SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'C5P'


List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 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.
1AFS_A_TESA325_1
(3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE)		 4ber PHOSPHOCHOLINE
TRANSFERASE ANKX
(Legionella
pneumophila) 		4 / 7 LEU A  49
TYR A  41
THR A 257
ASN A 242
 None
C5P  A1000 (-3.5A)
None
None
 1.36A 1afsA-4berA:
undetectable		 1afsA-4berA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AFS_B_TESB325_1
(3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE)		 4ber PHOSPHOCHOLINE
TRANSFERASE ANKX
(Legionella
pneumophila) 		4 / 7 LEU A  49
TYR A  41
THR A 257
ASN A 242
 None
C5P  A1000 (-3.5A)
None
None
 1.36A 1afsB-4berA:
undetectable		 1afsB-4berA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)		 1uj2 URIDINE-CYTIDINE
KINASE 2
(Homo
sapiens) 		5 / 12 ALA A 139
SER A  34
GLU A 135
ARG A 174
ASP A  84
 None
MG  A2303 ( 2.3A)
MG  A2303 ( 4.6A)
C5P  A2301 (-3.9A)
C5P  A2301 (-2.8A)
 1.12A 1dy4A-1uj2A:
undetectable		 1dy4A-1uj2A:
17.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ICR_A_NIOA604_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 SER A 325
THR A 328
PHE A 292
GLY A 273
 None
None
C5P  A1344 (-4.6A)
C5P  A1344 (-3.2A)
 1.30A 1icrA-2wnbA:
undetectable
1icrB-2wnbA:
undetectable		 1icrA-2wnbA:
20.77
1icrB-2wnbA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ICR_B_NIOB602_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 GLY A 273
SER A 325
THR A 328
PHE A 292
 C5P  A1344 (-3.2A)
None
None
C5P  A1344 (-4.6A)
 1.26A 1icrA-2wnbA:
undetectable
1icrB-2wnbA:
undetectable		 1icrA-2wnbA:
20.77
1icrB-2wnbA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ICU_D_NIOD223_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 GLY A 273
SER A 325
THR A 328
PHE A 292
 C5P  A1344 (-3.2A)
None
None
C5P  A1344 (-4.6A)
 1.36A 1icuC-2wnbA:
undetectable
1icuD-2wnbA:
undetectable		 1icuC-2wnbA:
20.77
1icuD-2wnbA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ICV_B_NIOB702_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 GLY A 273
SER A 325
THR A 328
PHE A 292
 C5P  A1344 (-3.2A)
None
None
C5P  A1344 (-4.6A)
 1.33A 1icvA-2wnbA:
undetectable
1icvB-2wnbA:
undetectable		 1icvA-2wnbA:
20.77
1icvB-2wnbA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ICV_C_NIOC708_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 SER A 325
THR A 328
PHE A 292
GLY A 273
 None
None
C5P  A1344 (-4.6A)
C5P  A1344 (-3.2A)
 1.31A 1icvC-2wnbA:
undetectable
1icvD-2wnbA:
undetectable		 1icvC-2wnbA:
20.77
1icvD-2wnbA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ICV_D_NIOD706_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 GLY A 273
SER A 325
THR A 328
PHE A 292
 C5P  A1344 (-3.2A)
None
None
C5P  A1344 (-4.6A)
 1.29A 1icvC-2wnbA:
undetectable
1icvD-2wnbA:
undetectable		 1icvC-2wnbA:
20.77
1icvD-2wnbA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KQB_B_BEZB525_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2wnb -
(Sus
scrofa) 		4 / 5 GLY A 273
SER A 325
THR A 328
PHE A 292
 C5P  A1344 (-3.2A)
None
None
C5P  A1344 (-4.6A)
 1.32A 1kqbA-2wnbA:
undetectable
1kqbB-2wnbA:
undetectable		 1kqbA-2wnbA:
21.61
1kqbB-2wnbA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OLT_A_SAMA501_0
(OXYGEN-INDEPENDENT
COPROPORPHYRINOGEN
III OXIDASE)		 4emd 4-DIPHOSPHOCYTIDYL-2
-C-METHYL-D-ERYTHRIT
OL KINASE
(Mycobacteroides
abscessus) 		5 / 12 GLY A  29
ARG A 207
ILE A 196
PHE A 193
ALA A 238
 None
None
None
C5P  A 401 (-3.5A)
None
 1.37A 1oltA-4emdA:
undetectable		 1oltA-4emdA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P91_B_SAMB2401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A)		 4ber PHOSPHOCHOLINE
TRANSFERASE ANKX
(Legionella
pneumophila) 		5 / 12 LEU A  76
GLY A 236
TYR A 225
ILE A  80
LEU A   8
 None
C5P  A1000 (-3.3A)
None
None
None
 1.09A 1p91B-4berA:
undetectable		 1p91B-4berA:
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.
1PWY_E_AC2E290_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		5 / 10 GLY A 446
VAL A 464
THR A 360
VAL A 381
HIS A 405
 None
None
C5P  A1427 ( 4.5A)
None
C5P  A1427 (-3.9A)
 1.24A 1pwyE-2z4tA:
2.7		 1pwyE-2z4tA:
18.10
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.
1SV9_A_DIFA701_1
(PHOSPHOLIPASE A2)		 2wnb -
(Sus
scrofa) 		5 / 8 LEU A 263
ILE A 278
GLY A 273
HIS A 319
PHE A 212
 None
None
C5P  A1344 (-3.2A)
GAL  A1347 (-3.9A)
GAL  A1347 (-3.9A)
 1.46A 1sv9A-2wnbA:
undetectable		 1sv9A-2wnbA:
14.77
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.
1V54_B_CHDB4085_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE II
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIA-HEART)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.48A 1v54A-2wnbA:
0.0
1v54B-2wnbA:
0.0
1v54T-2wnbA:
0.0		 1v54A-2wnbA:
17.88
1v54B-2wnbA:
18.98
1v54T-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XP0_A_VDNA201_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4c8g 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Burkholderia
cenocepacia) 		5 / 10 LEU A  43
ALA A  45
ILE A  46
VAL A 100
ALA A 133
 None
None
None
None
C5P  A1163 (-3.6A)
 1.04A 1xp0A-4c8gA:
undetectable		 1xp0A-4c8gA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YAJ_B_BEZB12_0
(CES1 PROTEIN)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		4 / 4 GLY A 149
SER A 360
VAL A 154
LEU A 120
 GOL  A   5 (-3.4A)
C5P  A   1 ( 2.6A)
None
None
 1.13A 1yajB-2zwiA:
2.2		 1yajB-2zwiA:
20.91
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.
1Z11_C_8MOC501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		5 / 10 ILE A 276
GLY A 277
ILE A 291
LEU A 292
PHE A 373
 C5P  A   1 (-4.0A)
C5P  A   1 (-4.0A)
None
None
None
 1.11A 1z11C-2zwiA:
undetectable		 1z11C-2zwiA:
21.59
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.
2B17_A_DIFA701_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 2wnb -
(Sus
scrofa) 		5 / 10 LEU A 263
ILE A 278
GLY A 273
HIS A 319
PHE A 212
 None
None
C5P  A1344 (-3.2A)
GAL  A1347 (-3.9A)
GAL  A1347 (-3.9A)
 1.46A 2b17A-2wnbA:
undetectable		 2b17A-2wnbA:
14.77
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.
2H42_B_VIAB902_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4c8g 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Burkholderia
cenocepacia) 		5 / 12 ALA A 152
ILE A  46
VAL A 100
ALA A 133
ILE A 111
 None
None
None
C5P  A1163 (-3.6A)
None
 1.16A 2h42B-4c8gA:
undetectable		 2h42B-4c8gA:
18.13
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.
2H42_C_VIAC903_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4c8g 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Burkholderia
cenocepacia) 		5 / 12 LEU A  43
ALA A  45
ILE A  46
VAL A 100
ALA A 133
 None
None
None
None
C5P  A1163 (-3.6A)
 1.09A 2h42C-4c8gA:
undetectable		 2h42C-4c8gA:
18.13
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.
2J2P_B_SC2B1290_1
(FICOLIN-2)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		4 / 8 LEU A  50
SER A 360
LEU A 209
GLU A 152
 None
C5P  A   1 ( 2.6A)
GOL  A   7 (-4.5A)
GOL  A   5 ( 4.8A)
 0.73A 2j2pA-2zwiA:
undetectable
2j2pB-2zwiA:
undetectable		 2j2pA-2zwiA:
19.94
2j2pB-2zwiA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JB7_B_ACTB1169_0
(HYPOTHETICAL PROTEIN
PAE2307)		 2h92 CYTIDYLATE KINASE
(Staphylococcus
aureus) 		3 / 3 ARG A  87
ARG A 153
ARG A 160
 C5P  A1300 ( 4.8A)
SO4  A1400 ( 3.6A)
None
 0.84A 2jb7A-2h92A:
undetectable
2jb7B-2h92A:
undetectable
2jb7C-2h92A:
undetectable		 2jb7A-2h92A:
21.92
2jb7B-2h92A:
21.92
2jb7C-2h92A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JB7_B_ACTB1169_0
(HYPOTHETICAL PROTEIN
PAE2307)		 2h92 CYTIDYLATE KINASE
(Staphylococcus
aureus) 		3 / 3 ARG A 153
ARG A 160
ARG A  87
 SO4  A1400 ( 3.6A)
None
C5P  A1300 ( 4.8A)
 0.82A 2jb7A-2h92A:
undetectable
2jb7B-2h92A:
undetectable
2jb7C-2h92A:
undetectable		 2jb7A-2h92A:
21.92
2jb7B-2h92A:
21.92
2jb7C-2h92A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JB7_B_ACTB1169_0
(HYPOTHETICAL PROTEIN
PAE2307)		 2h92 CYTIDYLATE KINASE
(Staphylococcus
aureus) 		3 / 3 ARG A 160
ARG A  87
ARG A 153
 None
C5P  A1300 ( 4.8A)
SO4  A1400 ( 3.6A)
 0.81A 2jb7A-2h92A:
undetectable
2jb7B-2h92A:
undetectable
2jb7C-2h92A:
undetectable		 2jb7A-2h92A:
21.92
2jb7B-2h92A:
21.92
2jb7C-2h92A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2P02_A_SAMA2_0
(S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 8 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.73A 2p02A-2z4tA:
undetectable		 2p02A-2z4tA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X0P_A_ADNA1607_1
(ALCALIGIN
BIOSYNTHESIS PROTEIN)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		4 / 8 GLY A 277
HIS A 317
ILE A 327
ALA A 283
 C5P  A   1 (-4.0A)
C5P  A   1 (-4.0A)
None
None
 0.94A 2x0pA-2zwiA:
undetectable		 2x0pA-2zwiA:
20.19
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.
3ABK_O_CHDO229_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.48A 3abkG-2wnbA:
0.0
3abkN-2wnbA:
undetectable
3abkO-2wnbA:
0.0		 3abkG-2wnbA:
14.73
3abkN-2wnbA:
17.88
3abkO-2wnbA:
18.98
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.
3AG3_O_CHDO229_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2wnb -
(Sus
scrofa) 		5 / 11 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.48A 3ag3G-2wnbA:
undetectable
3ag3N-2wnbA:
undetectable
3ag3O-2wnbA:
undetectable		 3ag3G-2wnbA:
14.73
3ag3N-2wnbA:
17.88
3ag3O-2wnbA:
18.98
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.
3AG4_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2wnb -
(Sus
scrofa) 		5 / 12 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.49A 3ag4A-2wnbA:
0.0
3ag4B-2wnbA:
0.0
3ag4T-2wnbA:
0.0		 3ag4A-2wnbA:
17.88
3ag4B-2wnbA:
18.98
3ag4T-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG4_O_CHDO229_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.49A 3ag4G-2wnbA:
0.0
3ag4N-2wnbA:
0.0
3ag4O-2wnbA:
0.0		 3ag4G-2wnbA:
14.73
3ag4N-2wnbA:
17.88
3ag4O-2wnbA:
18.98
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.
3ASN_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.45A 3asnA-2wnbA:
0.0
3asnB-2wnbA:
0.0
3asnT-2wnbA:
0.0		 3asnA-2wnbA:
17.88
3asnB-2wnbA:
18.98
3asnT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASO_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.46A 3asoA-2wnbA:
0.0
3asoB-2wnbA:
0.0
3asoT-2wnbA:
0.0		 3asoA-2wnbA:
17.88
3asoB-2wnbA:
18.98
3asoT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CR4_X_PNTX101_0
(PROTEIN S100-B)		 4xsv ETHANOLAMINE-PHOSPHA
TE
CYTIDYLYLTRANSFERASE
(Homo
sapiens) 		3 / 3 CYH A 306
HIS A 307
PHE A 331
 None
C5P  A 401 (-3.4A)
None
 1.18A 3cr4X-4xsvA:
undetectable		 3cr4X-4xsvA:
13.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FPJ_B_SAMB301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 4xsv ETHANOLAMINE-PHOSPHA
TE
CYTIDYLYLTRANSFERASE
(Homo
sapiens) 		4 / 7 GLY A 248
GLY A 220
GLU A 283
ALA A 288
 None
C5P  A 401 (-3.1A)
None
None
 0.86A 3fpjB-4xsvA:
3.1		 3fpjB-4xsvA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JZJ_A_ACRA405_1
(ACARBOSE/MALTOSE
BINDING PROTEIN GACH)		 4ber PHOSPHOCHOLINE
TRANSFERASE ANKX
(Legionella
pneumophila) 		5 / 12 GLU A  35
GLY A  47
ARG A  44
ALA A 234
ASP A  28
 None
None
C5P  A1000 (-3.4A)
C5P  A1000 (-3.5A)
C5P  A1000 (-2.2A)
 1.10A 3jzjA-4berA:
undetectable		 3jzjA-4berA:
20.70
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.
3N8X_B_NIMB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 4emd 4-DIPHOSPHOCYTIDYL-2
-C-METHYL-D-ERYTHRIT
OL KINASE
(Mycobacteroides
abscessus) 		5 / 12 HIS A  37
ILE A 196
ALA A 237
SER A 240
LEU A 241
 C5P  A 401 (-3.7A)
None
None
None
None
 0.85A 3n8xB-4emdA:
undetectable		 3n8xB-4emdA:
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.
3TBG_A_RTZA2_1
(CYTOCHROME P450 2D6)		 5fa1 PUTATIVE N-ACETYL
GLUCOSAMINYL
TRANSFERASE
(Raoultella
terrigena) 		5 / 11 LEU A 308
THR A 309
SER A 301
GLU A 305
THR A 313
 None
None
C5P  A 501 (-2.6A)
None
None
 1.40A 3tbgA-5fa1A:
undetectable		 3tbgA-5fa1A:
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.
3WG7_B_CHDB303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.43A 3wg7A-2wnbA:
0.0
3wg7B-2wnbA:
0.0
3wg7T-2wnbA:
0.0		 3wg7A-2wnbA:
17.88
3wg7B-2wnbA:
18.98
3wg7T-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WG7_G_CHDG103_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.46A 3wg7G-2wnbA:
0.0
3wg7N-2wnbA:
0.0
3wg7O-2wnbA:
0.0		 3wg7G-2wnbA:
14.73
3wg7N-2wnbA:
17.88
3wg7O-2wnbA:
18.98
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.
3X2Q_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.50A 3x2qA-2wnbA:
0.0
3x2qB-2wnbA:
0.0
3x2qT-2wnbA:
0.0		 3x2qA-2wnbA:
17.88
3x2qB-2wnbA:
18.98
3x2qT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KS8_A_B49A701_1
(SERINE/THREONINE-PRO
TEIN KINASE PAK 6)		 5b8f 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Pseudomonas
aeruginosa) 		6 / 10 ILE A 109
ALA A 131
VAL A 148
LEU A  20
GLY A  21
LEU A  40
 None
C5P  A 202 (-3.8A)
None
None
None
None
 1.43A 4ks8A-5b8fA:
undetectable		 4ks8A-5b8fA:
18.24
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.
4MK4_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2h92 CYTIDYLATE KINASE
(Staphylococcus
aureus) 		3 / 3 LEU A 169
ILE A 173
ARG A 176
 None
None
C5P  A1300 (-3.1A)
 0.34A 4mk4B-2h92A:
3.0		 4mk4B-2h92A:
19.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKX_C_STRC601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 4xsv ETHANOLAMINE-PHOSPHA
TE
CYTIDYLYLTRANSFERASE
(Homo
sapiens) 		5 / 12 LEU A 233
PHE A 232
ILE A 245
GLY A 248
VAL A 305
 None
C5P  A 401 (-3.8A)
None
None
None
 1.05A 4nkxC-4xsvA:
undetectable		 4nkxC-4xsvA:
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.
4NKX_D_STRD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 4xsv ETHANOLAMINE-PHOSPHA
TE
CYTIDYLYLTRANSFERASE
(Homo
sapiens) 		5 / 12 LEU A 233
PHE A 232
ILE A 245
GLY A 248
VAL A 305
 None
C5P  A 401 (-3.8A)
None
None
None
 1.03A 4nkxD-4xsvA:
undetectable		 4nkxD-4xsvA:
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.
4RUJ_A_VDXA501_1
(VITAMIN D3 RECEPTOR
A)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		5 / 12 TYR A 376
VAL A 361
SER A 359
ILE A 276
VAL A 369
 None
C5P  A   1 (-4.8A)
C5P  A   1 (-2.6A)
C5P  A   1 (-4.0A)
None
 1.49A 4rujA-2zwiA:
undetectable		 4rujA-2zwiA:
20.97
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.
4XEY_B_1N1B601_2
(TYROSINE-PROTEIN
KINASE ABL1)		 4xsv ETHANOLAMINE-PHOSPHA
TE
CYTIDYLYLTRANSFERASE
(Homo
sapiens) 		3 / 3 MET A  33
ASP A 223
PHE A 222
 None
None
C5P  A 401 (-3.9A)
 1.06A 4xeyB-4xsvA:
undetectable		 4xeyB-4xsvA:
23.24
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.
5A1I_A_ADNA407_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 8 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.71A 5a1iA-2z4tA:
undetectable		 5a1iA-2z4tA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A1I_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 7 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.71A 5a1iA-2z4tA:
undetectable		 5a1iA-2z4tA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1A_B_CHDB303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.45A 5b1aA-2wnbA:
0.0
5b1aB-2wnbA:
0.0
5b1aT-2wnbA:
0.0		 5b1aA-2wnbA:
17.88
5b1aB-2wnbA:
18.98
5b1aT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTG_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 2h92 CYTIDYLATE KINASE
(Staphylococcus
aureus) 		4 / 6 ALA A  36
GLY A  15
THR A 208
ARG A  87
 None
SO4  A1400 (-3.6A)
None
C5P  A1300 ( 4.8A)
 0.91A 5btgA-2h92A:
undetectable
5btgB-2h92A:
undetectable
5btgC-2h92A:
undetectable		 5btgA-2h92A:
20.33
5btgB-2h92A:
24.26
5btgC-2h92A:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FHZ_B_REAB602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 4c8g 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Burkholderia
cenocepacia) 		5 / 9 ILE A 118
GLY A  23
LEU A  42
ASN A 130
LEU A 107
 None
None
None
None
C5P  A1163 (-4.1A)
 1.37A 5fhzB-4c8gA:
undetectable		 5fhzB-4c8gA:
17.51
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.
5FPD_B_PZAB1385_0
(HEAT SHOCK-RELATED
70KDA PROTEIN 2)		 2h92 CYTIDYLATE KINASE
(Staphylococcus
aureus) 		4 / 7 VAL A  95
SER A  96
ALA A  99
ARG A  39
 C5P  A1300 (-4.3A)
C5P  A1300 (-3.6A)
C5P  A1300 ( 3.7A)
C5P  A1300 (-4.0A)
 0.92A 5fpdB-2h92A:
undetectable		 5fpdB-2h92A:
21.00
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.
5I8F_A_ML1A210_1
(PHENOLIC OXIDATIVE
COUPLING PROTEIN)		 2wnb -
(Sus
scrofa) 		5 / 12 LEU A 331
LEU A 263
VAL A 258
TYR A 250
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.42A 5i8fA-2wnbA:
undetectable		 5i8fA-2wnbA:
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.
5IY5_G_CHDG102_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.48A 5iy5G-2wnbA:
0.0
5iy5N-2wnbA:
0.0
5iy5O-2wnbA:
0.0		 5iy5G-2wnbA:
14.78
5iy5N-2wnbA:
17.88
5iy5O-2wnbA:
18.98
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.
5M24_A_9CRA501_1
(RETINOIC ACID
RECEPTOR GAMMA)		 2pmp 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Arabidopsis
thaliana) 		5 / 12 ALA A  83
LEU A  52
ILE A  60
GLY A   7
LEU A  97
 None
None
C5P  A 700 (-4.9A)
None
None
 1.06A 5m24A-2pmpA:
undetectable		 5m24A-2pmpA:
23.35
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.
5N0O_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2wnb -
(Sus
scrofa) 		5 / 12 ILE A 278
VAL A 147
SER A 276
PHE A 292
VAL A 327
 None
None
None
C5P  A1344 (-4.6A)
None
 1.16A 5n0oA-2wnbA:
undetectable		 5n0oA-2wnbA:
22.25
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.
5N0S_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2wnb -
(Sus
scrofa) 		5 / 12 ILE A 278
VAL A 147
SER A 276
PHE A 292
VAL A 327
 None
None
None
C5P  A1344 (-4.6A)
None
 1.18A 5n0sB-2wnbA:
undetectable		 5n0sB-2wnbA:
22.28
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.
5VLM_C_CVIC301_0
(REGULATORY PROTEIN
TETR)		 4ber PHOSPHOCHOLINE
TRANSFERASE ANKX
(Legionella
pneumophila) 		5 / 12 GLU A 260
TYR A 201
VAL A 276
ASP A  28
PHE A 258
 None
None
None
C5P  A1000 (-2.2A)
GOL  A3000 ( 4.3A)
 1.49A 5vlmC-4berA:
1.0		 5vlmC-4berA:
15.10
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.
5W97_B_CHDB303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.49A 5w97A-2wnbA:
0.0
5w97B-2wnbA:
0.0
5w97g-2wnbA:
0.0		 5w97A-2wnbA:
17.88
5w97B-2wnbA:
18.98
5w97g-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X1F_G_CHDG104_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.48A 5x1fG-2wnbA:
0.0
5x1fN-2wnbA:
0.0
5x1fO-2wnbA:
0.0		 5x1fG-2wnbA:
14.73
5x1fN-2wnbA:
17.88
5x1fO-2wnbA:
18.98
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.
5XDQ_B_CHDB304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.49A 5xdqA-2wnbA:
0.0
5xdqB-2wnbA:
0.0
5xdqT-2wnbA:
0.0		 5xdqA-2wnbA:
17.88
5xdqB-2wnbA:
18.98
5xdqT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDQ_G_CHDG102_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.48A 5xdqG-2wnbA:
0.0
5xdqN-2wnbA:
0.0
5xdqO-2wnbA:
0.0		 5xdqG-2wnbA:
14.73
5xdqN-2wnbA:
17.88
5xdqO-2wnbA:
18.98
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.
5XDX_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.49A 5xdxA-2wnbA:
0.0
5xdxB-2wnbA:
0.0
5xdxT-2wnbA:
0.0		 5xdxA-2wnbA:
17.88
5xdxB-2wnbA:
18.98
5xdxT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_O_CHDO301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.46A 5xdxG-2wnbA:
0.0
5xdxN-2wnbA:
0.0
5xdxO-2wnbA:
0.0		 5xdxG-2wnbA:
14.73
5xdxN-2wnbA:
17.88
5xdxO-2wnbA:
18.98
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.
5Y2T_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		5 / 12 LEU A 344
GLY A 316
LEU A 292
ILE A 276
MET A 332
 None
C5P  A   1 (-4.3A)
None
C5P  A   1 (-4.0A)
None
 1.20A 5y2tA-2zwiA:
undetectable		 5y2tA-2zwiA:
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.
5YCN_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		5 / 12 LEU A 344
ILE A 335
GLY A 316
LEU A 292
ILE A 276
 None
None
C5P  A   1 (-4.3A)
None
C5P  A   1 (-4.0A)
 1.00A 5ycnA-2zwiA:
undetectable		 5ycnA-2zwiA:
23.26
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.
5ZCO_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.49A 5zcoA-2wnbA:
0.0
5zcoB-2wnbA:
0.0
5zcoT-2wnbA:
0.0		 5zcoA-2wnbA:
17.88
5zcoB-2wnbA:
18.98
5zcoT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_G_CHDG102_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 10 ARG A 171
PHE A 192
GLY A 273
GLY A 291
THR A 328
 None
None
C5P  A1344 (-3.2A)
None
None
 1.49A 5zcoG-2wnbA:
0.0
5zcoN-2wnbA:
0.0
5zcoO-2wnbA:
0.0		 5zcoG-2wnbA:
14.73
5zcoN-2wnbA:
17.88
5zcoO-2wnbA:
18.98
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.
5ZCP_B_CHDB301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2wnb -
(Sus
scrofa) 		5 / 11 GLY A 291
THR A 328
ARG A 171
PHE A 192
GLY A 273
 None
None
None
None
C5P  A1344 (-3.2A)
 1.50A 5zcpA-2wnbA:
0.0
5zcpB-2wnbA:
0.0
5zcpT-2wnbA:
0.0		 5zcpA-2wnbA:
17.88
5zcpB-2wnbA:
18.98
5zcpT-2wnbA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6D6U_D_FYPD410_0
(GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1
GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
GAMMA-2,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT GAMMA-2)		 2zwi ALPHA-/BETA-GALACTOS
IDE
ALPHA-2,3-SIALYLTRAN
SFERASE
(Photobacterium
phosphoreum) 		5 / 9 SER A 359
SER A 360
ASP A 148
ALA A  48
THR A  49
 C5P  A   1 (-2.6A)
C5P  A   1 ( 2.6A)
GOL  A   5 (-3.5A)
None
C5P  A   1 (-4.1A)
 1.18A 6d6uD-2zwiA:
0.0
6d6uE-2zwiA:
0.0		 6d6uD-2zwiA:
20.43
6d6uE-2zwiA:
21.80
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.
6FBO_A_ADNA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 8 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.72A 6fboA-2z4tA:
undetectable		 6fboA-2z4tA:
7.78
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.
6FCB_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 8 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.80A 6fcbA-2z4tA:
undetectable		 6fcbA-2z4tA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FCD_A_ADNA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 8 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.71A 6fcdA-2z4tA:
undetectable		 6fcdA-2z4tA:
7.78
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.
6G6R_A_SAMA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2z4t BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE
(Photobacterium
sp.
JT-ISH-224) 		4 / 7 HIS A 123
ASP A 122
SER A 430
ASP A 232
 LBT  A2000 ( 4.0A)
MG  A5001 (-4.4A)
C5P  A1427 (-2.7A)
LBT  A2000 ( 2.9A)
 0.72A 6g6rA-2z4tA:
undetectable		 6g6rA-2z4tA:
20.42