SIMILAR PATTERNS OF AMINO ACIDS FOR 4RTR_A_SAMA301

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.
1bvu PROTEIN (GLUTAMATE
DEHYDROGENASE)


(Thermococcus
litoralis)
PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N)
5 GLY A  69
ILE A 358
ASN A 357
ASP A 139
PRO A  66
None
1.22A 4rtrA-1bvuA:
undetectable
4rtrA-1bvuA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1esc ESTERASE

(Streptomyces
scabiei)
PF13472
(Lipase_GDSL_2)
5 GLY A 250
ASN A 285
TYR A  41
PRO A 187
TYR A 246
None
1.47A 4rtrA-1escA:
undetectable
4rtrA-1escA:
22.83
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.
1euz GLUTAMATE
DEHYDROGENASE


(Thermococcus
profundus)
PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N)
5 GLY A  70
ILE A 359
ASN A 358
ASP A 140
PRO A  67
SO4  A 601 (-3.3A)
None
None
None
None
1.12A 4rtrA-1euzA:
undetectable
4rtrA-1euzA:
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.
1fw8 PHOSPHOGLYCERATE
KINASE


(Saccharomyces
cerevisiae)
PF00162
(PGK)
5 PHE A 114
ASP A  90
ILE A  88
ASN A  89
TYR A 392
None
0.99A 4rtrA-1fw8A:
undetectable
4rtrA-1fw8A:
21.18
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA


(Moraxella bovis)
PF01555
(N6_N4_Mtase)
6 PHE A 220
ASP A 241
ASN A 243
ASP A  30
PRO A  32
TYR A  33
SAM  A 500 (-4.6A)
SAM  A 500 (-2.9A)
None
SAM  A 500 (-3.7A)
None
None
0.86A 4rtrA-1g60A:
3.2
4rtrA-1g60A:
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.
1gtm GLUTAMATE
DEHYDROGENASE


(Pyrococcus
furiosus)
PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N)
5 GLY A  69
ILE A 359
ASN A 358
ASP A 139
PRO A  66
None
1.16A 4rtrA-1gtmA:
undetectable
4rtrA-1gtmA:
21.53
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.
1gzv GLUCOSE-6-PHOSPHATE
ISOMERASE


(Sus scrofa)
PF00342
(PGI)
5 TRP A 140
GLY A 142
PHE A 242
ILE A 257
TYR A 143
None
1.37A 4rtrA-1gzvA:
3.9
4rtrA-1gzvA:
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2


(Synechocystis
sp. PCC 6803)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
5 GLY A1244
ILE A1025
ASN A1026
SER A1285
ASP A1249
None
1.49A 4rtrA-1ofeA:
undetectable
4rtrA-1ofeA:
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.
1q50 GLUCOSE-6-PHOSPHATE
ISOMERASE


(Leishmania
mexicana)
PF00342
(PGI)
5 TRP A 188
GLY A 190
PHE A 295
ILE A 310
ASN A 314
None
1.26A 4rtrA-1q50A:
4.0
4rtrA-1q50A:
20.99
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.
1qpg 3-PHOSPHOGLYCERATE
KINASE


(Saccharomyces
cerevisiae)
PF00162
(PGK)
5 PHE A 185
ASP A 161
ILE A 159
ASN A 160
TYR A  48
None
1.08A 4rtrA-1qpgA:
4.6
4rtrA-1qpgA:
23.19
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.
1s3i 10-FORMYLTETRAHYDROF
OLATE DEHYDROGENASE


(Rattus
norvegicus)
PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C)
5 GLY A  43
PHE A  30
ILE A  90
TYR A  73
TYR A  16
None
1.46A 4rtrA-1s3iA:
2.5
4rtrA-1s3iA:
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.
1si1 IRON BINDING PROTEIN
FBPA


(Mannheimia
haemolytica)
PF13343
(SBP_bac_6)
5 GLY A 118
ILE A 194
SER A 193
TYR A 106
PRO A 221
None
1.46A 4rtrA-1si1A:
undetectable
4rtrA-1si1A:
24.64
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.
1u5l PRION PROTEIN

(Trachemys
scripta)
PF00377
(Prion)
5 PHE A 176
ASP A 179
ILE A 183
ASN A 182
TYR A 163
None
1.40A 4rtrA-1u5lA:
undetectable
4rtrA-1u5lA:
16.16
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.
1wky ENDO-BETA-1,4-MANNAN
ASE


(Bacillus sp.
JAMB-602)
PF00150
(Cellulase)
5 TRP A 353
GLY A 352
ILE A 482
SER A 481
PRO A 362
None
1.31A 4rtrA-1wkyA:
undetectable
4rtrA-1wkyA:
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.
1yfj DNA ADENINE
METHYLASE


(Escherichia
virus T4)
PF02086
(MethyltransfD12)
5 GLY A   9
ASP A  50
ASP A 171
PRO A 173
TYR A 174
None
SAH  A 401 (-2.9A)
SAH  A 401 (-3.8A)
SAH  A 401 (-4.0A)
None
0.79A 4rtrA-1yfjA:
26.2
4rtrA-1yfjA:
27.27
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.
1yfj DNA ADENINE
METHYLASE


(Escherichia
virus T4)
PF02086
(MethyltransfD12)
6 GLY A   9
PHE A  32
ASP A  50
ILE A  51
ASP A 171
PRO A 173
None
SAH  A 401 (-4.2A)
SAH  A 401 (-2.9A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.8A)
SAH  A 401 (-4.0A)
0.37A 4rtrA-1yfjA:
26.2
4rtrA-1yfjA:
27.27
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.
2as0 HYPOTHETICAL PROTEIN
PH1915


(Pyrococcus
horikoshii)
PF01472
(PUA)
PF10672
(Methyltrans_SAM)
5 PHE A 225
ASP A 247
SER A 275
ASP A 296
PRO A 298
None
0.49A 4rtrA-2as0A:
10.2
4rtrA-2as0A:
21.12
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.
2de0 ALPHA-(1,6)-FUCOSYLT
RANSFERASE


(Homo sapiens)
PF14604
(SH3_9)
5 PHE X 467
ASP X 495
ILE X 496
TYR X 476
TYR X 382
None
1.47A 4rtrA-2de0X:
undetectable
4rtrA-2de0X:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpm PROTEIN
(ADENINE-SPECIFIC
METHYLTRANSFERASE
DPNII 1)


(Streptococcus
pneumoniae)
PF02086
(MethyltransfD12)
8 TRP A  17
GLY A  19
PHE A  43
ASP A  62
ASN A  64
ASP A 194
PRO A 196
TYR A 197
SAM  A 300 (-4.3A)
SAM  A 300 (-4.4A)
SAM  A 300 (-4.2A)
SAM  A 300 (-2.8A)
None
SAM  A 300 (-3.7A)
SAM  A 300 ( 4.1A)
None
0.72A 4rtrA-2dpmA:
28.3
4rtrA-2dpmA:
29.97
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.
2dpm PROTEIN
(ADENINE-SPECIFIC
METHYLTRANSFERASE
DPNII 1)


(Streptococcus
pneumoniae)
PF02086
(MethyltransfD12)
7 TRP A  17
GLY A  20
PHE A  43
ASP A  62
ASN A  64
ASP A 194
PRO A 196
SAM  A 300 (-4.3A)
SAM  A 300 (-3.3A)
SAM  A 300 (-4.2A)
SAM  A 300 (-2.8A)
None
SAM  A 300 (-3.7A)
SAM  A 300 ( 4.1A)
0.97A 4rtrA-2dpmA:
28.3
4rtrA-2dpmA:
29.97
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.
2eax PEPTIDOGLYCAN
RECOGNITION
PROTEIN-I-BETA


(Homo sapiens)
PF01510
(Amidase_2)
5 ASP A 265
ILE A 264
SER A 269
TYR A 263
ASP A 258
None
1.48A 4rtrA-2eaxA:
undetectable
4rtrA-2eaxA:
18.63
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.
2eij CYTOCHROME C OXIDASE
SUBUNIT 1


(Bos taurus)
PF00115
(COX1)
5 ASP A 227
ILE A 229
TYR A 231
ASP A 221
PRO A 131
None
1.21A 4rtrA-2eijA:
undetectable
4rtrA-2eijA:
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.
2fna CONSERVED
HYPOTHETICAL PROTEIN


(Sulfolobus
solfataricus)
PF01637
(ATPase_2)
5 TRP A 244
GLY A 240
PHE A 248
ILE A 251
TYR A 252
None
1.32A 4rtrA-2fnaA:
2.4
4rtrA-2fnaA:
23.67
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.
2fyj LOW-DENSITY
LIPOPROTEIN
RECEPTOR-RELATED
PROTEIN 1


(Homo sapiens)
PF00057
(Ldl_recept_a)
5 GLY A  79
PHE A  51
ILE A  61
ASN A  62
ASP A  76
None
1.49A 4rtrA-2fyjA:
undetectable
4rtrA-2fyjA:
12.94
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.
2iny HEXON PROTEIN

(Fowl
aviadenovirus A)
PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C)
5 GLY A 661
PHE A 668
ASP A 557
TYR A 670
PRO A 658
None
1.46A 4rtrA-2inyA:
undetectable
4rtrA-2inyA:
14.90
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.
2jjq UNCHARACTERIZED RNA
METHYLTRANSFERASE
PYRAB10780


(Pyrococcus
abyssi)
PF05958
(tRNA_U5-meth_tr)
5 ASP A 299
ASN A 301
SER A 325
ASP A 340
PRO A 342
SAH  A1406 (-2.8A)
None
SAH  A1406 (-4.0A)
SAH  A1406 (-3.8A)
SAH  A1406 (-4.1A)
0.75A 4rtrA-2jjqA:
8.9
4rtrA-2jjqA:
27.04
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.
2obe HEXON

(Human
mastadenovirus
E)
PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C)
5 GLY A 672
PHE A 679
ASP A 568
TYR A 681
PRO A 669
None
None
None
MPD  A1704 ( 4.7A)
None
1.33A 4rtrA-2obeA:
undetectable
4rtrA-2obeA:
15.58
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.
2obe HEXON

(Human
mastadenovirus
E)
PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C)
5 GLY A 672
PHE A 679
TYR A 681
ASP A 676
PRO A 669
None
None
MPD  A1704 ( 4.7A)
None
None
1.32A 4rtrA-2obeA:
undetectable
4rtrA-2obeA:
15.58
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.
2oxh SOXZ PROTEIN

(Paracoccus
denitrificans)
no annotation 5 ILE Z  47
ASN Z  49
SER Z  32
PRO Z  73
TYR Z  74
None
1.42A 4rtrA-2oxhZ:
undetectable
4rtrA-2oxhZ:
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.
2paf LACTOSE OPERON
REPRESSOR


(Escherichia
coli)
PF13377
(Peripla_BP_3)
5 GLY A 103
ASP A 149
ASN A 125
SER A 158
ASP A 129
None
NPF  A 902 (-3.8A)
NPF  A 902 (-2.6A)
None
None
1.48A 4rtrA-2pafA:
4.3
4rtrA-2pafA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vcl CYANOBACTERIAL
PHYCOERYTHROBILIN


(Prochlorococcus
phage P-SSM2)
PF05996
(Fe_bilin_red)
5 ILE A 182
ASN A 184
ASP A  98
PRO A 100
TYR A 127
None
1.47A 4rtrA-2vclA:
undetectable
4rtrA-2vclA:
21.28
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.
2z0f PUTATIVE
PHOSPHOGLUCOMUTASE


(Thermus
thermophilus)
PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III)
5 GLY A 299
PHE A 279
ASP A 280
ILE A 213
ASP A 277
None
1.48A 4rtrA-2z0fA:
undetectable
4rtrA-2z0fA:
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.
3cb5 FACT COMPLEX SUBUNIT
SPT16


(Schizosaccharomyces
pombe)
PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob)
5 GLY A 259
PHE A 300
SER A 204
TYR A 437
ASP A 277
None
1.28A 4rtrA-3cb5A:
undetectable
4rtrA-3cb5A:
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.
3cdx SUCCINYLGLUTAMATEDES
UCCINYLASE/ASPARTOAC
YLASE


(Rhodobacter
sphaeroides)
PF04952
(AstE_AspA)
5 GLY A 151
ASP A 112
ILE A 113
ASN A 114
TYR A  66
None
1.32A 4rtrA-3cdxA:
undetectable
4rtrA-3cdxA:
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.
3cdx SUCCINYLGLUTAMATEDES
UCCINYLASE/ASPARTOAC
YLASE


(Rhodobacter
sphaeroides)
PF04952
(AstE_AspA)
5 GLY A 151
ASP A 112
ILE A 113
SER A 126
TYR A  66
None
1.45A 4rtrA-3cdxA:
undetectable
4rtrA-3cdxA:
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.
3dli METHYLTRANSFERASE

(Archaeoglobus
fulgidus)
PF13489
(Methyltransf_23)
5 ASP A 311
ILE A 312
ASN A 313
SER A 329
ASP A 288
None
1.48A 4rtrA-3dliA:
10.0
4rtrA-3dliA:
23.25
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.
3erb COMPLEMENT C2

(Homo sapiens)
PF00084
(Sushi)
5 GLY A  85
ASN A 160
SER A 189
PRO A  70
TYR A  87
None
1.33A 4rtrA-3erbA:
undetectable
4rtrA-3erbA:
19.37
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN


(Geobacillus
kaustophilus)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6)
5 PHE A1085
ASP A1086
ILE A1005
PRO A 387
TYR A 390
None
1.26A 4rtrA-3f2bA:
undetectable
4rtrA-3f2bA:
14.59
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.
3gnr OS03G0212800 PROTEIN

(Oryza sativa)
PF00232
(Glyco_hydro_1)
5 GLY A 396
PHE A 442
ILE A 174
ASN A 177
TYR A 127
GLY  A 396 ( 0.0A)
PHE  A 442 ( 1.3A)
ILE  A 174 ( 0.6A)
ASN  A 177 (-0.6A)
TYR  A 127 ( 1.3A)
1.22A 4rtrA-3gnrA:
undetectable
4rtrA-3gnrA:
19.24
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.
3hjb GLUCOSE-6-PHOSPHATE
ISOMERASE


(Vibrio cholerae)
PF00342
(PGI)
5 TRP A 140
GLY A 142
PHE A 241
ILE A 256
ASN A 260
None
1.24A 4rtrA-3hjbA:
undetectable
4rtrA-3hjbA:
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.
3jr3 NAD-DEPENDENT
DEACETYLASE


(Thermotoga
maritima)
PF02146
(SIR2)
5 GLY A  23
PHE A  33
ILE A  68
ASP A  32
PRO A  31
None
1.41A 4rtrA-3jr3A:
3.2
4rtrA-3jr3A:
24.05
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.
3ls2 S-FORMYLGLUTATHIONE
HYDROLASE


(Pseudoalteromonas
haloplanktis)
PF00756
(Esterase)
5 GLY A  53
PHE A 262
ASP A 225
ASN A 226
TYR A 256
None
1.47A 4rtrA-3ls2A:
undetectable
4rtrA-3ls2A:
23.71
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.
3nbu GLUCOSE-6-PHOSPHATE
ISOMERASE


(Escherichia
coli)
PF00342
(PGI)
5 TRP A 139
GLY A 141
PHE A 240
ILE A 255
TYR A 142
None
1.30A 4rtrA-3nbuA:
2.9
4rtrA-3nbuA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nx3 ACETYLORNITHINE
AMINOTRANSFERASE


(Campylobacter
jejuni)
PF00202
(Aminotran_3)
5 GLY A  51
ILE A 381
SER A 385
ASP A  40
PRO A 372
None
1.21A 4rtrA-3nx3A:
3.7
4rtrA-3nx3A:
21.55
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.
3pih UVRABC SYSTEM
PROTEIN A


(Thermotoga
maritima)
PF00005
(ABC_tran)
5 GLY A 714
PHE A 691
ILE A 687
TYR A 756
TYR A 702
None
1.37A 4rtrA-3pihA:
5.1
4rtrA-3pihA:
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.
3q3v PHOSPHOGLYCERATE
KINASE


(Campylobacter
jejuni)
PF00162
(PGK)
5 PHE A 173
ASP A 145
ILE A 143
ASN A 144
TYR A  48
None
1.01A 4rtrA-3q3vA:
3.6
4rtrA-3q3vA:
19.37
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.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE


(Entamoeba
histolytica)
PF00145
(DNA_methylase)
5 PHE A  12
ASP A  37
ILE A  38
ASN A  39
PRO A  80
SAH  A 323 (-4.4A)
SAH  A 323 (-2.9A)
SAH  A 323 (-4.0A)
SAH  A 323 (-4.8A)
SAH  A 323 (-4.4A)
0.79A 4rtrA-3qv2A:
5.6
4rtrA-3qv2A:
20.22
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.
3wcy INTERFERON
ALPHA/BETA RECEPTOR
1


(Mus musculus)
PF01108
(Tissue_fac)
PF09294
(Interfer-bind)
5 TRP A 130
GLY A 124
ILE A 179
TYR A 189
PRO A 105
None
1.41A 4rtrA-3wcyA:
undetectable
4rtrA-3wcyA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zif HEXON PROTEIN

(Bovine
mastadenovirus
B)
PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C)
5 GLY A 652
PHE A 659
ASP A 550
SER A 662
TYR A 661
None
1.39A 4rtrA-3zifA:
undetectable
4rtrA-3zifA:
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.
4dr0 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT BETA


(Bacillus
subtilis)
PF00268
(Ribonuc_red_sm)
5 ILE A 190
SER A 104
TYR A 105
PRO A 175
TYR A 174
None
1.22A 4rtrA-4dr0A:
undetectable
4rtrA-4dr0A:
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.
4ez5 CYCLIN-DEPENDENT
KINASE 6


(Homo sapiens)
PF00069
(Pkinase)
5 TRP A 203
ILE A 289
SER A 293
ASP A 201
PRO A 199
None
1.44A 4rtrA-4ez5A:
undetectable
4rtrA-4ez5A:
20.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gom DNA ADENINE
METHYLASE


(Escherichia
coli)
PF02086
(MethyltransfD12)
5 TRP D  10
GLY D  12
ASP D  54
ASN D  56
TYR D 184
0Y0  D 301 (-4.5A)
None
0Y0  D 301 (-2.8A)
None
0Y0  D 301 (-3.4A)
0.96A 4rtrA-4gomD:
38.7
4rtrA-4gomD:
92.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gom DNA ADENINE
METHYLASE


(Escherichia
coli)
PF02086
(MethyltransfD12)
10 TRP D  10
PHE D  35
ASP D  54
ILE D  55
ASN D  56
SER D 164
TYR D 165
ASP D 181
PRO D 183
TYR D 184
0Y0  D 301 (-4.5A)
0Y0  D 301 (-4.4A)
0Y0  D 301 (-2.8A)
0Y0  D 301 (-3.8A)
None
0Y0  D 301 (-3.6A)
None
0Y0  D 301 (-3.2A)
0Y0  D 301 (-4.0A)
0Y0  D 301 (-3.4A)
0.28A 4rtrA-4gomD:
38.7
4rtrA-4gomD:
92.95
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.
4ha4 BETA-GALACTOSIDASE

(Acidilobus
saccharovorans)
PF00232
(Glyco_hydro_1)
5 GLY A 339
PHE A 361
SER A 478
TYR A 398
PRO A 353
None
1.39A 4rtrA-4ha4A:
undetectable
4rtrA-4ha4A:
20.12
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.
4hf7 PUTATIVE
ACYLHYDROLASE


(Bacteroides
thetaiotaomicron)
PF13472
(Lipase_GDSL_2)
5 PHE A 131
ILE A 179
ASN A 176
TYR A 182
TYR A 129
None
1.41A 4rtrA-4hf7A:
4.0
4rtrA-4hf7A:
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.
4iyj GDSL-LIKE PROTEIN

(Bacteroides
uniformis)
PF13472
(Lipase_GDSL_2)
5 PHE A 123
ILE A 171
ASN A 168
TYR A 174
TYR A 121
None
1.41A 4rtrA-4iyjA:
4.2
4rtrA-4iyjA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jn7 ENOLASE

(Agrobacterium
tumefaciens)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 GLY A 390
ASP A 156
ILE A 157
PRO A 385
TYR A 392
None
None
EDO  A 404 ( 4.1A)
None
None
1.45A 4rtrA-4jn7A:
undetectable
4rtrA-4jn7A:
22.76
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.
4jy6 PGT123 HEAVY CHAIN

(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
5 TRP B  36
GLY B  49
ILE B  29
SER B  28
TYR B  50
None
1.50A 4rtrA-4jy6B:
undetectable
4rtrA-4jy6B:
21.23
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.
4nk5 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]


(Candidatus
Liberibacter
asiaticus)
PF13561
(adh_short_C2)
5 GLY A 138
PHE A  88
ILE A 142
ASN A 185
ASP A  87
None
1.37A 4rtrA-4nk5A:
3.3
4rtrA-4nk5A:
25.08
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.
4oju HYPOTHETICAL LEUCINE
RICH REPEAT PROTEIN


(Pseudoflavonifractor
capillosus)
PF13306
(LRR_5)
5 GLY A  44
PHE A  38
ILE A  80
TYR A  36
TYR A  75
None
1.43A 4rtrA-4ojuA:
undetectable
4rtrA-4ojuA:
21.69
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.
4qri HYPOXANTHINE-GUANINE
-XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE


(Leptospira
interrogans)
PF00156
(Pribosyltran)
5 GLY A  47
PHE A  40
ILE A  39
ASN A  65
TYR A  33
None
1.18A 4rtrA-4qriA:
3.9
4rtrA-4qriA:
22.48
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.
4v2i ESTERASE/LIPASE

(Thalassospira
sp. GB04J01)
PF07859
(Abhydrolase_3)
5 GLY A  85
PHE A 287
ILE A 303
TYR A 280
ASP A 286
None
1.46A 4rtrA-4v2iA:
undetectable
4rtrA-4v2iA:
21.96
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.
4wmj GLUCOSE-6-PHOSPHATE
ISOMERASE


(Colias
eurytheme)
PF00342
(PGI)
5 TRP A 145
GLY A 147
PHE A 246
ILE A 261
TYR A 148
None
1.35A 4rtrA-4wmjA:
undetectable
4rtrA-4wmjA:
20.55
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.
4wmj GLUCOSE-6-PHOSPHATE
ISOMERASE


(Colias
eurytheme)
PF00342
(PGI)
5 TRP A 145
PHE A 246
ILE A 261
ASN A 265
TYR A 148
None
1.36A 4rtrA-4wmjA:
undetectable
4rtrA-4wmjA:
20.55
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.
4xru RNL

(Capnocytophaga
gingivalis)
PF16542
(PNKP_ligase)
5 GLY B  64
ASP B 260
ILE B 258
ASN B 259
SER B 254
MG  B 505 (-4.7A)
None
None
None
None
1.05A 4rtrA-4xruB:
undetectable
4rtrA-4xruB:
20.10
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE


(Vesicular
stomatitis
virus)
PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap)
5 TRP A 506
GLY A1332
SER A1171
ASP A 457
PRO A 456
None
1.39A 4rtrA-5a22A:
7.9
4rtrA-5a22A:
9.52
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.
5b8i SERINE/THREONINE-PRO
TEIN PHOSPHATASE


(Coccidioides
immitis)
PF00149
(Metallophos)
5 GLY A 263
PHE A 257
ASP A 256
TYR A 309
TYR A 265
None
1.50A 4rtrA-5b8iA:
undetectable
4rtrA-5b8iA:
24.50
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.
5btr NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-1


(Homo sapiens)
PF02146
(SIR2)
5 GLY A 355
ASP A 348
ILE A 347
ASN A 346
TYR A 317
None
1.31A 4rtrA-5btrA:
undetectable
4rtrA-5btrA:
22.82
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.
5d0f UNCHARACTERIZED
PROTEIN


([Candida]
glabrata)
PF06202
(GDE_C)
PF14699
(hGDE_N)
PF14701
(hDGE_amylase)
PF14702
(hGDE_central)
5 PHE A1444
ASN A1449
TYR A1443
PRO A1373
TYR A1375
None
1.49A 4rtrA-5d0fA:
undetectable
4rtrA-5d0fA:
11.16
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE


(Thermococcus
kodakarensis)
PF01170
(UPF0020)
PF02926
(THUMP)
5 PHE A 187
ASP A 208
ILE A 209
ASP A 254
PRO A 256
SAM  A 400 (-4.7A)
SAM  A 400 (-2.8A)
SAM  A 400 (-3.9A)
None
SAM  A 400 (-4.2A)
0.83A 4rtrA-5e72A:
11.2
4rtrA-5e72A:
23.32
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE


(Thermococcus
kodakarensis)
PF01170
(UPF0020)
PF02926
(THUMP)
5 PHE A 187
ASP A 208
ILE A 209
PRO A 256
TYR A 257
SAM  A 400 (-4.7A)
SAM  A 400 (-2.8A)
SAM  A 400 (-3.9A)
SAM  A 400 (-4.2A)
None
0.66A 4rtrA-5e72A:
11.2
4rtrA-5e72A:
23.32
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.
5fsg MALTOSE-BINDING
PERIPLASMIC PROTEIN,
HANTAVIRUS
NUCLEOPROTEIN


(Hantaan
orthohantavirus)
PF00846
(Hanta_nucleocap)
PF13416
(SBP_bac_8)
5 GLY A-303
ILE A-106
ASN A-105
TYR A-266
TYR A-273
None
1.09A 4rtrA-5fsgA:
undetectable
4rtrA-5fsgA:
18.12
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.
5h8w ATP-DEPENDENT DNA
HELICASE TA0057


(Thermoplasma
acidophilum)
PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2)
5 GLY A  87
PHE A 154
TYR A 157
PRO A 165
TYR A 166
None
1.16A 4rtrA-5h8wA:
4.6
4rtrA-5h8wA:
20.23
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.
5isx GRAMICIDIN S
SYNTHASE 1


(Brevibacillus
brevis)
PF00550
(PP-binding)
PF00668
(Condensation)
5 GLY A 618
ASP A 792
ILE A 795
SER A 794
ASP A 673
None
1.25A 4rtrA-5isxA:
undetectable
4rtrA-5isxA:
17.80
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.
5jrp MARBERG VIRUS
MONOCLONAL ANTIBODY
MR78 FAB HEAVY CHAIN


(Homo sapiens)
no annotation 5 TRP H  43
GLY H  56
ILE H  30
SER H  31
TYR H  60
None
1.38A 4rtrA-5jrpH:
undetectable
4rtrA-5jrpH:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ntf AMINOPEPTIDASE

(Trypanosoma
cruzi)
PF00883
(Peptidase_M17)
5 GLY A 307
PHE A 165
TYR A 176
ASP A 213
PRO A 215
None
1.30A 4rtrA-5ntfA:
2.4
4rtrA-5ntfA:
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.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE


(Methanocaldococcus
jannaschii)
no annotation 5 PHE A 139
ILE A 124
ASN A 144
SER A 113
TYR A 164
None
1.39A 4rtrA-5od2A:
3.7
4rtrA-5od2A:
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.
5tvg ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)


(Burkholderia
vietnamiensis)
PF00982
(Glyco_transf_20)
5 GLY A 365
PHE A 159
TYR A 198
ASP A 191
PRO A 160
GOL  A 504 (-3.7A)
None
None
None
None
1.31A 4rtrA-5tvgA:
2.1
4rtrA-5tvgA:
21.60
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.
5uin FORMYLTRANSFERASE

(Salmonella
enterica)
PF00551
(Formyl_trans_N)
PF13637
(Ank_4)
5 GLY A 304
ASP A  10
ILE A 156
ASN A   9
SER A 157
None
1.05A 4rtrA-5uinA:
3.1
4rtrA-5uinA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)


(Paraburkholderia
xenovorans)
PF00982
(Glyco_transf_20)
5 GLY A 377
PHE A 167
TYR A 206
ASP A 199
PRO A 168
None
1.24A 4rtrA-5v0tA:
2.0
4rtrA-5v0tA:
21.33
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.
5wy0 SMALL RNA
2'-O-METHYLTRANSFERA
SE


(Homo sapiens)
no annotation 5 ASP A  48
ILE A  49
ASN A  50
SER A  84
ASP A  23
SAM  A 800 (-2.8A)
SAM  A 800 (-4.0A)
None
SAM  A 800 (-3.4A)
SAM  A 800 ( 4.5A)
1.03A 4rtrA-5wy0A:
10.6
4rtrA-5wy0A:
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.
5y83 MEMBRANE PROTEIN
INSERTASE YIDC


(Thermotoga
maritima)
no annotation 5 GLY A 180
PHE A  72
ASP A  73
ILE A  50
PRO A 141
None
1.50A 4rtrA-5y83A:
undetectable
4rtrA-5y83A:
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.
6be3 FAB (F598) HEAVY
CHAIN


(Homo sapiens)
no annotation 5 TRP H  36
GLY H  49
ILE H  29
SER H  28
ASP H  98
None
1.33A 4rtrA-6be3H:
undetectable
4rtrA-6be3H:
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.
6dbr -

(-)
no annotation 5 TRP A 915
GLY A 976
ASP A 819
ILE A 820
ASN A 822
None
1.32A 4rtrA-6dbrA:
undetectable
4rtrA-6dbrA:
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.
6f42 DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC1
DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC2


(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae)
no annotation
no annotation
5 GLY B 764
ILE A 564
SER A 565
TYR A 562
ASP A 556
None
1.45A 4rtrA-6f42B:
undetectable
4rtrA-6f42B:
undetectable