SIMILAR PATTERNS OF AMINO ACIDS FOR 2YA7_C_ZMRC1776_1

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.
1l0w ASPARTYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		5 ASP A 230
ASP A 530
LEU A 144
ARG A 131
ARG A 127
 None
 1.48A 2ya7C-1l0wA:
undetectable		 2ya7C-1l0wA:
20.27
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.
1ms8 TRANS-SIALIDASE

(Trypanosoma
cruzi) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		5 ARG A  35
ASP A  51
ARG A 245
ARG A 314
TYR A 342
 DAN  A 700 (-3.0A)
None
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
 0.81A 2ya7C-1ms8A:
36.1		 2ya7C-1ms8A:
24.70
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.
1ms8 TRANS-SIALIDASE

(Trypanosoma
cruzi) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		5 ARG A  35
ASP A  51
ASP A  96
ARG A 245
ARG A 314
 DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
 0.86A 2ya7C-1ms8A:
36.1		 2ya7C-1ms8A:
24.70
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.
1mt5 FATTY-ACID AMIDE
HYDROLASE

(Rattus
norvegicus) 		PF01425
(Amidase) 		5 ARG A 486
ILE A 534
ILE A 530
ASP A 529
LEU A 433
 None
 1.34A 2ya7C-1mt5A:
undetectable		 2ya7C-1mt5A:
21.79
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.
1mz5 SIALIDASE

(Trypanosoma
rangeli) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		7 ARG A  36
ILE A  37
ASP A  52
ASP A  97
ARG A 246
ARG A 315
TYR A 343
 None
 0.47A 2ya7C-1mz5A:
35.7		 2ya7C-1mz5A:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mz5 SIALIDASE

(Trypanosoma
rangeli) 		PF13385
(Laminin_G_3)
PF13859
(BNR_3) 		5 ARG A  36
ILE A  37
ASP A  52
ILE A  64
ARG A 315
 None
 1.41A 2ya7C-1mz5A:
35.7		 2ya7C-1mz5A:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t6k PHENAZINE
BIOSYNTHESIS PROTEIN
PHZF

(Pseudomonas
fluorescens) 		PF02567
(PhzC-PhzF) 		5 ASP A 130
ILE A 146
PHE A 187
TYR A 149
LEU A 218
 None
 1.48A 2ya7C-1t6kA:
undetectable		 2ya7C-1t6kA:
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		7 ARG A  68
ILE A  69
ASP A  85
ASP A 131
ARG A 276
ARG A 342
TYR A 370
 CIT  A1649 ( 2.6A)
None
None
GOL  A1650 (-2.7A)
CIT  A1649 ( 2.7A)
CIT  A1649 ( 2.9A)
CIT  A1649 (-4.5A)
 0.35A 2ya7C-1w8oA:
45.7		 2ya7C-1w8oA:
24.84
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.
1xa0 PUTATIVE NADPH
DEPENDENT
OXIDOREDUCTASES

(Geobacillus
stearothermophilus) 		PF00107
(ADH_zinc_N) 		5 ILE A  66
ASP A  46
ASP A  67
LEU A 287
ARG A 280
 None
 1.25A 2ya7C-1xa0A:
undetectable		 2ya7C-1xa0A:
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.
2anp LEUCYL
AMINOPEPTIDASE

(Vibrio
proteolyticus) 		PF04389
(Peptidase_M28) 		5 ILE A 193
ASP A 195
TYR A 225
LEU A 155
TYR A 251
 None
 1.31A 2ya7C-2anpA:
undetectable		 2ya7C-2anpA:
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.
2anp LEUCYL
AMINOPEPTIDASE

(Vibrio
proteolyticus) 		PF04389
(Peptidase_M28) 		5 ILE A 255
ASP A 260
ASP A 117
ASP A 118
LEU A 155
 None
None
ZN  A 501 ( 2.4A)
ZN  A 502 ( 4.9A)
None
 1.31A 2ya7C-2anpA:
undetectable		 2ya7C-2anpA:
19.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		5 ARG A 266
ILE A 267
ASP A 283
ILE A 297
ARG A 615
 SIA  A1692 (-2.7A)
SIA  A1692 (-4.5A)
None
None
SIA  A1692 (-3.1A)
 1.36A 2ya7C-2bf6A:
52.3		 2ya7C-2bf6A:
43.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2bf6 EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF13088
(BNR_2) 		9 ARG A 266
ILE A 267
ASP A 283
ILE A 327
ASP A 328
TYR A 485
ARG A 555
ARG A 615
TYR A 655
 SIA  A1692 (-2.7A)
SIA  A1692 (-4.5A)
None
SIA  A1692 (-4.5A)
SIA  A1692 (-2.9A)
SIA  A1692 (-4.7A)
SIA  A1692 (-2.9A)
SIA  A1692 (-3.1A)
SIA  A1692 (-4.2A)
 0.34A 2ya7C-2bf6A:
52.3		 2ya7C-2bf6A:
43.11
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.
2bju PLASMEPSIN II

(Plasmodium
falciparum) 		PF00026
(Asp) 		5 ILE A 139
ILE A 170
ASP A   4
PHE A 156
LEU A   8
 None
 1.03A 2ya7C-2bjuA:
undetectable		 2ya7C-2bjuA:
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.
2f28 SIALIDASE 2

(Homo sapiens) 		PF13088
(BNR_2) 		6 ARG A  21
ILE A  22
TYR A 179
ARG A 237
ARG A 304
TYR A 334
 None
 0.41A 2ya7C-2f28A:
40.7		 2ya7C-2f28A:
23.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w20 SIALIDASE A

(Streptococcus
pneumoniae) 		PF13088
(BNR_2) 		11 ARG A 347
ILE A 348
ASP A 364
ILE A 416
ASP A 417
ASP A 434
TYR A 590
LEU A 598
ARG A 663
ARG A 721
TYR A 752
 None
 0.22A 2ya7C-2w20A:
68.0		 2ya7C-2w20A:
94.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w20 SIALIDASE A

(Streptococcus
pneumoniae) 		PF13088
(BNR_2) 		5 ARG A 366
ASP A 417
PHE A 443
TYR A 590
LEU A 598
 None
 1.24A 2ya7C-2w20A:
68.0		 2ya7C-2w20A:
94.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w20 SIALIDASE A

(Streptococcus
pneumoniae) 		PF13088
(BNR_2) 		5 ARG A 366
ILE A 348
ASP A 417
TYR A 590
LEU A 598
 None
 1.30A 2ya7C-2w20A:
68.0		 2ya7C-2w20A:
94.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w20 SIALIDASE A

(Streptococcus
pneumoniae) 		PF13088
(BNR_2) 		7 ASP A 364
ILE A 416
ASP A 417
ASP A 434
PHE A 443
TYR A 590
LEU A 598
 None
 0.72A 2ya7C-2w20A:
68.0		 2ya7C-2w20A:
94.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w38 SIALIDASE

(Pseudomonas
aeruginosa) 		PF13088
(BNR_2) 		5 ASP A  79
TYR A 146
ARG A 198
ARG A 260
TYR A 297
 None
 0.70A 2ya7C-2w38A:
32.7		 2ya7C-2w38A:
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.
2xzi EXTRACELLULAR
SIALIDASE/NEURAMINID
ASE, PUTATIVE

(Aspergillus
fumigatus) 		PF13088
(BNR_2) 		5 ARG A  59
ILE A  60
ARG A 265
ARG A 322
TYR A 358
 KDM  A 500 (-2.7A)
None
KDM  A 500 (-2.7A)
KDM  A 500 ( 3.0A)
KDM  A 500 (-4.5A)
 0.29A 2ya7C-2xziA:
37.2		 2ya7C-2xziA:
26.09
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.
3ld1 REPLICASE
POLYPROTEIN 1A

(Avian
coronavirus) 		no annotation 5 ARG A 152
ILE A 191
ILE A 202
PHE A 209
LEU A 235
 None
 1.16A 2ya7C-3ld1A:
undetectable		 2ya7C-3ld1A:
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.
3rre PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermotoga
maritima) 		PF01256
(Carb_kinase)
PF03853
(YjeF_N) 		5 ILE A 125
ILE A 116
ASP A 114
PHE A 101
LEU A 106
 None
None
K  A 491 (-3.2A)
None
None
 1.17A 2ya7C-3rreA:
undetectable		 2ya7C-3rreA:
23.37
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.
3sil SIALIDASE

(Salmonella
enterica) 		PF13859
(BNR_3) 		7 ARG A  37
ILE A  38
ASP A  54
ASP A 100
ARG A 246
ARG A 309
TYR A 342
 PO4  A 499 (-2.7A)
None
None
GOL  A 403 (-3.4A)
PO4  A 499 (-2.7A)
PO4  A 499 (-3.0A)
PO4  A 499 (-4.6A)
 0.41A 2ya7C-3silA:
36.7		 2ya7C-3silA:
25.93
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.
3sil SIALIDASE

(Salmonella
enterica) 		PF13859
(BNR_3) 		7 ILE A  38
ASP A  54
ASP A 100
LEU A 205
ARG A 246
ARG A 309
TYR A 342
 None
None
GOL  A 403 (-3.4A)
None
PO4  A 499 (-2.7A)
PO4  A 499 (-3.0A)
PO4  A 499 (-4.6A)
 1.39A 2ya7C-3silA:
36.7		 2ya7C-3silA:
25.93
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.
4bbw SIALIDASE
(NEURAMINIDASE)

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2)
PF14873
(BNR_assoc_N) 		7 ARG A 204
ILE A 205
ASP A 221
ASP A 272
ARG A 415
ARG A 479
TYR A 510
 None
 0.46A 2ya7C-4bbwA:
44.2		 2ya7C-4bbwA:
26.94
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.
4fj6 GLYCOSIDE HYDROLASE
FAMILY 33, CANDIDATE
SIALIDASE

(Parabacteroides
distasonis) 		PF13859
(BNR_3)
PF14873
(BNR_assoc_N) 		7 ARG A 200
ILE A 201
ASP A 217
ASP A 268
ARG A 411
ARG A 475
TYR A 506
 PO4  A 607 ( 2.6A)
None
None
None
PO4  A 607 (-2.7A)
PO4  A 607 (-2.8A)
PO4  A 607 (-4.6A)
 0.31A 2ya7C-4fj6A:
44.6		 2ya7C-4fj6A:
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.
4fzh HEMAGGLUTININ-NEURAM
INIDASE

(Avian
avulavirus 1) 		PF00423
(HN) 		6 ARG A 174
ILE A 175
TYR A 317
ARG A 416
ARG A 498
TYR A 526
 None
 0.94A 2ya7C-4fzhA:
5.3		 2ya7C-4fzhA:
22.18
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.
4jf7 HEMAGGLUTININ-NEURAM
INIDASE

(Mammalian
rubulavirus 5) 		no annotation 5 ARG D 163
ILE D 164
LEU D 459
ARG D 405
TYR D 523
 SO4  D 608 ( 4.1A)
None
None
SO4  D 608 (-2.6A)
None
 1.26A 2ya7C-4jf7D:
7.1		 2ya7C-4jf7D:
20.95
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.
4jf7 HEMAGGLUTININ-NEURAM
INIDASE

(Mammalian
rubulavirus 5) 		no annotation 6 ARG D 163
ILE D 164
TYR D 306
ARG D 405
ARG D 495
TYR D 523
 SO4  D 608 ( 4.1A)
None
None
SO4  D 608 (-2.6A)
SO4  D 608 (-3.3A)
None
 0.69A 2ya7C-4jf7D:
7.1		 2ya7C-4jf7D:
20.95
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.
4jxk OXIDOREDUCTASE

(Rhodococcus
opacus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ILE A  66
ASP A  46
ASP A  67
LEU A 286
ARG A 279
 None
 1.37A 2ya7C-4jxkA:
undetectable		 2ya7C-4jxkA:
23.98
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.
4lmw GLUTATHIONE
TRANSFERASE

(Phanerochaete
chrysosporium) 		PF13417
(GST_N_3) 		5 ILE A  11
ASP A  10
LEU A 126
ARG A 153
TYR A  46
 None
None
None
FMT  A 305 ( 4.0A)
FMT  A 301 ( 4.9A)
 1.11A 2ya7C-4lmwA:
undetectable		 2ya7C-4lmwA:
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.
4q6k BNR/ASP-BOX REPEAT
PROTEIN

(Bacteroides
caccae) 		PF13088
(BNR_2)
PF14873
(BNR_assoc_N) 		7 ARG A 220
ILE A 221
ASP A 237
ASP A 288
ARG A 431
ARG A 495
TYR A 526
 EDO  A 604 (-4.0A)
None
None
EDO  A 607 (-3.1A)
None
None
None
 0.32A 2ya7C-4q6kA:
44.4		 2ya7C-4q6kA:
25.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		5 ARG A 293
ILE A 294
ASP A 310
ILE A 323
ARG A 673
 CNP  A 760 (-3.0A)
CNP  A 760 (-4.5A)
None
None
CNP  A 760 (-3.0A)
 1.25A 2ya7C-4sliA:
41.1		 2ya7C-4sliA:
25.88
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE

(Macrobdella
decora) 		PF02973
(Sialidase)
PF13088
(BNR_2) 		10 ARG A 293
ILE A 294
ASP A 310
ILE A 374
ASP A 375
ASP A 392
TYR A 561
ARG A 611
ARG A 673
TYR A 713
 CNP  A 760 (-3.0A)
CNP  A 760 (-4.5A)
None
CNP  A 760 ( 4.4A)
CNP  A 760 (-2.8A)
CNP  A 760 (-4.4A)
None
CNP  A 760 (-3.0A)
CNP  A 760 (-3.0A)
CNP  A 760 (-4.0A)
 0.41A 2ya7C-4sliA:
41.1		 2ya7C-4sliA:
25.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		5 ARG A 257
ILE A 258
ASP A 274
ILE A 287
ARG A 637
 3XR  A 802 (-3.0A)
None
None
None
3XR  A 802 (-3.0A)
 1.43A 2ya7C-4x6kA:
41.0		 2ya7C-4x6kA:
31.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		10 ARG A 257
ILE A 258
ASP A 274
ILE A 338
ASP A 339
ASP A 356
TYR A 525
ARG A 575
ARG A 637
TYR A 677
 3XR  A 802 (-3.0A)
None
None
3XR  A 802 (-4.2A)
3XR  A 802 (-2.8A)
3XR  A 802 (-4.6A)
None
3XR  A 802 (-2.6A)
3XR  A 802 (-3.0A)
3XR  A 802 (-4.2A)
 0.35A 2ya7C-4x6kA:
41.0		 2ya7C-4x6kA:
31.27
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		5 ARG A 245
ILE A 246
ASP A 262
ILE A 275
ARG A 619
 NHE  A 702 (-2.7A)
None
None
None
NHE  A 702 (-2.9A)
 1.44A 2ya7C-4xhbA:
40.6		 2ya7C-4xhbA:
24.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		10 ARG A 245
ILE A 246
ASP A 262
ILE A 326
ASP A 327
ASP A 344
TYR A 509
ARG A 557
ARG A 619
TYR A 653
 NHE  A 702 (-2.7A)
None
None
NHE  A 702 ( 4.8A)
NHE  A 702 (-3.6A)
None
None
NHE  A 702 (-2.8A)
NHE  A 702 (-2.9A)
NHE  A 702 (-4.8A)
 0.32A 2ya7C-4xhbA:
40.6		 2ya7C-4xhbA:
24.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		5 ARG A 290
ASP A 307
ILE A 371
ASP A 388
PHE A 316
 G39  A 801 (-2.6A)
None
None
G39  A 801 ( 4.8A)
GOL  A 802 (-4.9A)
 0.83A 2ya7C-4yw5A:
39.6		 2ya7C-4yw5A:
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.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		6 ARG A 290
ILE A 291
ASP A 307
ILE A 320
ARG A 662
TYR A 695
 G39  A 801 (-2.6A)
None
None
None
G39  A 801 (-2.9A)
G39  A 801 (-4.4A)
 1.30A 2ya7C-4yw5A:
39.6		 2ya7C-4yw5A:
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.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		10 ARG A 290
ILE A 291
ASP A 307
ILE A 371
ASP A 372
ASP A 388
TYR A 553
ARG A 600
ARG A 662
TYR A 695
 G39  A 801 (-2.6A)
None
None
None
G39  A 801 (-2.6A)
G39  A 801 ( 4.8A)
None
G39  A 801 (-2.9A)
G39  A 801 (-2.9A)
G39  A 801 (-4.4A)
 0.36A 2ya7C-4yw5A:
39.6		 2ya7C-4yw5A:
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.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		6 ARG A 180
ILE A 181
TYR A 323
ARG A 422
ARG A 512
TYR A 540
 SLT  A 606 (-2.6A)
None
SLT  A 606 (-4.6A)
SLT  A 606 (-3.0A)
SLT  A 606 (-2.8A)
SLT  A 606 (-4.7A)
 0.59A 2ya7C-5b2dA:
7.7		 2ya7C-5b2dA:
22.69
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.
6byw GOXA

(Pseudoalteromonas
luteoviolacea) 		no annotation 5 ARG B 404
ILE B 365
ASP B 360
TYR B  45
TYR B 807
 None
None
MG  B 901 (-2.8A)
None
None
 1.26A 2ya7C-6bywB:
undetectable		 2ya7C-6bywB:
13.32
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.
6c93 CYTOCHROME P450 4B1

(Oryctolagus
cuniculus) 		no annotation 5 ILE A 117
ASP A 305
TYR A 206
LEU A 187
ARG A 488
 None
 1.15A 2ya7C-6c93A:
undetectable		 2ya7C-6c93A:
9.33
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.
6ejb XYLOSYLTRANSFERASE 1

(Homo sapiens) 		no annotation 5 ARG A 957
ASP A 433
PHE A 330
LEU A 422
TYR A 617
 None
 1.48A 2ya7C-6ejbA:
undetectable		 2ya7C-6ejbA:
11.09
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.
6eks SIALIDASE

(Vibrio cholerae) 		no annotation 6 ARG A 250
ILE A 251
ASP A 318
ARG A 661
ARG A 738
TYR A 766
 G39  A 908 (-2.8A)
G39  A 908 (-4.7A)
G39  A 908 ( 4.2A)
G39  A 908 (-2.8A)
G39  A 908 (-3.0A)
G39  A 908 (-4.6A)
 0.83A 2ya7C-6eksA:
41.2		 2ya7C-6eksA:
22.19
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.
6eks SIALIDASE

(Vibrio cholerae) 		no annotation 6 ARG A 250
ILE A 251
ASP A 318
LEU A 606
ARG A 738
TYR A 766
 G39  A 908 (-2.8A)
G39  A 908 (-4.7A)
G39  A 908 ( 4.2A)
None
G39  A 908 (-3.0A)
G39  A 908 (-4.6A)
 1.27A 2ya7C-6eksA:
41.2		 2ya7C-6eksA:
22.19
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.
6eq8 PERIPLASMIC
ALPHA-GALACTOSIDE-BI
NDING PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 5 ASP D 114
ILE D 115
ASP D 642
PHE D 331
LEU D 619
 BQZ  D 708 ( 4.8A)
None
None
None
None
 1.42A 2ya7C-6eq8D:
undetectable		 2ya7C-6eq8D:
9.51
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.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 5 ILE A 346
ASP A 351
ASP A 207
ASP A 208
LEU A 245
 None
None
ZN  A 402 ( 2.2A)
None
None
 1.38A 2ya7C-6eslA:
undetectable		 2ya7C-6eslA:
10.55
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.
6fbt LYTIC MUREIN
TRANSGLYCOSYLASE

(Pseudomonas
aeruginosa) 		no annotation 5 ARG A 438
ILE A 442
ASP A 439
ARG A 392
TYR A 466
 None
 1.26A 2ya7C-6fbtA:
undetectable		 2ya7C-6fbtA:
10.43