SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'VO4'


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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AQU_A_ESTA304_1
(ESTROGEN
SULFOTRANSFERASE)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		10 / 11 ARG A  23
TYR A  81
CYH A  84
ASN A  86
LYS A 106
HIS A 108
PHE A 142
SER A 148
TYR A 149
MET A 247
 None
VO4  A 302 ( 4.9A)
None
None
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
None
None
 0.49A 1aquA-1bo6A:
45.2
1aquB-1bo6A:
44.5		 1aquA-1bo6A:
100.00
1aquB-1bo6A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AQU_B_ESTB303_1
(ESTROGEN
SULFOTRANSFERASE)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		10 / 10 ASP A  21
ARG A  23
TYR A  81
CYH A  84
ASN A  86
LYS A 106
HIS A 108
PHE A 142
TYR A 149
MET A 247
 None
None
VO4  A 302 ( 4.9A)
None
None
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
None
 0.49A 1aquB-1bo6A:
44.5		 1aquB-1bo6A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FMJ_A_RTLA401_0
(RETINOL DEHYDRATASE)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		5 / 11 TYR A  81
LEU A  89
LYS A 106
HIS A 108
PHE A 255
 VO4  A 302 ( 4.9A)
None
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
A3P  A 301 ( 4.6A)
 1.06A 1fmjA-1bo6A:
33.7		 1fmjA-1bo6A:
30.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HO5_A_ADNA1604_1
(5'-NUCLEOTIDASE)		 1qi9 PROTEIN (VANADIUM
BROMOPEROXIDASE)
(Ascophyllum
nodosum) 		5 / 11 ASN A 475
SER A 416
GLY A 491
PHE A 478
GLY A 494
 None
VO4  A 600 (-2.8A)
None
None
None
 1.37A 1ho5A-1qi9A:
undetectable		 1ho5A-1qi9A:
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.
1JZS_A_MRCA1301_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1rpt PROSTATIC ACID
PHOSPHATASE
(Rattus
norvegicus) 		5 / 11 GLY A  16
PRO A  17
HIS A 257
GLN A  37
LEU A  81
 None
None
VO4  A 343 (-3.8A)
None
None
 1.21A 1jzsA-1rptA:
undetectable		 1jzsA-1rptA:
18.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1K4T_D_TTCD990_1
(DNA TOPOISOMERASE I)		 2b9s DNA TOPOISOMERASE
I-LIKE PROTEIN
TOPOISOMERASE I-LIKE
PROTEIN
(Leishmania
donovani) 		4 / 5 GLU A 182
LYS A 352
ASP A 353
THR B 217
 None
VO4  B 301 ( 3.9A)
None
None
 1.24A 1k4tA-2b9sA:
32.6		 1k4tA-2b9sA:
48.42
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.
1KXH_A_ACRA598_1
(ALPHA-AMYLASE)		 3w36 NAPH1
(Streptomyces
sp.
CNQ525) 		5 / 12 ALA A 318
VAL A 493
GLY A 491
ASP A 419
HIS A 420
 None
None
None
None
VO4  A 600 (-4.5A)
 1.08A 1kxhA-3w36A:
undetectable		 1kxhA-3w36A:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NT2_A_SAMA301_0
(FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN)		 1idu VANADIUM
CHLOROPEROXIDASE
(Curvularia
inaequalis) 		5 / 12 GLY A 409
ALA A 405
SER A 402
ALA A 560
ILE A 557
 None
None
VO4  A1579 (-2.9A)
None
None
 1.21A 1nt2A-1iduA:
undetectable		 1nt2A-1iduA:
14.26
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.
1OE1_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		3 / 3 ASP A 389
HIS A 350
HIS A 106
 None
VO4  A 801 (-3.8A)
VO4  A 801 (-3.8A)
 0.66A 1oe1A-2d1gA:
undetectable		 1oe1A-2d1gA:
21.20
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.
1OE3_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		3 / 3 ASP A 389
HIS A 350
HIS A 106
 None
VO4  A 801 (-3.8A)
VO4  A 801 (-3.8A)
 0.68A 1oe3A-2d1gA:
undetectable		 1oe3A-2d1gA:
21.20
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.
1Q8J_B_C2FB802_0
(5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		5 / 12 GLU A 111
GLY A 128
ASP A 207
SER A 388
ASN A  44
 None
None
None
None
VO4  A 801 ( 2.1A)
 0.90A 1q8jB-2d1gA:
undetectable		 1q8jB-2d1gA:
21.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RR8_A_TTCA100_1
(DNA TOPOISOMERASE I)		 2b9s DNA TOPOISOMERASE
I-LIKE PROTEIN
TOPOISOMERASE I-LIKE
PROTEIN
(Leishmania
donovani) 		4 / 5 GLU A 182
LYS A 352
ASP A 353
THR B 217
 None
VO4  B 301 ( 3.9A)
None
None
 1.24A 1rr8C-2b9sA:
36.4		 1rr8C-2b9sA:
50.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RRJ_B_TTCB990_1
(DNA TOPOISOMERASE I)		 2b9s DNA TOPOISOMERASE
I-LIKE PROTEIN
TOPOISOMERASE I-LIKE
PROTEIN
(Leishmania
donovani) 		4 / 5 GLU A 182
LYS A 352
ASP A 353
THR B 217
 None
VO4  B 301 ( 3.9A)
None
None
 1.27A 1rrjA-2b9sA:
32.6		 1rrjA-2b9sA:
50.78
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.
1U1J_A_C2FA773_0
(5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE)		 3omx CG14216
(Drosophila
melanogaster) 		4 / 8 ARG A  42
ASN A  16
SER A  15
VAL A  43
 None
None
VO4  A 300 (-4.0A)
None
 1.28A 1u1jA-3omxA:
undetectable		 1u1jA-3omxA:
13.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D06_A_ESTA304_1
(SULFOTRANSFERASE 1A1)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		6 / 10 PHE A  24
PRO A  47
LYS A  48
LYS A 106
HIS A 108
MET A 248
 None
VO4  A 302 (-4.2A)
A3P  A 301 ( 2.9A)
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
None
 0.67A 2d06A-1bo6A:
40.5		 2d06A-1bo6A:
49.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D06_A_ESTA304_1
(SULFOTRANSFERASE 1A1)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		6 / 10 PHE A  24
PRO A  47
LYS A 106
HIS A 108
PHE A 142
MET A 248
 None
VO4  A 302 (-4.2A)
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
 0.88A 2d06A-1bo6A:
40.5		 2d06A-1bo6A:
49.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D06_B_ESTB305_1
(SULFOTRANSFERASE 1A1)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		6 / 10 PHE A  24
PRO A  47
HIS A 108
PHE A 142
TYR A 240
MET A 248
 None
VO4  A 302 (-4.2A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
None
 0.87A 2d06B-1bo6A:
40.4		 2d06B-1bo6A:
49.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D06_B_ESTB305_1
(SULFOTRANSFERASE 1A1)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		6 / 10 PRO A  47
LYS A 106
HIS A 108
PHE A 142
TYR A 240
MET A 248
 VO4  A 302 (-4.2A)
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
None
 0.81A 2d06B-1bo6A:
40.4		 2d06B-1bo6A:
49.50
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.
2OXT_C_SAMC300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		4 / 4 SER A 192
GLY A 195
HIS A 287
ASP A 387
 None
None
VO4  A 801 (-3.6A)
UNX  A 601 ( 2.6A)
 1.22A 2oxtC-2d1gA:
undetectable		 2oxtC-2d1gA:
17.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XXG_A_CUA1338_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		3 / 3 ASP A 389
HIS A 350
HIS A 106
 None
VO4  A 801 (-3.8A)
VO4  A 801 (-3.8A)
 0.68A 2xxgA-2d1gA:
undetectable		 2xxgA-2d1gA:
21.40
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.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		3 / 3 ASP A 389
HIS A 350
HIS A 106
 None
VO4  A 801 (-3.8A)
VO4  A 801 (-3.8A)
 0.66A 2xxgC-2d1gA:
undetectable		 2xxgC-2d1gA:
21.40
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.
3H52_C_486C4_2
(GLUCOCORTICOID
RECEPTOR)		 3omx CG14216
(Drosophila
melanogaster) 		3 / 3 MET A  85
CYH A  13
PRO A  96
 None
VO4  A 300 (-2.3A)
None
 1.28A 3h52C-3omxA:
undetectable		 3h52C-3omxA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K9W_A_ACTA170_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 1j9l STATIONARY PHASE
SURVIVAL PROTEIN
(Thermotoga
maritima) 		3 / 3 SER A 107
GLY A 108
THR A 109
 VO4  A 401 (-2.6A)
VO4  A 401 (-3.9A)
VO4  A 401 (-3.4A)
 0.09A 3k9wA-1j9lA:
3.2		 3k9wA-1j9lA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_K_TFPK201_1
(PROTEIN S100-A4)		 1qi9 PROTEIN (VANADIUM
BROMOPEROXIDASE)
(Ascophyllum
nodosum) 		4 / 8 GLY A 417
ILE A 492
PHE A 195
PHE A 207
 VO4  A 600 (-3.8A)
None
None
None
 0.91A 3ko0K-1qi9A:
0.0
3ko0S-1qi9A:
0.0		 3ko0K-1qi9A:
11.13
3ko0S-1qi9A:
11.13
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 1j9l STATIONARY PHASE
SURVIVAL PROTEIN
(Thermotoga
maritima) 		5 / 10 LEU A  19
ILE A 126
ALA A 125
THR A 109
VAL A  31
 None
None
None
VO4  A 401 (-3.4A)
None
 1.43A 3r9cA-1j9lA:
undetectable		 3r9cA-1j9lA:
17.77
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.
3T7S_C_SAMC300_0
(PUTATIVE
METHYLTRANSFERASE)		 5aa6 VANADIUM-DEPENDENT
BROMOPEROXIDASE 2
(Ascophyllum
nodosum) 		5 / 12 GLY A 548
SER A 449
ALA A 457
TYR A 458
ASN A 454
 None
VO4  A 800 (-2.7A)
None
None
None
 1.34A 3t7sC-5aa6A:
undetectable		 3t7sC-5aa6A:
18.18
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.
4APJ_A_ACTA1635_0
(ANGIOTENSIN-CONVERTI
NG ENZYME
BRADYKININ-POTENTIAT
ING PEPTIDE B)		 3q8y NUCLEOSIDE
DIPHOSPHATE KINASE
(Staphylococcus
aureus) 		4 / 6 HIS A 115
GLU A 126
ASP A 118
SER A 122
 VO4  A 159 (-2.7A)
None
ADP  A 158 (-4.1A)
None
 1.19A 4apjA-3q8yA:
undetectable
4apjP-3q8yA:
undetectable		 4apjA-3q8yA:
15.17
4apjP-3q8yA:
9.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JVL_A_ESTA702_1
(ESTROGEN
SULFOTRANSFERASE)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		5 / 9 CYH A  84
LYS A 106
HIS A 108
PHE A 142
MET A 248
 None
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
 0.62A 4jvlA-1bo6A:
44.6		 4jvlA-1bo6A:
77.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JVL_A_ESTA702_1
(ESTROGEN
SULFOTRANSFERASE)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		4 / 9 LYS A 106
PHE A 255
ILE A 146
MET A 248
 VO4  A 302 (-3.0A)
A3P  A 301 ( 4.6A)
None
None
 1.06A 4jvlA-1bo6A:
44.6		 4jvlA-1bo6A:
77.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JVL_B_ESTB302_1
(ESTROGEN
SULFOTRANSFERASE)		 1bo6 ESTROGEN
SULFOTRANSFERASE
(Mus
musculus) 		5 / 9 CYH A  84
LYS A 106
HIS A 108
PHE A 142
MET A 248
 None
VO4  A 302 (-3.0A)
VO4  A 302 (-3.9A)
VO4  A 302 ( 4.6A)
None
 0.67A 4jvlB-1bo6A:
44.3		 4jvlB-1bo6A:
77.29
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.
4K0B_B_SAMB504_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		5 / 8 HIS A 106
PRO A 174
ASP A 387
SER A 175
ASP A 208
 VO4  A 801 (-3.8A)
VO4  A 801 (-4.1A)
UNX  A 601 ( 2.6A)
UNX  A 601 ( 1.8A)
VO4  A 801 (-2.6A)
 1.47A 4k0bB-2d1gA:
undetectable		 4k0bB-2d1gA:
22.11
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.
4K7G_B_ACTB902_0
(3-HYDROXYPROLINE
DEHYDRATSE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		4 / 7 ASP A 389
ASP A 387
SER A 175
HIS A 350
 None
UNX  A 601 ( 2.6A)
UNX  A 601 ( 1.8A)
VO4  A 801 (-3.8A)
 1.17A 4k7gB-2d1gA:
undetectable		 4k7gB-2d1gA:
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.
4KTV_C_ADNC403_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		5 / 11 HIS A 106
PRO A 174
ASP A 387
ASP A 208
ILE A 285
 VO4  A 801 (-3.8A)
VO4  A 801 (-4.1A)
UNX  A 601 ( 2.6A)
VO4  A 801 (-2.6A)
None
 1.38A 4ktvC-2d1gA:
undetectable
4ktvD-2d1gA:
undetectable		 4ktvC-2d1gA:
21.97
4ktvD-2d1gA:
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.
4L7I_B_SAMB501_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		5 / 8 HIS A 106
PRO A 174
ASP A 387
SER A 175
ASP A 208
 VO4  A 801 (-3.8A)
VO4  A 801 (-4.1A)
UNX  A 601 ( 2.6A)
UNX  A 601 ( 1.8A)
VO4  A 801 (-2.6A)
 1.44A 4l7iB-2d1gA:
undetectable		 4l7iB-2d1gA:
22.11
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.
4R82_A_ACTA207_0
(OXIDOREDUCTASE)		 3w36 NAPH1
(Streptomyces
sp.
CNQ525) 		4 / 4 GLU A 322
GLY A 418
HIS A 494
ARG A 488
 None
VO4  A 600 ( 4.8A)
VO4  A 600 (-3.4A)
VO4  A 600 (-4.0A)
 1.19A 4r82A-3w36A:
undetectable
4r82B-3w36A:
undetectable		 4r82A-3w36A:
16.98
4r82B-3w36A:
16.98
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.
4RZV_B_032B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4cit VANADIUM-DEPENDENT
HALOPEROXIDASE
(Zobellia
galactanivorans) 		4 / 5 PHE A 375
SER A 361
HIS A 360
ASP A 383
 None
None
VO4  A1451 ( 3.9A)
None
 1.27A 4rzvB-4citA:
undetectable		 4rzvB-4citA:
19.79
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.
5DZK_P_BEZP801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 3q8y NUCLEOSIDE
DIPHOSPHATE KINASE
(Staphylococcus
aureus) 		4 / 5 SER A 117
ALA A 123
HIS A 115
LEU A   6
 None
None
VO4  A 159 (-2.7A)
None
 1.45A 5dzkb-3q8yA:
undetectable
5dzkp-3q8yA:
undetectable		 5dzkb-3q8yA:
21.17
5dzkp-3q8yA:
6.25
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.
5DZK_Q_BEZQ801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 3q8y NUCLEOSIDE
DIPHOSPHATE KINASE
(Staphylococcus
aureus) 		4 / 5 SER A 117
ALA A 123
HIS A 115
LEU A   6
 None
None
VO4  A 159 (-2.7A)
None
 1.43A 5dzkc-3q8yA:
undetectable
5dzkq-3q8yA:
undetectable		 5dzkc-3q8yA:
21.17
5dzkq-3q8yA:
6.25
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.
5ENT_C_MIYC901_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB)		 5hmp UNCONVENTIONAL
MYOSIN-VC
(Homo
sapiens) 		5 / 9 SER A 170
GLY A 438
SER A 163
ILE A 436
ALA A 455
 None
VO4  A 802 (-3.5A)
VO4  A 802 (-2.6A)
None
None
 1.43A 5entC-5hmpA:
undetectable		 5entC-5hmpA:
22.94
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.
5J4N_A_AG2A501_1
(ARGININE/AGMATINE
ANTIPORTER)		 1qi9 PROTEIN (VANADIUM
BROMOPEROXIDASE)
(Ascophyllum
nodosum) 		4 / 6 SER A 416
GLY A 423
ASN A 422
ILE A 492
 VO4  A 600 (-2.8A)
None
None
None
 1.11A 5j4nA-1qi9A:
undetectable		 5j4nA-1qi9A:
22.16
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.
5KXI_A_NCTA402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 4knw N-ACYLNEURAMINATE-9-
PHOSPHATASE
(Homo
sapiens) 		4 / 8 THR A  22
CYH A 149
CYH A 147
LEU A  15
 None
None
None
VO4  A 301 (-4.2A)
 1.31A 5kxiA-4knwA:
undetectable
5kxiB-4knwA:
undetectable		 5kxiA-4knwA:
20.78
5kxiB-4knwA:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KXI_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 4knw N-ACYLNEURAMINATE-9-
PHOSPHATASE
(Homo
sapiens) 		4 / 8 THR A  22
CYH A 149
CYH A 147
LEU A  15
 None
None
None
VO4  A 301 (-4.2A)
 1.30A 5kxiD-4knwA:
undetectable
5kxiE-4knwA:
undetectable		 5kxiD-4knwA:
20.78
5kxiE-4knwA:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OCS_A_ACTA402_0
(PUTATIVE
NADH-DEPENTDENT
FLAVIN
OXIDOREDUCTASE)		 3q8y NUCLEOSIDE
DIPHOSPHATE KINASE
(Staphylococcus
aureus) 		4 / 5 ILE A  65
HIS A  48
HIS A 115
TYR A  49
 None
None
VO4  A 159 (-2.7A)
None
 1.12A 5ocsA-3q8yA:
undetectable		 5ocsA-3q8yA:
17.16
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.
5OCS_C_ACTC402_0
(PUTATIVE
NADH-DEPENTDENT
FLAVIN
OXIDOREDUCTASE)		 3q8y NUCLEOSIDE
DIPHOSPHATE KINASE
(Staphylococcus
aureus) 		4 / 5 ILE A  65
HIS A  48
HIS A 115
TYR A  49
 None
None
VO4  A 159 (-2.7A)
None
 1.12A 5ocsC-3q8yA:
undetectable		 5ocsC-3q8yA:
17.16
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.
5V0V_A_8QPA613_1
(SERUM ALBUMIN)		 2v26 MYOSIN VI
(Sus
scrofa) 		4 / 8 ARG A 667
ALA A 155
THR A 161
GLY A 459
 None
ADP  A1789 (-4.2A)
None
VO4  A1791 (-3.3A)
 0.90A 5v0vA-2v26A:
1.8		 5v0vA-2v26A:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5W7B_B_PA1B204_1
(ACYLOXYACYL
HYDROLASE SMALL
SUBUNIT
ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT)		 2v26 MYOSIN VI
(Sus
scrofa) 		3 / 3 GLY A 459
ASN A 477
ARG A 667
 VO4  A1791 (-3.3A)
EDO  A1793 ( 4.6A)
None
 0.58A 5w7bD-2v26A:
undetectable		 5w7bD-2v26A:
7.66
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.
5YOD_H_BEZH201_0
(NS3 PROTEASE)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		4 / 5 HIS A 106
SER A 103
GLY A 351
TYR A 353
 VO4  A 801 (-3.8A)
None
None
None
 1.16A 5yodH-2d1gA:
undetectable		 5yodH-2d1gA:
16.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EW0_F_TA1F502_2
(TUBULIN BETA CHAIN)		 1qi9 PROTEIN (VANADIUM
BROMOPEROXIDASE)
(Ascophyllum
nodosum) 		4 / 5 LEU A 380
LEU A 146
THR A 397
ARG A 349
 None
None
None
VO4  A 600 (-2.7A)
 1.05A 6ew0F-1qi9A:
undetectable		 6ew0F-1qi9A:
9.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EW0_G_TA1G501_2
(TUBULIN BETA CHAIN)		 1qi9 PROTEIN (VANADIUM
BROMOPEROXIDASE)
(Ascophyllum
nodosum) 		4 / 6 LEU A 380
LEU A 146
THR A 397
ARG A 349
 None
None
None
VO4  A 600 (-2.7A)
 1.05A 6ew0G-1qi9A:
undetectable		 6ew0G-1qi9A:
9.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F8C_A_STRA502_1
(CYTOCHROME P450
CYP260A1)		 1qi9 PROTEIN (VANADIUM
BROMOPEROXIDASE)
(Ascophyllum
nodosum) 		4 / 6 ALA A 107
GLY A 417
THR A 420
ILE A 501
 None
VO4  A 600 (-3.8A)
None
None
 0.83A 6f8cA-1qi9A:
0.2		 6f8cA-1qi9A:
12.23
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.
6FBP_B_ADNB404_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2d1g ACID PHOSPHATASE
(Francisella
tularensis) 		5 / 12 ILE A 285
HIS A 106
PRO A 174
ASP A 387
ASP A 208
 None
VO4  A 801 (-3.8A)
VO4  A 801 (-4.1A)
UNX  A 601 ( 2.6A)
VO4  A 801 (-2.6A)
 1.44A 6fbpA-2d1gA:
undetectable
6fbpB-2d1gA:
undetectable		 6fbpA-2d1gA:
10.13
6fbpB-2d1gA:
10.13