SIMILAR PATTERNS OF AMINO ACIDS FOR 4WS0_A_URFA301

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.
1e59 PHOSPHOGLYCERATE
MUTASE


(Escherichia
coli)
PF00300
(His_Phos_1)
4 GLY A  92
GLN A  95
TYR A 132
HIS A  90
None
1.04A 4ws0A-1e59A:
undetectable
4ws0A-1e59A:
20.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1flz URACIL-DNA
GLYCOSYLASE


(Escherichia
coli)
PF03167
(UDG)
5 GLY A  62
TYR A  66
PHE A  77
ASN A 123
HIS A 187
URA  A 230 ( 4.1A)
URA  A 230 (-3.2A)
URA  A 230 (-3.6A)
URA  A 230 (-2.9A)
URA  A 230 (-4.1A)
0.29A 4ws0A-1flzA:
30.3
4ws0A-1flzA:
36.78
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.
1gu1 3-DEHYDROQUINATE
DEHYDRATASE


(Streptomyces
coelicolor)
PF01220
(DHquinase_II)
4 GLY A  14
GLN A  55
TYR A  28
ASN A  79
None
None
GOL  A 202 (-3.7A)
FA1  A 201 (-3.0A)
1.05A 4ws0A-1gu1A:
3.4
4ws0A-1gu1A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j3u ASPARTASE

(Bacillus sp.
YM55-1)
PF00206
(Lyase_1)
PF10415
(FumaraseC_C)
4 GLY A 354
GLN A 355
SER A 351
ASN A 359
None
1.00A 4ws0A-1j3uA:
undetectable
4ws0A-1j3uA:
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.
1l9g CONSERVED
HYPOTHETICAL PROTEIN


(Thermotoga
maritima)
PF03167
(UDG)
4 GLY A  45
PHE A  59
ASN A  85
HIS A 161
None
0.47A 4ws0A-1l9gA:
8.7
4ws0A-1l9gA:
22.13
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.
1nhy ELONGATION FACTOR
1-GAMMA 1


(Saccharomyces
cerevisiae)
PF00043
(GST_C)
PF02798
(GST_N)
4 GLY A   4
GLN A   3
TYR A  58
PHE A  52
None
1.00A 4ws0A-1nhyA:
undetectable
4ws0A-1nhyA:
22.59
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.
1oe5 SINGLE-STRAND
SELECTIVE
MONOFUNCTIONAL
URACIL DNA
GLYCOSYLASE


(Xenopus laevis)
no annotation 4 GLY A  94
PHE A 109
ASN A 174
HIS A 250
URA  A1282 (-3.6A)
URA  A1282 (-3.6A)
URA  A1282 (-3.0A)
URA  A1282 (-4.1A)
0.42A 4ws0A-1oe5A:
9.8
4ws0A-1oe5A:
25.45
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.
1rc9 CYSTEINE-RICH
SECRETORY PROTEIN


(Trimeresurus
stejnegeri)
PF00188
(CAP)
PF08562
(Crisp)
4 GLY A 114
TYR A 147
ASN A 152
HIS A 115
None
1.18A 4ws0A-1rc9A:
undetectable
4ws0A-1rc9A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s7k ACETYL TRANSFERASE

(Salmonella
enterica)
PF13302
(Acetyltransf_3)
4 GLY A 108
GLN A 107
TYR A  98
SER A 111
None
1.14A 4ws0A-1s7kA:
undetectable
4ws0A-1s7kA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ui1 URACIL-DNA
GLYCOSYLASE


(Thermus
thermophilus)
PF03167
(UDG)
4 GLY A  40
PHE A  54
ASN A  80
HIS A 155
None
0.54A 4ws0A-1ui1A:
9.6
4ws0A-1ui1A:
21.22
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.
1xx5 NATRIN 1

(Naja atra)
PF00188
(CAP)
PF08562
(Crisp)
4 GLY A 114
TYR A 147
ASN A 152
HIS A 115
EOH  A 501 ( 3.7A)
None
None
EOH  A 501 ( 4.0A)
1.18A 4ws0A-1xx5A:
undetectable
4ws0A-1xx5A:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bas YKUI PROTEIN

(Bacillus
subtilis)
PF00563
(EAL)
PF10388
(YkuI_C)
4 GLN A 321
SER A 345
PHE A 350
ASN A 343
None
1.07A 4ws0A-2basA:
undetectable
4ws0A-2basA:
21.77
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.
2bas YKUI PROTEIN

(Bacillus
subtilis)
PF00563
(EAL)
PF10388
(YkuI_C)
4 GLY A 319
SER A 345
PHE A 350
ASN A 343
None
1.03A 4ws0A-2basA:
undetectable
4ws0A-2basA:
21.77
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.
2cfe ALLERGEN

(Malassezia
sympodialis)
PF00160
(Pro_isomerase)
4 GLY A  63
GLN A 109
SER A  49
HIS A  52
None
1.16A 4ws0A-2cfeA:
undetectable
4ws0A-2cfeA:
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.
2d42 NON-TOXIC CRYSTAL
PROTEIN


(Bacillus
thuringiensis)
PF03318
(ETX_MTX2)
4 GLY A 234
GLN A 161
TYR A 157
PHE A 139
None
0.96A 4ws0A-2d42A:
undetectable
4ws0A-2d42A:
23.74
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.
2eaa 7S GLOBULIN-3

(Vigna angularis)
PF00190
(Cupin_1)
4 GLY A 368
GLN A 399
SER A 374
ASN A 371
None
1.14A 4ws0A-2eaaA:
undetectable
4ws0A-2eaaA:
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.
2he9 NK-TUMOR RECOGNITION
PROTEIN


(Homo sapiens)
PF00160
(Pro_isomerase)
4 GLY A  76
GLN A 122
SER A  62
HIS A  65
None
1.17A 4ws0A-2he9A:
undetectable
4ws0A-2he9A:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum)
PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind)
4 GLY A 181
SER A 416
ASN A 273
HIS A 217
None
1.08A 4ws0A-2i0kA:
undetectable
4ws0A-2i0kA:
19.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2j8x URACIL-DNA
GLYCOSYLASE


(Human
gammaherpesvirus
4)
PF03167
(UDG)
5 GLY A  89
GLN A  90
TYR A  93
PHE A 103
ASN A 149
None
0.75A 4ws0A-2j8xA:
28.9
4ws0A-2j8xA:
36.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2jhq URACIL
DNA-GLYCOSYLASE


(Vibrio cholerae)
PF03167
(UDG)
4 GLY A  62
GLN A  63
TYR A  66
ASN A 123
None
0.75A 4ws0A-2jhqA:
30.5
4ws0A-2jhqA:
38.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2jhq URACIL
DNA-GLYCOSYLASE


(Vibrio cholerae)
PF03167
(UDG)
5 GLY A  62
TYR A  66
PHE A  77
ASN A 123
HIS A 187
None
0.72A 4ws0A-2jhqA:
30.5
4ws0A-2jhqA:
38.43
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.
2pcl LIPOPROTEIN-RELEASIN
G SYSTEM ATP-BINDING
PROTEIN LOLD


(Aquifex
aeolicus)
PF00005
(ABC_tran)
4 GLY A 144
GLN A 147
ASN A 175
HIS A  91
None
None
SO4  A 227 ( 3.4A)
SO4  A 230 ( 3.8A)
1.12A 4ws0A-2pclA:
undetectable
4ws0A-2pclA:
22.05
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.
2poa 14 KDA FATTY
ACID-BINDING PROTEIN


(Schistosoma
mansoni)
PF00061
(Lipocalin)
4 GLY A  33
TYR A 129
SER A  13
PHE A  16
None
1.15A 4ws0A-2poaA:
undetectable
4ws0A-2poaA:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rmc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
C


(Mus musculus)
PF00160
(Pro_isomerase)
4 GLY A  99
GLN A 145
SER A  85
HIS A  88
None
1.18A 4ws0A-2rmcA:
undetectable
4ws0A-2rmcA:
19.60
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.
2rpr FLYWCH-TYPE ZINC
FINGER-CONTAINING
PROTEIN 1


(Homo sapiens)
PF04500
(FLYWCH)
4 TYR A  30
SER A  27
PHE A  28
HIS A  71
None
None
ZN  A 201 (-4.8A)
ZN  A 201 ( 3.0A)
1.17A 4ws0A-2rprA:
undetectable
4ws0A-2rprA:
15.06
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.
2v5d O-GLCNACASE NAGJ

(Clostridium
perfringens)
PF00754
(F5_F8_type_C)
PF02838
(Glyco_hydro_20b)
PF07555
(NAGidase)
4 GLY A 564
GLN A 563
TYR A 526
SER A 568
None
1.17A 4ws0A-2v5dA:
undetectable
4ws0A-2v5dA:
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.
2vzn VENOM ALLERGEN 3

(Solenopsis
invicta)
PF00188
(CAP)
4 GLY A 161
TYR A 196
ASN A 201
HIS A 162
None
1.16A 4ws0A-2vznA:
undetectable
4ws0A-2vznA:
22.06
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.
2xot AMPHOTERIN-INDUCED
PROTEIN 1


(Mus musculus)
PF07679
(I-set)
PF13855
(LRR_8)
4 GLN A 248
TYR A 230
SER A 264
ASN A 261
None
1.16A 4ws0A-2xotA:
undetectable
4ws0A-2xotA:
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.
2xz4 PEPTIDOGLYCAN-RECOGN
ITION PROTEIN LF


(Drosophila
melanogaster)
PF01510
(Amidase_2)
4 GLY A 142
GLN A 141
SER A 154
ASN A 123
None
0.93A 4ws0A-2xz4A:
undetectable
4ws0A-2xz4A:
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.
2yoc PULLULANASE

(Klebsiella
oxytoca)
PF02922
(CBM_48)
PF03714
(PUD)
PF11852
(DUF3372)
4 GLY A 775
TYR A 800
SER A 721
ASN A 779
None
1.14A 4ws0A-2yocA:
undetectable
4ws0A-2yocA:
12.18
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT


(Thermus
thermophilus)
PF00344
(SecY)
4 GLY Y  65
TYR Y  28
SER Y  63
ASN Y  66
None
1.08A 4ws0A-2zqpY:
undetectable
4ws0A-2zqpY:
21.82
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.
3au9 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE


(Plasmodium
falciparum)
PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C)
4 GLY A 186
GLN A 185
SER A 207
ASN A 204
None
NDP  A 501 (-4.0A)
None
NDP  A 501 (-3.8A)
1.16A 4ws0A-3au9A:
undetectable
4ws0A-3au9A:
17.25
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.
3b2y METALLOPEPTIDASE
CONTAINING
CO-CATALYTIC
METALLOACTIVE SITE


(Shewanella
denitrificans)
PF04952
(AstE_AspA)
4 GLY A 264
GLN A 265
TYR A 202
SER A 260
None
0.90A 4ws0A-3b2yA:
undetectable
4ws0A-3b2yA:
21.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cxm URACIL-DNA
GLYCOSYLASE


(Leishmania
naiffi)
PF03167
(UDG)
5 GLY A 204
GLN A 205
TYR A 208
PHE A 219
ASN A 265
URB  A 401 ( 3.5A)
None
URB  A 401 ( 3.3A)
URB  A 401 ( 4.1A)
URB  A 401 ( 2.9A)
0.80A 4ws0A-3cxmA:
29.6
4ws0A-3cxmA:
39.92
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.
3e54 RRNA INTRON-ENCODED
ENDONUCLEASE


(Vulcanisaeta
distributa)
PF00961
(LAGLIDADG_1)
4 GLY A  20
TYR A  76
SER A  43
PHE A  42
None
1.14A 4ws0A-3e54A:
undetectable
4ws0A-3e54A:
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.
3f5f MALTOSE-BINDING
PERIPLASMIC PROTEIN,
HEPARAN SULFATE
2-O-SULFOTRANSFERASE
1


(Escherichia
coli;
Gallus gallus)
PF03567
(Sulfotransfer_2)
PF13416
(SBP_bac_8)
4 GLY A1223
GLN A1239
TYR A1159
SER A1144
None
0.92A 4ws0A-3f5fA:
undetectable
4ws0A-3f5fA:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fkj PUTATIVE
PHOSPHOSUGAR
ISOMERASES


(Salmonella
enterica)
PF01380
(SIS)
4 GLY A 199
TYR A  41
SER A 203
HIS A 227
None
1.18A 4ws0A-3fkjA:
undetectable
4ws0A-3fkjA:
22.35
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.
3hl1 FERRITIN LIKE
PROTEIN


(Caulobacter
vibrioides)
PF12902
(Ferritin-like)
4 GLY A 205
GLN A 204
TYR A  28
HIS A  56
UNL  A 317 (-3.4A)
None
None
UNL  A 317 (-4.2A)
1.02A 4ws0A-3hl1A:
undetectable
4ws0A-3hl1A:
24.11
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.
3iy7 FRAGMENT FROM
NEUTRALIZING
ANTIBODY F (HEAVY
CHAIN)


(Rattus
norvegicus)
PF07686
(V-set)
4 GLY B 215
GLN B 214
TYR B 211
PHE B 194
None
1.08A 4ws0A-3iy7B:
undetectable
4ws0A-3iy7B:
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.
3k1d 1,4-ALPHA-GLUCAN-BRA
NCHING ENZYME


(Mycobacterium
tuberculosis)
PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48)
4 GLY A 131
TYR A 398
PHE A 217
HIS A 133
None
1.03A 4ws0A-3k1dA:
undetectable
4ws0A-3k1dA:
16.85
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE


(Burkholderia
mallei)
PF00246
(Peptidase_M14)
4 GLN A 170
TYR A 320
ASN A 233
HIS A 268
None
CL  A 387 ( 4.9A)
CL  A 387 ( 4.9A)
None
1.13A 4ws0A-3k2kA:
2.8
4ws0A-3k2kA:
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.
3kbh ANGIOTENSIN-CONVERTI
NG ENZYME 2


(Homo sapiens)
PF01401
(Peptidase_M2)
4 GLY A 173
GLN A 175
TYR A 127
SER A 502
None
1.15A 4ws0A-3kbhA:
undetectable
4ws0A-3kbhA:
17.22
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.
3n71 HISTONE LYSINE
METHYLTRANSFERASE
SMYD1


(Mus musculus)
PF00856
(SET)
PF01753
(zf-MYND)
4 GLY A 175
TYR A 271
PHE A 139
ASN A 134
None
0.92A 4ws0A-3n71A:
undetectable
4ws0A-3n71A:
19.35
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.
3nvq SEMAPHORIN-7A

(Homo sapiens)
PF01403
(Sema)
PF01437
(PSI)
PF13895
(Ig_2)
4 GLY A 271
TYR A 213
SER A 277
ASN A 282
None
1.12A 4ws0A-3nvqA:
undetectable
4ws0A-3nvqA:
17.06
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.
3o21 GLUTAMATE RECEPTOR 3

(Rattus
norvegicus)
PF01094
(ANF_receptor)
4 GLY A 323
GLN A 322
SER A  95
PHE A 109
None
0.95A 4ws0A-3o21A:
2.4
4ws0A-3o21A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o7t CYCLOPHILIN A

(Moniliophthora
perniciosa)
PF00160
(Pro_isomerase)
4 GLY A  63
GLN A 109
SER A  49
HIS A  52
None
1.14A 4ws0A-3o7tA:
undetectable
4ws0A-3o7tA:
17.84
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.
3pz6 LEUCYL-TRNA
SYNTHETASE


(Giardia
intestinalis)
PF00133
(tRNA-synt_1)
4 GLY A 344
GLN A 345
TYR A 448
SER A 439
None
1.16A 4ws0A-3pz6A:
undetectable
4ws0A-3pz6A:
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.
3qwu DNA LIGASE

(Aquifex
aeolicus)
PF09414
(RNA_ligase)
4 TYR A 227
SER A 230
PHE A 262
ASN A 206
None
1.07A 4ws0A-3qwuA:
undetectable
4ws0A-3qwuA:
20.35
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.
3r6y ASPARTASE

(Bacillus sp.
YM55-1)
PF00206
(Lyase_1)
4 GLY A 354
GLN A 355
SER A 351
ASN A 359
GLY  A 354 ( 0.0A)
GLN  A 355 ( 0.6A)
SER  A 351 ( 0.0A)
ASN  A 359 ( 0.6A)
0.95A 4ws0A-3r6yA:
undetectable
4ws0A-3r6yA:
19.71
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.
3ros NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE


(Lactobacillus
acidophilus)
PF00171
(Aldedh)
4 GLY A 123
GLN A 201
SER A 121
ASN A 150
None
1.14A 4ws0A-3rosA:
undetectable
4ws0A-3rosA:
19.63
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.
3tih HIV-1 CLADE C
ZM109F.PB4 GP120


(Human
immunodeficiency
virus 1)
PF00516
(GP120)
4 GLY A 237
TYR A 484
SER A 234
PHE A 233
None
0.89A 4ws0A-3tihA:
undetectable
4ws0A-3tihA:
20.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tr7 URACIL-DNA
GLYCOSYLASE


(Coxiella
burnetii)
PF03167
(UDG)
4 GLN A  66
TYR A  69
PHE A  80
ASN A 125
None
1.04A 4ws0A-3tr7A:
30.5
4ws0A-3tr7A:
41.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tr7 URACIL-DNA
GLYCOSYLASE


(Coxiella
burnetii)
PF03167
(UDG)
4 GLY A  65
TYR A  69
PHE A  80
ASN A 125
None
0.65A 4ws0A-3tr7A:
30.5
4ws0A-3tr7A:
41.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wdg URACIL-DNA
GLYCOSYLASE


(Staphylococcus
aureus)
PF03167
(UDG)
4 GLN A  58
TYR A  61
PHE A  72
HIS A 180
None
1.17A 4ws0A-3wdgA:
29.9
4ws0A-3wdgA:
37.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wdg URACIL-DNA
GLYCOSYLASE


(Staphylococcus
aureus)
PF03167
(UDG)
5 GLY A  57
GLN A  58
TYR A  61
PHE A  72
ASN A 116
None
0.72A 4ws0A-3wdgA:
29.9
4ws0A-3wdgA:
37.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zoq URACIL-DNA
GLYCOSYLASE


(Bacillus
subtilis)
PF03167
(UDG)
4 GLN A  64
TYR A  67
PHE A  78
ASN A 123
GOL  A1226 ( 4.5A)
None
None
None
0.99A 4ws0A-3zoqA:
31.0
4ws0A-3zoqA:
43.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zoq URACIL-DNA
GLYCOSYLASE


(Bacillus
subtilis)
PF03167
(UDG)
5 GLY A  63
TYR A  67
SER A  77
PHE A  78
ASN A 123
None
0.71A 4ws0A-3zoqA:
31.0
4ws0A-3zoqA:
43.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zoq URACIL-DNA
GLYCOSYLASE


(Bacillus
subtilis)
PF03167
(UDG)
4 TYR A  67
SER A  77
PHE A  78
HIS A 187
None
None
None
GOL  A1226 (-4.6A)
0.70A 4ws0A-3zoqA:
31.0
4ws0A-3zoqA:
43.28
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata)
PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s)
4 GLY A 339
TYR A 358
PHE A 360
HIS A 154
None
0.95A 4ws0A-4bedA:
undetectable
4ws0A-4bedA:
9.60
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.
4eyy ICMQ

(Legionella
pneumophila)
PF09475
(Dot_icm_IcmQ)
5 GLY Q  86
GLN Q 126
SER Q  83
ASN Q 127
HIS Q 175
None
1.43A 4ws0A-4eyyQ:
undetectable
4ws0A-4eyyQ:
22.04
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.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63)
4 GLY B 908
GLN B 911
ASN B 909
HIS B1548
None
0.91A 4ws0A-4f92B:
undetectable
4ws0A-4f92B:
10.47
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.
4gi2 CROTONYL-COA
CARBOXYLASE/REDUCTAS
E


(Methylobacterium
extorquens)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 GLY A  80
SER A 104
ASN A  79
HIS A 393
None
1.15A 4ws0A-4gi2A:
undetectable
4ws0A-4gi2A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h0a UNCHARACTERIZED
PROTEIN


(Staphylococcus
aureus)
PF00188
(CAP)
PF14504
(CAP_assoc_N)
4 GLN A 227
TYR A  91
SER A 106
ASN A  93
None
None
EDO  A 401 (-3.4A)
EDO  A 401 (-3.2A)
1.14A 4ws0A-4h0aA:
undetectable
4ws0A-4h0aA:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i9y E3 SUMO-PROTEIN
LIGASE RANBP2


(Homo sapiens)
PF00160
(Pro_isomerase)
4 GLY A  65
GLN A 111
SER A  51
HIS A  54
None
1.18A 4ws0A-4i9yA:
undetectable
4ws0A-4i9yA:
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.
4jcp PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Brugia malayi)
PF00160
(Pro_isomerase)
4 GLY A  72
GLN A 118
SER A  58
HIS A  61
None
1.16A 4ws0A-4jcpA:
undetectable
4ws0A-4jcpA:
20.76
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.
4jg5 PUTATIVE CELL
ADHESION PROTEIN


(Parabacteroides
distasonis)
PF06321
(P_gingi_FimA)
4 GLY A 169
GLN A 171
SER A 177
ASN A 172
None
1.13A 4ws0A-4jg5A:
undetectable
4ws0A-4jg5A:
20.50
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.
4jwg TRNA
(GUANINE(9)-N1)-METH
YLTRANSFERASE


(Schizosaccharomyces
pombe)
PF01746
(tRNA_m1G_MT)
4 GLY A 154
GLN A 155
TYR A 162
ASN A 157
None
1.03A 4ws0A-4jwgA:
undetectable
4ws0A-4jwgA:
21.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l5n URACIL-DNA
GLYCOSYLASE


(Human
alphaherpesvirus
1)
PF03167
(UDG)
5 GLY A  86
GLN A  87
TYR A  90
PHE A 101
ASN A 147
None
ACT  A 301 (-3.6A)
None
None
None
0.83A 4ws0A-4l5nA:
28.0
4ws0A-4l5nA:
37.35
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.
4lq1 1,4-ALPHA-GLUCAN
BRANCHING ENZYME
GLGB


(Escherichia
coli)
PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48)
4 GLY A 126
TYR A 392
PHE A 208
HIS A 128
None
1.14A 4ws0A-4lq1A:
undetectable
4ws0A-4lq1A:
15.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lyl URACIL-DNA
GLYCOSYLASE


(Gadus morhua)
PF03167
(UDG)
5 GLY A 143
GLN A 144
TYR A 147
PHE A 158
ASN A 204
None
0.75A 4ws0A-4lylA:
30.7
4ws0A-4lylA:
39.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nxk ABP, A GH27
BETA-L-ARABINOPYRANO
SIDASE


(Geobacillus
stearothermophilus)
PF16499
(Melibiase_2)
4 GLY A 357
SER A 374
PHE A 382
HIS A 352
None
1.07A 4ws0A-4nxkA:
undetectable
4ws0A-4nxkA:
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.
4ovq TRAP DICARBOXYLATE
ABC TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN


(Roseobacter
denitrificans)
PF03480
(DctP)
4 GLY A  94
TYR A 308
SER A 104
ASN A 172
None
1.12A 4ws0A-4ovqA:
undetectable
4ws0A-4ovqA:
26.49
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.
4qt9 PUTATIVE
GLUCOAMYLASE


(Bacteroides
caccae)
PF10091
(Glycoamylase)
4 GLY A 146
SER A  72
PHE A 129
ASN A  71
None
0.99A 4ws0A-4qt9A:
undetectable
4ws0A-4qt9A:
20.50
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.
4qyj ALDEHYDE
DEHYDROGENASE


(Pseudomonas
putida)
PF00171
(Aldedh)
4 GLY A 298
GLN A 299
TYR A 110
HIS A 297
None
1.18A 4ws0A-4qyjA:
undetectable
4ws0A-4qyjA:
20.04
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.
4r12 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Dictyostelium
purpureum)
PF05450
(Nicastrin)
4 GLY A 215
GLN A 216
SER A 504
ASN A 287
None
0.97A 4ws0A-4r12A:
undetectable
4ws0A-4r12A:
16.50
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.
4r1d UNCHARACTERIZED
PROTEIN


(Pseudomonas
aeruginosa)
no annotation 4 GLY A 180
GLN A 179
TYR A 533
ASN A 528
None
1.08A 4ws0A-4r1dA:
3.0
4ws0A-4r1dA:
17.30
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.
4rlc OUTER MEMBRANE PORIN
F


(Pseudomonas
aeruginosa)
PF05736
(OprF)
4 SER A   5
PHE A  36
ASN A 159
HIS A  76
None
1.08A 4ws0A-4rlcA:
undetectable
4ws0A-4rlcA:
23.29
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.
4s1j PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Leishmania
donovani)
PF00160
(Pro_isomerase)
4 GLY A  88
GLN A 133
SER A  74
HIS A  77
None
1.15A 4ws0A-4s1jA:
undetectable
4ws0A-4s1jA:
22.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uqm URACIL-DNA
GLYCOSYLASE


(Deinococcus
radiodurans)
PF03167
(UDG)
7 GLY A  81
GLN A  82
TYR A  85
SER A  95
PHE A  96
ASN A 142
HIS A 206
None
GOL  A1246 (-3.0A)
CL  A1245 (-4.3A)
None
None
CL  A1245 (-4.0A)
None
0.75A 4ws0A-4uqmA:
33.4
4ws0A-4uqmA:
45.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wrw URACIL-DNA
GLYCOSYLASE


(Mycobacterium
tuberculosis)
PF03167
(UDG)
6 GLY A  66
GLN A  67
TYR A  70
SER A  80
PHE A  81
ASN A 127
GOL  A 307 (-3.5A)
None
GOL  A 307 (-3.5A)
None
GOL  A 307 (-3.5A)
GOL  A 307 (-2.8A)
0.70A 4ws0A-4wrwA:
38.1
4ws0A-4wrwA:
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.
4ye4 HEAVY CHAIN HUMAN
ANTIBODY HJ16
HT593.1 GP120


(Homo sapiens;
Human
immunodeficiency
virus)
PF00516
(GP120)
PF07654
(C1-set)
PF07686
(V-set)
4 GLY G 459
TYR H 113
PHE H 111
ASN G 460
None
1.06A 4ws0A-4ye4G:
undetectable
4ws0A-4ye4G:
19.62
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.
4zbz URACIL-DNA
GLYCOSYLASE


(Sulfurisphaera
tokodaii)
PF03167
(UDG)
4 GLY A  41
PHE A  55
ASN A  82
HIS A 164
None
0.31A 4ws0A-4zbzA:
9.7
4ws0A-4zbzA:
18.67
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.
5a0z CHOLINE
TRIMETHYLAMINE LYASE


(Klebsiella
pneumoniae)
PF01228
(Gly_radical)
PF02901
(PFL-like)
4 GLY A1072
GLN A1073
TYR A 766
SER A 748
None
1.02A 4ws0A-5a0zA:
undetectable
4ws0A-5a0zA:
15.36
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.
5cb2 PROTEIN SEY1

(Candida
albicans)
PF05879
(RHD3)
4 GLY A 167
GLN A 166
SER A  66
ASN A 169
None
1.07A 4ws0A-5cb2A:
undetectable
4ws0A-5cb2A:
14.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cvv (ISO)EUGENOL
O-METHYLTRANSFERASE


(Clarkia breweri)
PF00891
(Methyltransf_2)
PF08100
(Dimerisation)
4 GLY A 215
SER A 219
PHE A 245
HIS A 250
None
1.17A 4ws0A-5cvvA:
undetectable
4ws0A-5cvvA:
22.55
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.
5erp DESMOCOLLIN-2

(Homo sapiens)
PF00028
(Cadherin)
4 GLY A 301
GLN A 299
TYR A 225
PHE A 220
None
1.18A 4ws0A-5erpA:
undetectable
4ws0A-5erpA:
21.47
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.
5gnw BLR0248 PROTEIN

(Bradyrhizobium
diazoefficiens)
no annotation 4 GLY C  55
GLN C  56
ASN C  94
HIS C 168
URA  C 301 ( 3.9A)
None
URA  C 301 (-2.9A)
URA  C 301 (-3.6A)
0.59A 4ws0A-5gnwC:
8.0
4ws0A-5gnwC:
23.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jk7 URACIL-DNA
GLYCOSYLASE


(Homo sapiens)
PF03167
(UDG)
4 GLY D 143
GLN D 144
TYR D 147
ASN D 204
None
0.75A 4ws0A-5jk7D:
28.1
4ws0A-5jk7D:
37.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jk7 URACIL-DNA
GLYCOSYLASE


(Homo sapiens)
PF03167
(UDG)
4 GLY D 143
TYR D 147
PHE D 158
ASN D 204
None
0.91A 4ws0A-5jk7D:
28.1
4ws0A-5jk7D:
37.66
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.
5jx3 URACIL-DNA
GLYCOSYLASE


(Vaccinia virus)
no annotation 4 GLY A  66
TYR A  70
PHE A  79
ASN A 120
GOL  A 402 (-3.1A)
GOL  A 402 (-3.6A)
GOL  A 402 (-3.8A)
GOL  A 402 (-2.7A)
0.87A 4ws0A-5jx3A:
21.7
4ws0A-5jx3A:
24.31
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.
5kut MITOCHONDRIAL RHO
GTPASE 2


(Homo sapiens)
no annotation 4 GLY A 410
GLN A 411
PHE A 576
ASN A 461
None
1.12A 4ws0A-5kutA:
3.2
4ws0A-5kutA:
24.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lsu HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2


(Homo sapiens)
PF00856
(SET)
4 GLY A1185
PHE A1117
ASN A1186
HIS A1110
None
None
SAM  A1304 (-3.6A)
None
1.09A 4ws0A-5lsuA:
undetectable
4ws0A-5lsuA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1)
no annotation 4 GLY A 391
GLN A 413
ASN A 387
HIS A 392
None
1.08A 4ws0A-5nd1A:
undetectable
4ws0A-5nd1A:
15.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nn7 URACIL-DNA
GLYCOSYLASE


(Human
gammaherpesvirus
8)
no annotation 4 GLY A  86
TYR A  90
PHE A 100
ASN A 146
None
0.69A 4ws0A-5nn7A:
29.3
4ws0A-5nn7A:
23.96
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.
5suj UNCHARACTERIZED
PROTEIN


(Legionella
pneumophila)
no annotation 4 GLY A  84
GLN A  85
TYR A 267
SER A 245
None
1.01A 4ws0A-5sujA:
undetectable
4ws0A-5sujA:
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT


(Xanthobacter
autotrophicus)
PF02538
(Hydantoinase_B)
4 GLY A 540
TYR A 621
SER A 556
ASN A 539
None
1.18A 4ws0A-5svcA:
undetectable
4ws0A-5svcA:
14.43
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.
5tnx ALCOHOL
DEHYDROGENASE
ZINC-BINDING DOMAIN
PROTEIN


(Burkholderia
ambifaria)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 GLY A 183
SER A 322
PHE A 327
ASN A 187
None
0.99A 4ws0A-5tnxA:
undetectable
4ws0A-5tnxA:
25.19
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.
5x55 PROBABLE URACIL-DNA
GLYCOSYLASE


(Acanthamoeba
polyphaga
mimivirus)
PF03167
(UDG)
6 GLY A 189
GLN A 190
TYR A 193
SER A 208
PHE A 209
ASN A 255
None
0.85A 4ws0A-5x55A:
26.0
4ws0A-5x55A:
21.84
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.
5x55 PROBABLE URACIL-DNA
GLYCOSYLASE


(Acanthamoeba
polyphaga
mimivirus)
PF03167
(UDG)
6 GLY A 189
TYR A 193
SER A 208
PHE A 209
ASN A 255
HIS A 318
None
0.97A 4ws0A-5x55A:
26.0
4ws0A-5x55A:
21.84
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.
5yxa NON-STRUCTURAL
PROTEIN 1


(Yellow fever
virus)
no annotation 4 GLY A 157
TYR A 160
SER A 129
HIS A 153
None
1.19A 4ws0A-5yxaA:
undetectable
4ws0A-5yxaA:
15.21