mosaic
virus;
Cowpea mosaic
virus) 		PF02247
(Como_LCP)
PF02248
(Como_SCP) 		4 ILE S  56
PRO S  54
VAL L 146
PHE S 180
 None
 1.28A 2ygnA-2bfuS:
undetectable		 2ygnA-2bfuS:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c3b PPIASE

(Aspergillus
fumigatus) 		PF00160
(Pro_isomerase) 		4 ILE A  59
PRO A 163
VAL A  32
PHE A   6
 None
None
SO4  A1172 (-3.5A)
None
 1.21A 2ygnA-2c3bA:
undetectable		 2ygnA-2c3bA:
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.
2d3t FATTY OXIDATION
COMPLEX ALPHA
SUBUNIT

(Pseudomonas
fragi) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 ILE A 678
PHE A 664
VAL A 492
PHE A 714
 None
 1.22A 2ygnA-2d3tA:
undetectable		 2ygnA-2d3tA:
11.68
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.
2dlc TYROSYL-TRNA
SYNTHETASE,
CYTOPLASMIC

(Saccharomyces
cerevisiae) 		PF00579
(tRNA-synt_1b) 		4 ILE X  29
PHE X  66
VAL X 219
PHE X 196
 None
None
YMP  X 601 (-3.8A)
None
 1.22A 2ygnA-2dlcX:
undetectable		 2ygnA-2dlcX:
17.68
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.
2fnc MALTOSE ABC
TRANSPORTER,
PERIPLASMIC
MALTOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13416
(SBP_bac_8) 		4 ILE A  77
PRO A  79
VAL A 310
PHE A  83
 None
 1.16A 2ygnA-2fncA:
undetectable		 2ygnA-2fncA:
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.
2gmh ELECTRON TRANSFER
FLAVOPROTEIN-UBIQUIN
ONE OXIDOREDUCTASE

(Sus scrofa) 		PF05187
(ETF_QO)
PF13450
(NAD_binding_8) 		4 ILE A 519
PHE A 535
PRO A 299
PHE A 527
 None
 1.29A 2ygnA-2gmhA:
undetectable		 2ygnA-2gmhA:
12.99
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.
2iu1 EUKARYOTIC
TRANSLATION
INITIATION FACTOR 5

(Homo sapiens) 		PF02020
(W2) 		4 ILE A 256
PHE A 300
VAL A 363
PHE A 244
 None
 1.27A 2ygnA-2iu1A:
undetectable		 2ygnA-2iu1A:
22.64
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.
2jii SERINE/THREONINE-PRO
TEIN KINASE VRK3
MOLECULE: VACCINIA
RELATED KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 422
PRO A 389
VAL A 314
PHE A 356
 None
 1.27A 2ygnA-2jiiA:
undetectable		 2ygnA-2jiiA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o0a S.CEREVISIAE
CHROMOSOME XVI
READING FRAME ORF
YPL253C

(Saccharomyces
cerevisiae) 		PF16796
(Microtub_bd) 		4 ILE A 461
PHE A 572
VAL A 635
PHE A 424
 None
 1.01A 2ygnA-2o0aA:
undetectable		 2ygnA-2o0aA:
20.07
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.
2o8i HYPOTHETICAL PROTEIN
ATU2327

(Agrobacterium
fabrum) 		PF09349
(OHCU_decarbox) 		4 ILE A 153
PHE A  48
PRO A  64
PHE A 113
 None
 1.27A 2ygnA-2o8iA:
undetectable		 2ygnA-2o8iA:
17.82
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.
2p2v ALPHA-2,3-SIALYLTRAN
SFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		4 ILE A 101
PRO A  67
VAL A 220
PHE A  64
 None
EDO  A 705 ( 4.8A)
None
None
 1.28A 2ygnA-2p2vA:
undetectable		 2ygnA-2p2vA:
19.80
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.
2pvz PRPF METHYLACONITATE
ISOMERASE

(Shewanella
oneidensis) 		PF04303
(PrpF) 		4 ILE A 144
PHE A 181
PRO A 223
VAL A 170
 EDO  A1010 ( 3.7A)
None
EDO  A1010 ( 4.5A)
None
 0.99A 2ygnA-2pvzA:
undetectable		 2ygnA-2pvzA:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q4n UNCHARACTERIZED
PROTEIN AT1G79260

(Arabidopsis
thaliana) 		PF08768
(DUF1794) 		4 ILE A  60
PHE A 135
PRO A  84
VAL A 128
 None
 0.84A 2ygnA-2q4nA:
undetectable		 2ygnA-2q4nA:
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.
2v55 RHO-ASSOCIATED
PROTEIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE A 113
PRO A 393
VAL A  93
PHE A 397
 None
 1.26A 2ygnA-2v55A:
undetectable		 2ygnA-2v55A:
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.
2wkn FORMAMIDASE

(Delftia
acidovorans) 		PF03069
(FmdA_AmdA) 		4 ILE A 226
PHE A 237
PRO A 217
VAL A  32
 None
 1.17A 2ygnA-2wknA:
undetectable		 2ygnA-2wknA:
17.27
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.
2wy0 ANGIOTENSINOGEN

(Mus musculus) 		PF00079
(Serpin) 		4 ILE C 280
PRO C 278
VAL C 323
PHE C 267
 None
 1.11A 2ygnA-2wy0C:
undetectable		 2ygnA-2wy0C:
14.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xdq LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Thermosynechococcus
elongatus) 		PF00148
(Oxidored_nitro) 		4 ILE A 104
PRO A  23
VAL A 210
PHE A 251
 None
 1.22A 2ygnA-2xdqA:
undetectable		 2ygnA-2xdqA:
16.41
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.
2xvo SSO1725

(Sulfolobus
solfataricus) 		no annotation 4 ILE A  20
PHE A 116
VAL A  12
PHE A 129
 None
 1.15A 2ygnA-2xvoA:
undetectable		 2ygnA-2xvoA:
22.45
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.
2y9e MYOSIN-2

(Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		4 ILE X 326
PRO X 220
VAL X 381
PHE X 225
 None
 1.16A 2ygnA-2y9eX:
undetectable		 2ygnA-2y9eX:
11.21
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) 		5 ILE A  49
PHE A  66
PRO A  78
VAL A 156
PHE A 173
 PCF  A1179 (-4.8A)
PCF  A1179 (-3.8A)
PCF  A1179 (-4.3A)
None
PCF  A1179 (-3.8A)
 0.00A 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) 		5 ILE A  49
PHE A  66
PRO A  78
VAL A 156
PHE A 173
 PCF  A1213 (-4.6A)
PCF  A1213 ( 3.6A)
PCF  A1213 (-4.0A)
None
PCF  A1213 (-3.8A)
 0.26A 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) 		4 ILE A  49
PHE A  66
VAL A 156
PHE A 173
 PCF  A1275 (-4.7A)
None
None
PCF  A1275 ( 4.5A)
 0.67A 2ygnA-2ygqA:
26.1		 2ygnA-2ygqA:
48.15
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) 		4 PHE A  66
PRO A  78
VAL A 156
PHE A 173
 None
PCF  A1275 (-4.1A)
None
PCF  A1275 ( 4.5A)
 0.48A 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.
2zzw ABC TRANSPORTER,
SOLUTE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF03480
(DctP) 		4 ILE A 287
PHE A  98
PRO A 220
PHE A 228
 None
LAC  A 401 (-4.0A)
None
None
 1.09A 2ygnA-2zzwA:
undetectable		 2ygnA-2zzwA:
15.15
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.
3al0 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A
ASPARTYL/GLUTAMYL-TR
NA(ASN/GLN)
AMIDOTRANSFERASE
SUBUNIT B

(Thermotoga
maritima;
Thermotoga
maritima) 		PF01425
(Amidase)
PF02637
(GatB_Yqey)
PF02934
(GatB_N) 		4 ILE B  93
PHE B 277
VAL A 340
PHE B  83
 None
 1.07A 2ygnA-3al0B:
undetectable		 2ygnA-3al0B:
15.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c8u FRUCTOKINASE

(Ruegeria sp.
TM1040) 		no annotation 4 ILE A 193
PRO A  79
VAL A 125
PHE A  87
 None
 1.12A 2ygnA-3c8uA:
undetectable		 2ygnA-3c8uA:
22.12
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.
3dde TENA/THI-4 PROTEIN,
DOMAIN OF UNKNOWN
FUNCTION WITH A HEME
OXYGENASE-LIKE FOLD

(Shewanella
denitrificans) 		PF14518
(Haem_oxygenas_2) 		4 PHE A  26
PRO A 148
VAL A 104
PHE A 167
 None
 1.23A 2ygnA-3ddeA:
undetectable		 2ygnA-3ddeA:
19.74
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.
3e4e CYTOCHROME P450 2E1

(Homo sapiens) 		PF00067
(p450) 		4 ILE A 314
PRO A 411
VAL A  86
PHE A 403
 None
 1.11A 2ygnA-3e4eA:
undetectable		 2ygnA-3e4eA:
15.97
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.
3eay SENTRIN-SPECIFIC
PROTEASE 7

(Homo sapiens) 		PF02902
(Peptidase_C48) 		4 ILE A 737
PHE A 937
PRO A 788
VAL A 809
 None
 0.95A 2ygnA-3eayA:
undetectable		 2ygnA-3eayA:
20.38
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.
3j0h PHIKZ029

(Pseudomonas
virus phiKZ) 		no annotation 4 ILE A 108
PHE A 304
PRO A 188
PHE A 341
 None
 1.10A 2ygnA-3j0hA:
undetectable		 2ygnA-3j0hA:
18.27
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.
3le2 SERPIN-ZX

(Arabidopsis
thaliana) 		PF00079
(Serpin) 		4 ILE A  45
PHE A  60
VAL A 371
PHE A 286
 None
 1.28A 2ygnA-3le2A:
undetectable		 2ygnA-3le2A:
17.48
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.
3loy COPPER AMINE OXIDASE

(Ogataea angusta) 		PF01179
(Cu_amine_oxid) 		4 ILE A 268
PHE A 263
VAL A 609
PHE A 442
 None
 0.96A 2ygnA-3loyA:
undetectable		 2ygnA-3loyA:
13.42
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.
3lws AROMATIC AMINO ACID
BETA-ELIMINATING
LYASE/THREONINE
ALDOLASE

(Exiguobacterium
sibiricum) 		PF01212
(Beta_elim_lyase) 		4 ILE A 199
PHE A 179
VAL A  25
PHE A  51
 None
 1.13A 2ygnA-3lwsA:
undetectable		 2ygnA-3lwsA:
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.
3mes CHOLINE KINASE

(Cryptosporidium
parvum) 		PF01633
(Choline_kinase) 		4 ILE A 355
PHE A 422
PRO A 258
PHE A 293
 None
 1.27A 2ygnA-3mesA:
undetectable		 2ygnA-3mesA:
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.
3n3k UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 8

(Homo sapiens) 		PF00443
(UCH) 		4 ILE A 921
PHE A 830
VAL A1088
PHE A1105
 None
 1.00A 2ygnA-3n3kA:
undetectable		 2ygnA-3n3kA:
15.37
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.
3niz RHODANESE FAMILY
PROTEIN

(Cryptosporidium
parvum) 		PF00069
(Pkinase) 		4 ILE A 293
PHE A 304
VAL A 108
PHE A 273
 None
 1.29A 2ygnA-3nizA:
undetectable		 2ygnA-3nizA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qd9 QSOX FROM
TRYPANOSOMA BRUCEI
(TBQSOX)

(Trypanosoma
brucei) 		PF00085
(Thioredoxin)
PF04777
(Evr1_Alr) 		4 ILE A 259
PHE A 248
VAL A 379
PHE A 315
 None
 1.25A 2ygnA-3qd9A:
undetectable		 2ygnA-3qd9A:
13.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rtx MRNA-CAPPING ENZYME

(Mus musculus) 		PF01331
(mRNA_cap_enzyme)
PF03919
(mRNA_cap_C) 		4 ILE A 441
PRO A 273
VAL A 322
PHE A 268
 None
GUN  A   1 (-4.6A)
None
None
 1.27A 2ygnA-3rtxA:
undetectable		 2ygnA-3rtxA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sim PROTEIN, FAMILY 18
CHITINASE

(Crocus vernus) 		PF00704
(Glyco_hydro_18) 		4 ILE A 180
PHE A 137
VAL A  87
PHE A 162
 None
 1.03A 2ygnA-3simA:
undetectable		 2ygnA-3simA:
16.73
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.
3u7g BIFUNCTIONAL
POLYNUCLEOTIDE
PHOSPHATASE/KINASE

(Mus musculus) 		PF08645
(PNK3P)
PF13671
(AAA_33) 		4 ILE A 193
PHE A 246
VAL A 316
PHE A 326
 None
None
None
GOL  A 527 ( 4.3A)
 1.17A 2ygnA-3u7gA:
undetectable		 2ygnA-3u7gA:
17.41
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.
3umb DEHALOGENASE-LIKE
HYDROLASE

(Ralstonia
solanacearum) 		PF00702
(Hydrolase) 		4 ILE A 175
PRO A 117
VAL A  18
PHE A 142
 None
 1.09A 2ygnA-3umbA:
undetectable		 2ygnA-3umbA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3upu ATP-DEPENDENT DNA
HELICASE DDA

(Escherichia
virus T4) 		PF13604
(AAA_30) 		4 ILE A 252
PHE A 218
VAL A 186
PHE A 395
 None
 1.23A 2ygnA-3upuA:
undetectable		 2ygnA-3upuA:
15.97
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.
3vex O-CARBAMOYLTRANSFERA
SE TOBZ

(Streptoalloteichus
tenebrarius) 		PF02543
(Carbam_trans_N)
PF16861
(Carbam_trans_C) 		4 ILE A 474
PRO A 417
VAL A 351
PHE A  29
 None
None
EDO  A 606 ( 4.5A)
None
 1.23A 2ygnA-3vexA:
undetectable		 2ygnA-3vexA:
14.81
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.
3vib MTRR

(Neisseria
gonorrhoeae) 		PF00440
(TetR_N)
PF08361
(TetR_C_2) 		4 ILE A  28
PHE A  62
VAL A 163
PHE A 113
 None
 1.29A 2ygnA-3vibA:
undetectable		 2ygnA-3vibA:
20.09
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.
3w6x MPR1 PROTEIN

(Saccharomyces
cerevisiae) 		no annotation 4 ILE A  28
PHE A 120
PRO A  30
PHE A  33
 None
 1.25A 2ygnA-3w6xA:
undetectable		 2ygnA-3w6xA:
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.
3wjs NADH OXIDASE

(Gluconobacter
oxydans) 		PF00724
(Oxidored_FMN) 		4 ILE A 312
PHE A  10
VAL A 212
PHE A 285
 None
 1.19A 2ygnA-3wjsA:
undetectable		 2ygnA-3wjsA:
18.51
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.
3zef PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		4 ILE B1090
PRO B 966
VAL B1074
PHE B 964
 None
 1.12A 2ygnA-3zefB:
undetectable		 2ygnA-3zefB:
7.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4acq ALPHA-2-MACROGLOBULI
N

(Homo sapiens) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 ILE A 505
PHE A  89
VAL A  67
PHE A 678
 None
 1.17A 2ygnA-4acqA:
undetectable		 2ygnA-4acqA:
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.
4dal PUTATIVE ALDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		4 ILE A 319
PHE A 436
PRO A 382
PHE A 380
 None
 1.06A 2ygnA-4dalA:
undetectable		 2ygnA-4dalA:
15.23
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.
4etp SPINDLE POLE
BODY-ASSOCIATED
PROTEIN VIK1

(Saccharomyces
cerevisiae) 		PF16796
(Microtub_bd) 		4 ILE B 461
PHE B 572
VAL B 635
PHE B 424
 None
 1.01A 2ygnA-4etpB:
undetectable		 2ygnA-4etpB:
19.06
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.
4gfh DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae) 		PF00204
(DNA_gyraseB)
PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF02518
(HATPase_c)
PF16898
(TOPRIM_C) 		4 ILE A 308
PRO A 360
VAL A 325
PHE A 377
 None
 1.15A 2ygnA-4gfhA:
undetectable		 2ygnA-4gfhA:
8.12
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.
4i3u ALDEHYDE
DEHYDROGENASE (NAD+)

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		4 ILE A  97
PHE A 387
PRO A 160
VAL A 435
 None
 0.84A 2ygnA-4i3uA:
undetectable		 2ygnA-4i3uA:
15.42
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.
4idm DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00171
(Aldedh) 		4 ILE A 215
PHE A 246
PRO A 213
PHE A 263
 None
 1.10A 2ygnA-4idmA:
undetectable		 2ygnA-4idmA:
12.66
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.
4jso OLIGOPEPTIDE ABC
TRANSPORTER,
PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		4 ILE A 311
PRO A 435
VAL A  53
PHE A 432
 None
 1.23A 2ygnA-4jsoA:
undetectable		 2ygnA-4jsoA:
13.15
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.
4jyj ENOYL-COA
HYDRATASE/ISOMERASE

(Novosphingobium
aromaticivorans) 		PF00378
(ECH_1) 		4 ILE A 136
PRO A 163
VAL A 103
PHE A 159
 None
 1.00A 2ygnA-4jyjA:
undetectable		 2ygnA-4jyjA:
18.54
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		4 ILE A 363
PHE A 425
VAL A 249
PHE A 215
 None
 1.27A 2ygnA-4kriA:
undetectable		 2ygnA-4kriA:
16.98
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.
4kto ISOVALERYL-COA
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 ILE A 162
PRO A 166
VAL A  21
PHE A  42
 FAD  A 401 ( 4.4A)
None
None
None
 1.18A 2ygnA-4ktoA:
undetectable		 2ygnA-4ktoA:
17.27
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.
4lza ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Thermoanaerobacter
pseudethanolicus) 		PF00156
(Pribosyltran) 		4 ILE A   8
PRO A  26
VAL A  73
PHE A  34
 None
 0.88A 2ygnA-4lzaA:
undetectable		 2ygnA-4lzaA:
21.63
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.
4mm0 P450-LIKE
MONOOXYGENASE

(Streptomyces
griseoviridis) 		PF00067
(p450) 		4 ILE A 116
PRO A 140
VAL A 223
PHE A 160
 None
 0.92A 2ygnA-4mm0A:
undetectable		 2ygnA-4mm0A:
16.14
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.
4nex ACETYLGLUTAMATE
KINASE

(Xylella
fastidiosa) 		PF04768
(NAT) 		4 ILE A 437
PRO A 321
VAL A 371
PHE A 324
 None
 1.15A 2ygnA-4nexA:
undetectable		 2ygnA-4nexA:
18.82
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.
4o5m ISOVALERYL-COA
DEHYDROGENASE

(Brucella suis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 ILE A 157
PRO A 161
VAL A  16
PHE A  37
 None
 1.16A 2ygnA-4o5mA:
undetectable		 2ygnA-4o5mA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ogc HNH ENDONUCLEASE
DOMAIN PROTEIN

(Actinomyces
naeslundii) 		PF01844
(HNH) 		4 ILE A1057
PHE A1006
PRO A1039
VAL A 940
 None
 1.25A 2ygnA-4ogcA:
undetectable		 2ygnA-4ogcA:
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.
4pqg GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
pneumoniae) 		PF00534
(Glycos_transf_1) 		4 ILE A 489
PHE A  28
VAL A 228
PHE A 274
 None
 1.09A 2ygnA-4pqgA:
undetectable		 2ygnA-4pqgA:
15.07
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.
4psw HISTONE
ACETYLTRANSFERASE
TYPE B CATALYTIC
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00583
(Acetyltransf_1)
PF10394
(Hat1_N) 		4 ILE A 155
PHE A 223
PRO A  65
VAL A 124
 None
 1.00A 2ygnA-4pswA:
undetectable		 2ygnA-4pswA:
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.
4wdr HALOALKANE
DEHALOGENASE

(Sphingobium
japonicum) 		PF00561
(Abhydrolase_1) 		4 ILE A 236
PHE A 115
PRO A 261
PHE A 240
 None
 1.26A 2ygnA-4wdrA:
undetectable		 2ygnA-4wdrA:
20.14
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.
5bsh PYRROLINE-5-CARBOXYL
ATE REDUCTASE

(Medicago
truncatula) 		PF03807
(F420_oxidored)
PF14748
(P5CR_dimer) 		4 ILE A  57
PHE A  15
PRO A  37
VAL A 139
 None
 1.26A 2ygnA-5bshA:
undetectable		 2ygnA-5bshA:
17.56
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.
5c0p ENDO-ARABINASE

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		4 ILE A 313
PRO A 315
VAL A 268
PHE A 323
 None
None
GOL  A 405 (-3.8A)
None
 1.18A 2ygnA-5c0pA:
undetectable		 2ygnA-5c0pA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cmc ML032222A IGLUR

(Mnemiopsis
leidyi) 		PF10613
(Lig_chan-Glu_bd) 		4 ILE A 241
PHE A  20
VAL A 116
PHE A 212
 None
 0.96A 2ygnA-5cmcA:
undetectable		 2ygnA-5cmcA:
20.69
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.
5cmc ML032222A IGLUR

(Mnemiopsis
leidyi) 		PF10613
(Lig_chan-Glu_bd) 		4 PHE A  20
PRO A 107
VAL A 116
PHE A 212
 None
 1.11A 2ygnA-5cmcA:
undetectable		 2ygnA-5cmcA:
20.69
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.
5dzz DESMOPLAKIN

(Homo sapiens) 		PF00681
(Plectin) 		4 ILE A2263
PRO A2418
VAL A2336
PHE A2415
 None
 1.06A 2ygnA-5dzzA:
undetectable		 2ygnA-5dzzA:
13.97
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.
5ere EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Desulfohalobium
retbaense) 		PF13458
(Peripla_BP_6) 		4 PHE A 329
PRO A 338
VAL A  37
PHE A 285
 None
 1.07A 2ygnA-5ereA:
undetectable		 2ygnA-5ereA:
15.30
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 ILE A1850
PHE A1980
PRO A1929
PHE A1907
 None
 1.28A 2ygnA-5i6hA:
undetectable		 2ygnA-5i6hA:
6.78
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.
5i6i ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 ILE A1850
PHE A1980
PRO A1929
PHE A1907
 None
 1.21A 2ygnA-5i6iA:
undetectable		 2ygnA-5i6iA:
5.26
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.
5lhe N-(5'-PHOSPHORIBOSYL
)ANTHRANILATE
ISOMERASE

(Thermococcus
kodakarensis) 		PF00697
(PRAI) 		4 ILE A 173
PHE A 201
VAL A  29
PHE A   4
 None
 1.16A 2ygnA-5lheA:
undetectable		 2ygnA-5lheA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ui2 ORANGE
CAROTENOID-BINDING
PROTEIN

(Arthrospira
maxima) 		PF02136
(NTF2)
PF09150
(Carot_N) 		4 ILE A 288
PHE A 292
PRO A 228
PHE A 243
 None
 1.28A 2ygnA-5ui2A:
undetectable		 2ygnA-5ui2A:
18.51
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.
5xbi PROBABLE
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		no annotation 4 ILE A 146
PHE A 225
PRO A 219
VAL A 125
 81U  A 500 (-3.7A)
81U  A 500 ( 4.6A)
81U  A 500 ( 4.2A)
None
 1.29A 2ygnA-5xbiA:
undetectable		 2ygnA-5xbiA:
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.
5xsy SODIUM CHANNEL
PROTEIN

(Electrophorus
electricus) 		PF00520
(Ion_trans)
PF06512
(Na_trans_assoc) 		4 ILE A1566
PHE A 785
VAL A1135
PHE A1555
 None
 1.11A 2ygnA-5xsyA:
undetectable		 2ygnA-5xsyA:
6.86
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.
5xtb NADH-UBIQUINONE
OXIDOREDUCTASE 75
KDA SUBUNIT,
MITOCHONDRIAL
NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
6, MITOCHONDRIAL

(Homo sapiens;
Homo sapiens) 		PF00384
(Molybdopterin)
PF09326
(NADH_dhqG_C)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4)
PF10276
(zf-CHCC) 		4 ILE M 223
PRO M 235
VAL T  99
PHE M 238
 None
 1.29A 2ygnA-5xtbM:
undetectable		 2ygnA-5xtbM:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yud BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 1E

(Mus musculus) 		no annotation 4 ILE A1201
PHE A1188
VAL A1267
PHE A1227
 None
 1.12A 2ygnA-5yudA:
undetectable		 2ygnA-5yudA:
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.
6b0k IOTA-CARRAGEENAN
SULFATASE

(Pseudoalteromonas) 		no annotation 4 ILE A 372
PHE A  68
VAL A 268
PHE A 348
 ARG  A 507 (-3.6A)
None
None
None
 1.08A 2ygnA-6b0kA:
undetectable		 2ygnA-6b0kA:
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.
6cip PYRUVATE-FERREDOXIN
OXIDOREDUCTASE

(Moorella
thermoacetica) 		no annotation 4 ILE A 403
PHE A 367
VAL A 342
PHE A 376
 None
 1.19A 2ygnA-6cipA:
undetectable		 2ygnA-6cipA:
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.
6dg4 ULP1-LIKE SUMO
PROTEASE

(Chaetomium
thermophilum) 		no annotation 4 PHE A 122
PRO A 105
VAL A  76
PHE A  92
 None
 1.12A 2ygnA-6dg4A:
undetectable		 2ygnA-6dg4A:
undetectable