SIMILAR PATTERNS OF AMINO ACIDS FOR 2YGQ_A_PCFA1275

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.
1c30 CARBAMOYL PHOSPHATE
SYNTHETASE: LARGE
SUBUNIT


(Escherichia
coli)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3)
5 ILE A 439
ILE A 359
PRO A 360
PHE A 409
PHE A 497
None
0.97A 2ygqA-1c30A:
0.0
2ygqA-1c30A:
14.13
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.
1di6 MOLYBDENUM COFACTOR
BIOSYNTHETIC ENZYME


(Escherichia
coli)
PF00994
(MoCF_biosynth)
5 LEU A  58
ILE A  11
PRO A  26
ILE A 139
PRO A 136
None
0.99A 2ygqA-1di6A:
0.0
2ygqA-1di6A:
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.
1elv COMPLEMENT C1S
COMPONENT


(Homo sapiens)
PF00084
(Sushi)
PF00089
(Trypsin)
6 ILE A 660
LEU A 535
ILE A 515
ILE A 533
PHE A 440
VAL A 461
None
1.28A 2ygqA-1elvA:
0.0
2ygqA-1elvA:
18.57
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.
1f51 SPORULATION
INITIATION
PHOSPHOTRANSFERASE F


(Bacillus
subtilis)
PF00072
(Response_reg)
5 ILE E1311
LEU E1252
ILE E1308
MET E1281
PHE E1306
None
0.84A 2ygqA-1f51E:
undetectable
2ygqA-1f51E:
15.56
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.
1h2s SENSORY RHODOPSIN II
SENSORY RHODOPSIN II
TRANSDUCER


(Natronomonas
pharaonis;
Natronomonas
pharaonis)
PF01036
(Bac_rhodopsin)
no annotation
5 ILE B  69
LEU A 188
ILE A 173
PRO A 190
VAL A 203
None
0.95A 2ygqA-1h2sB:
undetectable
2ygqA-1h2sB:
11.22
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.
1j83 ENDO-1,4-BETA
GLUCANASE ENGF


(Clostridium
cellulovorans)
PF03424
(CBM_17_28)
5 ILE A1071
ILE A1163
MET A1112
PHE A1149
VAL A1120
None
1.01A 2ygqA-1j83A:
0.2
2ygqA-1j83A:
16.87
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.
1jd0 CARBONIC ANHYDRASE
XII


(Homo sapiens)
PF00194
(Carb_anhydrase)
5 LEU A 164
ILE A 160
LEU A 184
PRO A 186
PHE A 161
None
1.05A 2ygqA-1jd0A:
undetectable
2ygqA-1jd0A:
17.13
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.
1jsc ACETOHYDROXY-ACID
SYNTHASE


(Saccharomyces
cerevisiae)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 ILE A 125
MET A 102
PHE A  98
PHE A 234
VAL A 220
None
1.01A 2ygqA-1jscA:
undetectable
2ygqA-1jscA:
18.64
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.
1n5x XANTHINE
DEHYDROGENASE


(Bos taurus)
PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C)
5 LEU A 372
ILE A 409
ILE A 407
PHE A 365
PHE A 390
None
0.96A 2ygqA-1n5xA:
0.0
2ygqA-1n5xA:
12.74
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.
1n5x XANTHINE
DEHYDROGENASE


(Bos taurus)
PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C)
5 LEU A 372
ILE A 409
LEU A 312
ILE A 407
PHE A 365
None
1.00A 2ygqA-1n5xA:
0.0
2ygqA-1n5xA:
12.74
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.
1ozh ACETOLACTATE
SYNTHASE, CATABOLIC


(Klebsiella
pneumoniae)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 ILE A 279
ILE A 281
ILE A 335
PHE A 212
VAL A 248
None
None
None
None
PGE  A1403 ( 4.1A)
1.01A 2ygqA-1ozhA:
0.0
2ygqA-1ozhA:
19.10
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.
1ozh ACETOLACTATE
SYNTHASE, CATABOLIC


(Klebsiella
pneumoniae)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 LEU A 214
ILE A 279
ILE A 281
ILE A 335
PHE A 212
None
0.88A 2ygqA-1ozhA:
0.0
2ygqA-1ozhA:
19.10
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.
1px8 BETA-XYLOSIDASE

(Thermoanaerobacterium
saccharolyticum)
PF01229
(Glyco_hydro_39)
5 ILE A 100
LEU A  57
ILE A 186
ILE A  82
PHE A  86
None
1.01A 2ygqA-1px8A:
undetectable
2ygqA-1px8A:
18.11
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.
1pzx HYPOTHETICAL PROTEIN
APC36103


(Geobacillus
stearothermophilus)
PF02645
(DegV)
5 LEU A 260
ILE A 231
LEU A 226
ILE A 233
PHE A 258
None
0.96A 2ygqA-1pzxA:
undetectable
2ygqA-1pzxA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ty2 PUTATIVE EXOTOXIN
(SUPERANTIGEN)


(Streptococcus
pyogenes)
PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C)
6 LEU A  33
ILE A  30
ILE A 128
PRO A 127
PHE A  64
VAL A  56
None
1.37A 2ygqA-1ty2A:
undetectable
2ygqA-1ty2A:
18.60
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.
1um8 ATP-DEPENDENT CLP
PROTEASE ATP-BINDING
SUBUNIT CLPX


(Helicobacter
pylori)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
6 ILE A 216
LEU A 326
ILE A 213
ILE A 327
PRO A 328
VAL A 188
None
1.40A 2ygqA-1um8A:
undetectable
2ygqA-1um8A:
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.
1x0m AMINOTRANSFERASE II
HOMOLOGUE


(Pyrococcus
horikoshii)
PF00155
(Aminotran_1_2)
6 LEU A 141
ILE A 136
LEU A 264
PRO A 204
PRO A 238
PHE A 161
None
1.35A 2ygqA-1x0mA:
undetectable
2ygqA-1x0mA:
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.
1zlt SERINE/THREONINE-PRO
TEIN KINASE CHK1


(Homo sapiens)
PF00069
(Pkinase)
5 LEU A 137
ILE A 146
LEU A 121
ILE A  58
VAL A  23
HYM  A 400 (-4.5A)
None
None
None
HYM  A 400 (-4.3A)
1.08A 2ygqA-1zltA:
undetectable
2ygqA-1zltA:
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.
2bzu FIBER PROTEIN 2

(Human
mastadenovirus
F)
PF00541
(Adeno_knob)
5 LEU A 254
ILE A 269
LEU A 284
ILE A 267
PHE A 290
None
1.06A 2ygqA-2bzuA:
undetectable
2ygqA-2bzuA:
21.75
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.
2e47 TIME INTERVAL
MEASURING ENZYME
TIME


(Bombyx mori)
PF00080
(Sod_Cu)
5 ILE A 101
ILE A  39
ILE A 153
PHE A  49
VAL A 148
None
1.00A 2ygqA-2e47A:
undetectable
2ygqA-2e47A:
17.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gv8 MONOOXYGENASE

(Schizosaccharomyces
pombe)
PF00743
(FMO-like)
PF13450
(NAD_binding_8)
5 LEU A 231
LEU A 278
ILE A 239
PRO A 258
ILE A 260
None
0.97A 2ygqA-2gv8A:
undetectable
2ygqA-2gv8A:
18.20
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.
2h0e TRANSTHYRETIN-LIKE
PROTEIN PUCM


(Bacillus
subtilis)
PF00576
(Transthyretin)
6 ILE A  29
LEU A  54
ILE A  15
MET A  67
PHE A  69
PHE A  95
None
1.10A 2ygqA-2h0eA:
undetectable
2ygqA-2h0eA:
15.65
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.
2hrz NUCLEOSIDE-DIPHOSPHA
TE-SUGAR EPIMERASE


(Agrobacterium
fabrum)
PF01370
(Epimerase)
5 LEU A  44
ILE A  11
LEU A  34
ILE A  13
PHE A  42
None
1.02A 2ygqA-2hrzA:
undetectable
2ygqA-2hrzA:
22.36
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.
2pg0 ACYL-COA
DEHYDROGENASE


(Geobacillus
kaustophilus)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
6 LEU A  56
ILE A  42
ILE A  77
PRO A  58
PHE A  46
PHE A  21
None
1.41A 2ygqA-2pg0A:
undetectable
2ygqA-2pg0A:
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.
2q5o PHENYLPYRUVATE
DECARBOXYLASE


(Azospirillum
brasilense)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 ILE A  96
LEU A  11
ILE A 163
ILE A  39
PHE A  30
None
1.01A 2ygqA-2q5oA:
undetectable
2ygqA-2q5oA:
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.
2qxl HEAT SHOCK PROTEIN
HOMOLOG SSE1


(Saccharomyces
cerevisiae)
PF00012
(HSP70)
5 LEU A 366
ILE A 372
ILE A 341
PHE A 216
VAL A 199
None
0.79A 2ygqA-2qxlA:
undetectable
2ygqA-2qxlA:
17.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vvf MAJOR CAPSID PROTEIN
P2


(Pseudoalteromonas
virus PM2)
no annotation 5 ILE A 177
ILE A 246
PRO A 165
ILE A 172
PHE A 223
None
0.99A 2ygqA-2vvfA:
undetectable
2ygqA-2vvfA:
20.18
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.
2whx SERINE
PROTEASE/NTPASE/HELI
CASE NS3


(Dengue virus)
PF00949
(Peptidase_S7)
PF07652
(Flavi_DEAD)
5 LEU A  65
ILE A  58
PRO A 102
ILE A 100
PHE A  46
None
1.07A 2ygqA-2whxA:
undetectable
2ygqA-2whxA:
18.15
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)
11 LEU A  38
ILE A  40
ILE A  57
PRO A  78
ILE A  80
PRO A  81
MET A  87
PHE A  89
PHE A 103
PHE A 138
VAL A 154
PCF  A1179 ( 4.0A)
None
PCF  A1179 ( 4.7A)
PCF  A1179 (-4.3A)
None
None
PCF  A1179 (-3.6A)
PCF  A1179 ( 3.8A)
None
None
PCF  A1179 ( 4.7A)
0.42A 2ygqA-2ygnA:
26.1
2ygqA-2ygnA:
48.15
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)
9 LEU A  38
ILE A  40
LEU A  48
ILE A  57
MET A  87
PHE A  89
PHE A 103
PHE A 138
VAL A 154
PCF  A1179 ( 4.0A)
None
PCF  A1179 (-4.1A)
PCF  A1179 ( 4.7A)
PCF  A1179 (-3.6A)
PCF  A1179 ( 3.8A)
None
None
PCF  A1179 ( 4.7A)
0.66A 2ygqA-2ygnA:
26.1
2ygqA-2ygnA:
48.15
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)
6 LEU A  38
ILE A  40
PRO A  81
PHE A  89
PHE A 103
VAL A 154
PCF  A1179 ( 4.0A)
None
None
PCF  A1179 ( 3.8A)
None
PCF  A1179 ( 4.7A)
1.29A 2ygqA-2ygnA:
26.1
2ygqA-2ygnA:
48.15
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  38
ILE A  40
ILE A  57
PRO A  78
ILE A  80
PRO A  81
MET A  87
PHE A  89
PHE A 103
PHE A 138
VAL A 154
PCF  A1213 ( 3.9A)
None
PCF  A1213 ( 4.8A)
PCF  A1213 (-4.0A)
None
None
PCF  A1213 ( 3.8A)
PCF  A1213 (-4.1A)
None
None
PCF  A1213 ( 4.7A)
0.52A 2ygqA-2ygoA:
26.4
2ygqA-2ygoA:
58.02
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 LEU A  38
ILE A  40
LEU A  48
ILE A  57
MET A  87
PHE A  89
PHE A 103
VAL A 154
PCF  A1213 ( 3.9A)
None
PCF  A1213 (-4.3A)
PCF  A1213 ( 4.8A)
PCF  A1213 ( 3.8A)
PCF  A1213 (-4.1A)
None
PCF  A1213 ( 4.7A)
0.64A 2ygqA-2ygoA:
26.4
2ygqA-2ygoA:
58.02
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)
6 LEU A  38
ILE A  40
PRO A  81
PHE A  89
PHE A 103
VAL A 154
PCF  A1213 ( 3.9A)
None
None
PCF  A1213 (-4.1A)
None
PCF  A1213 ( 4.7A)
1.38A 2ygqA-2ygoA:
26.4
2ygqA-2ygoA:
58.02
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)
12 LEU A  38
ILE A  40
LEU A  48
ILE A  57
PRO A  78
ILE A  80
PRO A  81
MET A  87
PHE A  89
PHE A 103
PHE A 138
VAL A 154
None
None
PCF  A1275 (-4.6A)
PCF  A1275 ( 4.5A)
PCF  A1275 (-4.1A)
PCF  A1275 (-4.7A)
PCF  A1275 (-4.6A)
PCF  A1275 (-3.2A)
PCF  A1275 (-4.6A)
PCF  A1275 (-4.6A)
None
PCF  A1275 (-4.9A)
0.00A 2ygqA-2ygqA:
38.3
2ygqA-2ygqA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z83 HELICASE/NUCLEOSIDE
TRIPHOSPHATASE


(Japanese
encephalitis
virus)
PF00271
(Helicase_C)
PF07652
(Flavi_DEAD)
5 ILE A 204
LEU A 194
ILE A 208
PRO A 319
VAL A 260
None
0.98A 2ygqA-2z83A:
undetectable
2ygqA-2z83A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zts PUTATIVE
UNCHARACTERIZED
PROTEIN PH0186


(Pyrococcus
horikoshii)
PF06745
(ATPase)
5 LEU A  35
ILE A 176
PRO A  61
ILE A  94
PHE A  85
None
0.93A 2ygqA-2ztsA:
undetectable
2ygqA-2ztsA:
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.
3a2b SERINE
PALMITOYLTRANSFERASE


(Sphingobacterium
multivorum)
PF00155
(Aminotran_1_2)
5 ILE A 383
ILE A 379
PRO A 328
ILE A 366
MET A 386
None
1.00A 2ygqA-3a2bA:
undetectable
2ygqA-3a2bA:
20.63
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.
3aov PUTATIVE
UNCHARACTERIZED
PROTEIN PH0207


(Pyrococcus
horikoshii)
PF00155
(Aminotran_1_2)
6 LEU A 141
ILE A 136
LEU A 264
PRO A 204
PRO A 238
PHE A 161
None
None
None
None
PLP  A 429 (-4.5A)
None
1.33A 2ygqA-3aovA:
undetectable
2ygqA-3aovA:
21.21
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.
3b9j XANTHINE OXIDASE

(Bos taurus)
PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C)
5 LEU B 372
ILE B 409
ILE B 407
PHE B 365
PHE B 390
None
1.02A 2ygqA-3b9jB:
undetectable
2ygqA-3b9jB:
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.
3b9j XANTHINE OXIDASE

(Bos taurus)
PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C)
5 LEU B 372
ILE B 409
LEU B 312
ILE B 407
PHE B 365
None
1.03A 2ygqA-3b9jB:
undetectable
2ygqA-3b9jB:
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.
3bqr DEATH-ASSOCIATED
PROTEIN KINASE 3


(Homo sapiens)
PF00069
(Pkinase)
5 LEU A 210
ILE A 123
LEU A 159
ILE A 206
ILE A 160
None
None
None
None
4RB  A 401 (-3.5A)
1.04A 2ygqA-3bqrA:
undetectable
2ygqA-3bqrA:
19.69
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.
3cc8 PUTATIVE
METHYLTRANSFERASE


(Bacillus cereus)
PF13489
(Methyltransf_23)
5 LEU A 105
ILE A  38
LEU A  36
ILE A 119
PHE A  98
None
1.06A 2ygqA-3cc8A:
undetectable
2ygqA-3cc8A:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ciy TOLL-LIKE RECEPTOR 3

(Mus musculus)
PF00560
(LRR_1)
PF13855
(LRR_8)
5 LEU A 357
LEU A 386
ILE A 367
MET A 362
PHE A 333
None
1.00A 2ygqA-3ciyA:
undetectable
2ygqA-3ciyA:
15.67
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.
3fe1 HEAT SHOCK 70 KDA
PROTEIN 6


(Homo sapiens)
PF00012
(HSP70)
5 ILE A 299
LEU A 276
ILE A 345
PRO A 346
PHE A 312
None
None
ADP  A 386 (-4.8A)
None
None
1.06A 2ygqA-3fe1A:
undetectable
2ygqA-3fe1A:
20.28
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.
3j0a TOLL-LIKE RECEPTOR 5

(Homo sapiens)
PF01582
(TIR)
PF13855
(LRR_8)
5 LEU A 150
ILE A 157
PHE A 177
PHE A 201
VAL A 185
None
0.94A 2ygqA-3j0aA:
undetectable
2ygqA-3j0aA:
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.
3k5s CADHERIN-13

(Gallus gallus)
PF00028
(Cadherin)
5 LEU A  65
ILE A  95
LEU A  93
ILE A   9
ILE A  52
LEU  A  65 ( 0.5A)
ILE  A  95 ( 0.6A)
LEU  A  93 ( 0.6A)
ILE  A   9 ( 0.7A)
ILE  A  52 ( 0.6A)
0.97A 2ygqA-3k5sA:
undetectable
2ygqA-3k5sA:
18.94
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.
3k60 HEAT SHOCK PROTEIN
86


(Plasmodium
falciparum)
PF00183
(HSP90)
PF02518
(HATPase_c)
5 LEU A  34
LEU A  89
ILE A 173
PHE A 124
PHE A   8
None
0.88A 2ygqA-3k60A:
undetectable
2ygqA-3k60A:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k6d T-CADHERIN

(Xenopus laevis)
PF00028
(Cadherin)
5 LEU A  65
ILE A  95
LEU A  93
ILE A   9
ILE A  52
None
0.95A 2ygqA-3k6dA:
undetectable
2ygqA-3k6dA:
15.02
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.
3k6i T-CADHERIN

(Gallus gallus)
PF00028
(Cadherin)
5 LEU A  65
ILE A  95
LEU A  93
ILE A   9
ILE A  52
None
1.04A 2ygqA-3k6iA:
undetectable
2ygqA-3k6iA:
16.29
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.
3khn MOTB PROTEIN,
PUTATIVE


(Desulfovibrio
vulgaris)
PF00691
(OmpA)
5 LEU A 160
ILE A  87
ILE A  85
PHE A 158
PHE A  27
None
0.97A 2ygqA-3khnA:
undetectable
2ygqA-3khnA:
20.73
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.
3l4i HEAT SHOCK 70
(HSP70) PROTEIN


(Cryptosporidium
parvum)
PF00012
(HSP70)
5 ILE A 314
LEU A 291
ILE A 360
PRO A 361
PHE A 327
None
None
ADP  A 401 ( 4.9A)
None
None
1.07A 2ygqA-3l4iA:
undetectable
2ygqA-3l4iA:
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.
3lvv GLUTAMATE--CYSTEINE
LIGASE


(Saccharomyces
cerevisiae)
PF03074
(GCS)
5 ILE A 561
LEU A 489
ILE A 553
PHE A 471
VAL A 513
None
1.02A 2ygqA-3lvvA:
undetectable
2ygqA-3lvvA:
17.45
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.
3o6o HEAT SHOCK PROTEIN
83


(Trypanosoma
brucei)
PF00183
(HSP90)
PF02518
(HATPase_c)
5 LEU A  33
LEU A  88
ILE A 171
PHE A 123
PHE A   7
None
94M  A 214 (-4.5A)
None
94M  A 214 (-3.7A)
None
0.79A 2ygqA-3o6oA:
undetectable
2ygqA-3o6oA:
19.94
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.
3p13 D-RIBOSE PYRANASE

(Staphylococcus
aureus)
PF05025
(RbsD_FucU)
5 ILE A  90
LEU A  61
ILE A  96
ILE A  28
PHE A  53
None
1.04A 2ygqA-3p13A:
undetectable
2ygqA-3p13A:
17.79
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.
3rhd LACTALDEHYDE
DEHYDROGENASE


(Methanocaldococcus
jannaschii)
PF00171
(Aldedh)
5 ILE A 249
LEU A 251
ILE A 387
ILE A 287
VAL A 358
None
1.07A 2ygqA-3rhdA:
undetectable
2ygqA-3rhdA:
21.26
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.
3she MAP KINASE-ACTIVATED
PROTEIN KINASE 3


(Homo sapiens)
PF00069
(Pkinase)
6 ILE A 130
LEU A 321
ILE A 146
PRO A 240
PHE A 138
VAL A 310
None
1.33A 2ygqA-3sheA:
undetectable
2ygqA-3sheA:
20.11
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.
3u6n HIGH-CONDUCTANCE
CA2+-ACTIVATED K+
CHANNEL PROTEIN


(Danio rerio)
PF02254
(TrkA_N)
PF03493
(BK_channel_a)
5 LEU A 927
ILE A 937
ILE A 566
MET A 536
PHE A 511
None
0.91A 2ygqA-3u6nA:
undetectable
2ygqA-3u6nA:
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.
3uj2 ENOLASE 1

(Anaerostipes
caccae)
PF00113
(Enolase_C)
PF03952
(Enolase_N)
5 LEU A 132
ILE A 411
LEU A 144
PRO A 147
VAL A 348
None
1.05A 2ygqA-3uj2A:
undetectable
2ygqA-3uj2A:
20.96
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.
3wwh (R)-AMINE
TRANSAMINASE


(Arthrobacter
sp. KNK168)
PF01063
(Aminotran_4)
5 LEU A 219
LEU A 252
ILE A 267
ILE A 310
VAL A 293
None
0.81A 2ygqA-3wwhA:
undetectable
2ygqA-3wwhA:
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.
4d8m PESTICIDAL CRYSTAL
PROTEIN CRY5BA


(Bacillus
thuringiensis)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N)
5 ILE A 678
LEU A 688
PRO A 565
PHE A 627
VAL A 667
None
0.99A 2ygqA-4d8mA:
undetectable
2ygqA-4d8mA:
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.
4dhz UBIQUITIN
THIOESTERASE
OTUBAIN-LIKE


(Caenorhabditis
elegans;
Homo sapiens)
PF10275
(Peptidase_C65)
5 ILE A 169
LEU A  94
ILE A 159
PHE A 142
VAL A 150
None
1.04A 2ygqA-4dhzA:
undetectable
2ygqA-4dhzA:
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.
4fvv NEUROTOXIN

(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
5 LEU A 870
ILE A 936
ILE A 954
PHE A1069
VAL A 889
None
0.92A 2ygqA-4fvvA:
undetectable
2ygqA-4fvvA:
18.84
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.
4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT


(Caldanaerobacter
subterraneus)
PF00005
(ABC_tran)
PF08352
(oligo_HPY)
5 ILE B 255
ILE B 242
ILE B 271
PRO B 270
VAL B 314
None
1.06A 2ygqA-4fwiB:
undetectable
2ygqA-4fwiB:
21.99
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.
4gip FUSION GLYCOPROTEIN
F2
FUSION GLYCOPROTEIN
F1


(Mammalian
rubulavirus 5;
Mammalian
rubulavirus 5)
PF00523
(Fusion_gly)
PF00523
(Fusion_gly)
5 LEU D 413
ILE D 405
ILE A  31
PRO A  32
PHE D 365
None
0.94A 2ygqA-4gipD:
undetectable
2ygqA-4gipD:
21.74
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.
4gq2 NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe)
PF11715
(Nup160)
5 ILE M 463
LEU M 741
ILE M 433
PHE M 505
VAL M 509
None
0.96A 2ygqA-4gq2M:
undetectable
2ygqA-4gq2M:
13.65
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.
4gqt HEAT SHOCK PROTEIN
90


(Caenorhabditis
elegans)
PF00183
(HSP90)
PF02518
(HATPase_c)
5 LEU A  36
LEU A  91
ILE A 174
PHE A 126
PHE A  10
None
0.82A 2ygqA-4gqtA:
undetectable
2ygqA-4gqtA:
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.
4hwi HEAT SHOCK COGNATE
71 KDA PROTEIN


(Homo sapiens)
PF00012
(HSP70)
5 ILE A 297
LEU A 274
ILE A 343
PRO A 344
PHE A 310
None
1.07A 2ygqA-4hwiA:
undetectable
2ygqA-4hwiA:
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.
4jmo CYTOHESIN-2

(Homo sapiens)
PF01369
(Sec7)
5 ILE A 193
LEU A 148
ILE A 245
PRO A 246
VAL A 204
JAF  A 301 (-3.7A)
JAF  A 301 (-3.9A)
JAF  A 301 (-3.9A)
JAF  A 301 (-4.7A)
None
0.99A 2ygqA-4jmoA:
undetectable
2ygqA-4jmoA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA


(Shewanella
oneidensis)
no annotation 6 LEU A 411
ILE A 484
LEU A 467
PHE A 413
PHE A 543
VAL A 502
None
1.13A 2ygqA-4lmhA:
undetectable
2ygqA-4lmhA:
17.08
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.
4mjk CRISPR PROTEIN

(Archaeoglobus
fulgidus)
PF09704
(Cas_Cas5d)
5 LEU A 132
ILE A  69
PRO A  78
PHE A  10
VAL A  40
None
0.96A 2ygqA-4mjkA:
undetectable
2ygqA-4mjkA:
19.22
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.
4mlo TCP PILUS VIRULENCE
REGULATORY PROTEIN


(Vibrio cholerae)
PF00165
(HTH_AraC)
5 ILE A  59
LEU A 114
ILE A  58
ILE A  27
VAL A 131
None
1.05A 2ygqA-4mloA:
1.2
2ygqA-4mloA:
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.
4mq0 PARKIA BIGLOBOSA
LECTIN (PBL)


(Parkia
biglobosa)
PF01419
(Jacalin)
5 LEU A 139
ILE A  95
ILE A 121
PRO A 122
PHE A  43
None
0.93A 2ygqA-4mq0A:
undetectable
2ygqA-4mq0A:
21.98
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.
4pd4 CYTOCHROME B

(Saccharomyces
cerevisiae)
PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B)
5 ILE C 125
LEU C 275
ILE C 122
PHE C 121
PHE C 333
AOQ  C4003 ( 4.4A)
AOQ  C4003 (-3.8A)
None
3PH  C4006 ( 4.6A)
3PH  C4006 (-4.1A)
1.01A 2ygqA-4pd4C:
undetectable
2ygqA-4pd4C:
21.11
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.
4qnn PHOSPHOLIPASE A 1
FROM HORNET(VESPA
BASALIS) VENOM


(Vespa basalis)
PF00151
(Lipase)
5 LEU A 133
ILE A  80
ILE A  31
PHE A  48
PHE A  37
None
1.01A 2ygqA-4qnnA:
undetectable
2ygqA-4qnnA:
22.38
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.
4x9l HEAT SHOCK PROTEIN

(Oryza sativa)
PF00183
(HSP90)
PF02518
(HATPase_c)
5 LEU A  36
LEU A  91
ILE A 175
PHE A 126
PHE A  10
None
0.94A 2ygqA-4x9lA:
undetectable
2ygqA-4x9lA:
20.60
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.
4zow MULTIDRUG
TRANSPORTER MDFA


(Escherichia
coli)
PF07690
(MFS_1)
5 ILE A 122
LEU A  22
ILE A 142
MET A 146
VAL A 335
None
0.97A 2ygqA-4zowA:
undetectable
2ygqA-4zowA:
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.
5a0t RIBONUCLEASE J

(Streptomyces
coelicolor)
PF00753
(Lactamase_B)
PF07521
(RMMBL)
6 LEU A  44
ILE A 103
LEU A  97
ILE A 115
PHE A 146
VAL A 159
None
1.08A 2ygqA-5a0tA:
undetectable
2ygqA-5a0tA:
18.83
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.
5bop OCTARELLIN V.1

(synthetic
construct)
no annotation 5 ILE B 129
LEU B   4
ILE B 100
ILE B   5
PHE B  45
None
1.06A 2ygqA-5bopB:
undetectable
2ygqA-5bopB:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eul PROTEIN TRANSLOCASE
SUBUNIT SECY


(Geobacillus
thermodenitrificans)
PF00344
(SecY)
5 ILE Y 228
LEU Y 402
PRO Y 382
ILE Y 378
PHE Y 374
None
1.07A 2ygqA-5eulY:
undetectable
2ygqA-5eulY:
20.84
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.
5f5r HEAT SHOCK PROTEIN
75 KDA,
MITOCHONDRIAL


(Homo sapiens)
PF13589
(HATPase_c_3)
5 LEU A 116
LEU A 168
ILE A 253
PHE A 205
PHE A  90
None
0.86A 2ygqA-5f5rA:
undetectable
2ygqA-5f5rA:
19.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fpn HEAT SHOCK-RELATED
70 KDA PROTEIN 2


(Homo sapiens)
PF00012
(HSP70)
5 ILE A 299
LEU A 276
ILE A 345
PRO A 346
PHE A 312
None
None
KYD  A1386 ( 4.2A)
None
None
1.05A 2ygqA-5fpnA:
undetectable
2ygqA-5fpnA:
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.
5h71 ALGQ2

(Sphingomonas
sp.)
PF01547
(SBP_bac_1)
5 LEU A  13
ILE A 319
LEU A  92
PRO A 128
ILE A 103
None
1.07A 2ygqA-5h71A:
undetectable
2ygqA-5h71A:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l22 ABC TRANSPORTER
(HLYB SUBFAMILY)


(Aquifex
aeolicus)
no annotation 5 LEU B 349
ILE B 522
PRO B 341
PHE B 405
VAL B 409
None
None
ADP  B 601 (-4.1A)
None
None
1.07A 2ygqA-5l22B:
undetectable
2ygqA-5l22B:
19.48
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.
5lxr RNA-BINDING PROTEIN
7
ZINC FINGER CCHC
DOMAIN-CONTAINING
PROTEIN 8


(Homo sapiens;
Homo sapiens)
PF00076
(RRM_1)
PF04046
(PSP)
5 ILE A  73
ILE A  80
ILE B 291
PHE A  57
VAL A  55
None
0.91A 2ygqA-5lxrA:
undetectable
2ygqA-5lxrA:
14.06
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.
5moy BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
6 ILE A1053
LEU A 928
ILE A 965
ILE A 878
PHE A1072
VAL A1017
None
1.43A 2ygqA-5moyA:
undetectable
2ygqA-5moyA:
18.37
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.
5my5 ABC TRANSPORTER
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN


(Desulfovibrio
alaskensis)
PF12849
(PBP_like_2)
6 LEU A   5
LEU A  79
ILE A  55
ILE A 235
MET A 226
PHE A 222
None
1.50A 2ygqA-5my5A:
undetectable
2ygqA-5my5A:
20.65
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.
5nem INTEGRIN BETA-6

(Homo sapiens)
PF00362
(Integrin_beta)
PF17205
(PSI_integrin)
5 LEU B 424
ILE B 413
LEU B 366
ILE B 415
PRO B 404
None
0.95A 2ygqA-5nemB:
undetectable
2ygqA-5nemB:
21.51
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.
5nvr TELOMERE LENGTH
REGULATOR PROTEIN
RIF1


(Saccharomyces
cerevisiae)
PF12231
(Rif1_N)
5 ILE A 579
LEU A 595
ILE A 652
PRO A 651
PHE A 602
None
1.04A 2ygqA-5nvrA:
undetectable
2ygqA-5nvrA:
13.43
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.
5tpc BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
6 ILE A1053
LEU A 928
ILE A 965
ILE A 878
PHE A1072
VAL A1017
None
1.42A 2ygqA-5tpcA:
undetectable
2ygqA-5tpcA:
18.99
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.
5u4s PUTATIVE SHORT CHAIN
DEHYDROGENASE


(Burkholderia
cenocepacia)
PF00106
(adh_short)
5 ILE A  55
ILE A  57
PRO A 117
ILE A  73
VAL A 129
None
NAP  A 300 (-4.1A)
None
None
NAP  A 300 (-4.8A)
1.06A 2ygqA-5u4sA:
undetectable
2ygqA-5u4sA:
17.99
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.
5uqd DUMPY: SHORTER THAN
WILD-TYPE


(Caenorhabditis
elegans)
no annotation 6 LEU A1579
LEU A1383
PRO A1388
ILE A1386
PHE A1279
VAL A1530
None
1.28A 2ygqA-5uqdA:
undetectable
2ygqA-5uqdA:
19.14
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.
5uqi PHOSPHOSUGAR
ISOMERASE


(Escherichia
coli)
no annotation 5 LEU A 172
ILE A  36
ILE A 141
PRO A 142
VAL A  46
None
0.97A 2ygqA-5uqiA:
undetectable
2ygqA-5uqiA:
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.
5v38 HCHA

(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
6 ILE A1045
LEU A 918
ILE A 953
ILE A 866
PHE A1064
VAL A1009
None
None
None
ACY  A1304 ( 4.9A)
None
None
1.40A 2ygqA-5v38A:
undetectable
2ygqA-5v38A:
18.91
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.
5vbu CYTOCHROME P450
21-HYDROXYLASE


(Homo sapiens)
PF00067
(p450)
5 LEU A 439
LEU A 452
PRO A 454
PHE A 477
VAL A 359
None
None
None
None
HEM  A 501 (-4.7A)
0.96A 2ygqA-5vbuA:
undetectable
2ygqA-5vbuA:
18.26
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.
5wx8 IMMEDIATE-EARLY
PROTEIN 2


(Human
betaherpesvirus
6A)
PF03361
(Herpes_IE2_3)
5 ILE A1466
ILE A1367
ILE A1354
MET A1356
PHE A1358
None
1.07A 2ygqA-5wx8A:
undetectable
2ygqA-5wx8A:
19.16
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.
5xvm STEROL
3-BETA-GLUCOSYLTRANS
FERASE


(Saccharomyces
cerevisiae)
PF00201
(UDPGT)
PF03033
(Glyco_transf_28)
5 LEU A 744
ILE A 843
LEU A1159
ILE A 845
PHE A 742
None
1.04A 2ygqA-5xvmA:
undetectable
2ygqA-5xvmA:
19.11
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.
6aom ENDOPLASMIN

(Canis lupus)
no annotation 5 LEU A 104
LEU A 159
ILE A 247
PHE A 199
PHE A  78
VC5  A 409 (-4.5A)
None
VC5  A 409 (-4.4A)
VC5  A 409 (-4.2A)
None
0.94A 2ygqA-6aomA:
undetectable
2ygqA-6aomA:
21.41
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.
6cmj CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2


(Homo sapiens)
no annotation 5 LEU A 319
ILE A 328
LEU A 303
ILE A 239
VAL A 179
F6J  A 501 (-4.5A)
None
None
None
F6J  A 501 (-4.6A)
1.07A 2ygqA-6cmjA:
undetectable
2ygqA-6cmjA:
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.
6ekt P-47 PROTEIN

(Clostridium
botulinum)
no annotation 5 ILE A 111
ILE A 139
PRO A  87
ILE A  46
PHE A 131
None
1.05A 2ygqA-6ektA:
undetectable
2ygqA-6ektA:
18.78