SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1vra'

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.
1CMC_A_SAMA105_0
(MET REPRESSOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 10 ALA B 279
GLY B 282
GLU B 290
LEU B 288
PRO B 377
None
1.38A 1cmcA-1vraB:
undetectable
1cmcB-1vraB:
undetectable
1cmcA-1vraB:
20.00
1cmcB-1vraB:
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.
1MJ2_A_SAMA2200_0
(PROTEIN (METHIONINE
REPRESSOR))
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 ALA B 279
GLY B 282
GLU B 290
LEU B 288
PRO B 377
None
1.29A 1mj2A-1vraB:
undetectable
1mj2B-1vraB:
undetectable
1mj2A-1vraB:
20.00
1mj2B-1vraB:
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.
1MJ2_C_SAMC2199_0
(PROTEIN (METHIONINE
REPRESSOR))
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 ALA B 279
GLY B 282
GLU B 290
LEU B 288
PRO B 377
None
1.28A 1mj2C-1vraB:
undetectable
1mj2D-1vraB:
undetectable
1mj2C-1vraB:
20.00
1mj2D-1vraB:
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.
1MJO_C_SAMC200_0
(METHIONINE REPRESSOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 ALA B 279
GLY B 282
GLU B 290
LEU B 288
PRO B 377
None
1.25A 1mjoC-1vraB:
undetectable
1mjoD-1vraB:
undetectable
1mjoC-1vraB:
20.00
1mjoD-1vraB:
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.
1MJQ_A_SAMA200_0
(METHIONINE REPRESSOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 11 GLU B 290
LEU B 288
PRO B 377
ALA B 279
GLY B 282
None
1.27A 1mjqA-1vraB:
undetectable
1mjqB-1vraB:
undetectable
1mjqA-1vraB:
20.00
1mjqB-1vraB:
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.
1MJQ_C_SAMC199_0
(METHIONINE REPRESSOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 10 GLU B 290
LEU B 288
PRO B 377
ALA B 279
GLY B 282
None
1.23A 1mjqC-1vraB:
undetectable
1mjqD-1vraB:
undetectable
1mjqC-1vraB:
20.00
1mjqD-1vraB:
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.
1MJQ_G_SAMG199_0
(METHIONINE REPRESSOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 10 GLU B 290
LEU B 288
PRO B 377
ALA B 279
GLY B 282
None
1.26A 1mjqG-1vraB:
undetectable
1mjqH-1vraB:
undetectable
1mjqG-1vraB:
20.00
1mjqH-1vraB:
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.
1MJQ_I_SAMI199_0
(METHIONINE REPRESSOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 11 GLU B 290
LEU B 288
PRO B 377
ALA B 279
GLY B 282
None
1.25A 1mjqI-1vraB:
undetectable
1mjqJ-1vraB:
undetectable
1mjqI-1vraB:
20.00
1mjqJ-1vraB:
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.
2AVD_B_SAMB601_0
(CATECHOL-O-METHYLTRA
NSFERASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 GLY B 391
VAL B 382
ALA B 306
ASP B 299
ALA B 302
None
1.26A 2avdB-1vraB:
undetectable
2avdB-1vraB:
21.95
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.
2HZQ_A_STRA300_1
(APOLIPOPROTEIN D)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
4 / 7 THR A  68
ALA A  88
ASN B 237
LEU A 130
None
1.04A 2hzqA-1vraA:
undetectable
2hzqA-1vraA:
22.22
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.
2JN3_A_JN3A130_1
(FATTY ACID-BINDING
PROTEIN, LIVER)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 ALA B 368
ILE B 352
THR B 354
ASP B 323
ILE B 289
None
1.16A 2jn3A-1vraB:
undetectable
2jn3A-1vraB:
26.60
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.
2VH3_A_DAHA2_1
(RANASMURFIN)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 9 ALA B 206
PHE A  24
GLY A  23
SER A  50
ALA A  49
None
None
None
EDO  B  17 (-3.3A)
None
1.14A 2vh3A-1vraB:
undetectable
2vh3A-1vraB:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 11 ALA A  88
ALA A  62
GLY A  93
GLY A 127
ILE A 126
None
None
None
None
EDO  A 207 (-4.0A)
1.07A 2x1lA-1vraA:
undetectable
2x1lA-1vraA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 11 ALA A  88
ALA A  62
GLY A  93
GLY A 127
ILE A 126
None
None
None
None
EDO  A 207 (-4.0A)
1.10A 2x1lC-1vraA:
undetectable
2x1lC-1vraA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D1X_A_ROCA201_1
(HIV-1 PROTEASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
6 / 12 ALA B 324
ASP B 323
GLY B 327
ILE B 330
THR B 361
VAL B 353
None
None
None
None
None
EDO  B  11 ( 4.6A)
1.46A 3d1xA-1vraB:
undetectable
3d1xA-1vraB:
17.97
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.
3D1Y_A_ROCA201_1
(HIV-1 PROTEASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
6 / 12 ALA B 324
ASP B 323
GLY B 327
ILE B 330
THR B 361
VAL B 353
None
None
None
None
None
EDO  B  11 ( 4.6A)
1.48A 3d1yA-1vraB:
undetectable
3d1yA-1vraB:
19.07
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.
3EL4_A_ROCA100_1
(PROTEASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
6 / 12 GLY A 150
ALA A 151
ILE A 158
GLY A  41
THR B 203
VAL A  18
EDO  A 204 ( 3.8A)
None
None
None
None
None
1.14A 3el4A-1vraA:
undetectable
3el4A-1vraA:
18.36
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.
3JUS_A_ECLA600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
4 / 8 LEU B 355
THR B 354
GLY B 350
ILE B 309
None
0.81A 3jusA-1vraB:
undetectable
3jusA-1vraB:
18.48
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.
3JUS_A_ECNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
4 / 8 LEU B 355
THR B 354
GLY B 350
ILE B 309
None
0.81A 3jusA-1vraB:
undetectable
3jusA-1vraB:
18.48
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.
3JUS_B_ECLB600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
4 / 8 LEU B 355
THR B 354
GLY B 350
ILE B 309
None
0.65A 3jusB-1vraB:
undetectable
3jusB-1vraB:
18.48
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.
3KO0_R_TFPR201_1
(PROTEIN S100-A4)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 10 GLY B 246
CYH A 169
PHE A 154
PHE A  24
GLY A  23
EDO  B  17 (-3.8A)
None
None
None
None
1.20A 3ko0R-1vraB:
undetectable
3ko0T-1vraB:
undetectable
3ko0R-1vraB:
20.48
3ko0T-1vraB:
20.48
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.
3KO0_R_TFPR201_1
(PROTEIN S100-A4)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 10 GLY B 246
CYH A 169
PHE B 201
PHE A  24
GLY A  23
EDO  B  17 (-3.8A)
None
None
None
None
1.49A 3ko0R-1vraB:
undetectable
3ko0T-1vraB:
undetectable
3ko0R-1vraB:
20.48
3ko0T-1vraB:
20.48
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.
3MB5_A_SAMA301_0
(SAM-DEPENDENT
METHYLTRANSFERASE)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 ILE A  43
VAL A  44
GLY A  41
ALA A  26
ILE A 135
None
EDO  A 205 ( 4.7A)
None
None
None
1.02A 3mb5A-1vraA:
undetectable
3mb5A-1vraA:
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.
3R75_A_BEZA701_0
(ANTHRANILATE/PARA-AM
INOBENZOATE
SYNTHASES COMPONENT
I)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ
ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans;
Bacillus
halodurans)
5 / 12 GLU B 283
GLY A 124
THR A 123
SER B 235
LYS B 197
EDO  B  10 (-2.6A)
SO4  A 197 ( 3.3A)
SO4  A 197 (-3.9A)
None
SO4  A 197 (-3.8A)
1.33A 3r75A-1vraB:
undetectable
3r75A-1vraB:
16.33
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.
3R75_B_BEZB701_0
(ANTHRANILATE/PARA-AM
INOBENZOATE
SYNTHASES COMPONENT
I)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ
ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans;
Bacillus
halodurans)
5 / 12 GLU B 283
GLY A 124
THR A 123
SER B 235
LYS B 197
EDO  B  10 (-2.6A)
SO4  A 197 ( 3.3A)
SO4  A 197 (-3.9A)
None
SO4  A 197 (-3.8A)
1.32A 3r75B-1vraB:
undetectable
3r75B-1vraB:
16.33
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.
3RFM_A_CFFA330_1
(ADENOSINE RECEPTOR
A2A)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 7 VAL A  33
LEU A 130
ASN A  89
MET A 103
ILE A 135
None
1.44A 3rfmA-1vraA:
0.0
3rfmA-1vraA:
21.52
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.
3W9T_C_W9TC1005_1
(HEMOLYTIC LECTIN
CEL-III)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
3 / 3 ASP B 397
GLY B 284
TYR B 320
None
EDO  B   7 (-4.2A)
EDO  B   7 (-4.4A)
0.66A 3w9tC-1vraB:
undetectable
3w9tC-1vraB:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_G_W9TG503_1
(HEMOLYTIC LECTIN
CEL-III)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
3 / 3 ASP B 397
GLY B 284
TYR B 320
None
EDO  B   7 (-4.2A)
EDO  B   7 (-4.4A)
0.66A 3w9tG-1vraB:
undetectable
3w9tG-1vraB:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E1G_A_LNLA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 PHE A 111
ILE A  29
GLY A 150
ALA A 151
GLY A  41
None
EDO  A 210 (-3.8A)
EDO  A 204 ( 3.8A)
None
None
1.05A 4e1gA-1vraA:
undetectable
4e1gA-1vraA:
15.28
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.
4E1G_B_LNLB701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 PHE A 111
ILE A  29
GLY A 150
ALA A 151
GLY A  41
None
EDO  A 210 (-3.8A)
EDO  A 204 ( 3.8A)
None
None
1.05A 4e1gB-1vraA:
undetectable
4e1gB-1vraA:
15.28
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.
4MM8_A_RFXA603_1
(TRANSPORTER)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 12 VAL A  18
GLY A  41
PHE A 154
SER A  25
GLY A 150
None
None
None
None
EDO  A 204 ( 3.8A)
1.18A 4mm8A-1vraA:
undetectable
4mm8A-1vraA:
17.55
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.
4Y0Q_A_PX9A201_1
(BETA-LACTOGLOBULIN)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ
ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans;
Bacillus
halodurans)
3 / 3 LYS A 186
ILE B 278
ILE B 228
SO4  A 197 (-2.7A)
None
None
0.50A 4y0qA-1vraA:
undetectable
4y0qA-1vraA:
19.05
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.
5KQX_A_ROCA101_1
(PROTEASE E35D-SQV)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
6 / 12 ALA B 324
ASP B 323
GLY B 327
ILE B 330
THR B 361
VAL B 353
None
None
None
None
None
EDO  B  11 ( 4.6A)
1.44A 5kqxA-1vraB:
undetectable
5kqxA-1vraB:
18.89
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.
5MVS_A_ADNA401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
4 / 7 GLY A  41
ALA A  80
PHE A 154
ASN A  84
None
0.98A 5mvsA-1vraA:
undetectable
5mvsA-1vraA:
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.
5MVS_B_ADNB401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
4 / 8 GLY A  41
ALA A  80
PHE A 154
ASN A  84
None
0.97A 5mvsB-1vraA:
undetectable
5mvsB-1vraA:
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.
5QGK_A_ACTA301_0
(PEROXISOMAL COENZYME
A DIPHOSPHATASE
NUDT7)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
3 / 3 VAL A  10
TYR A 170
GLN A 171
None
0.59A 5qgkA-1vraA:
undetectable
5qgkA-1vraA:
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.
5QGR_A_ACTA301_0
(PEROXISOMAL COENZYME
A DIPHOSPHATASE
NUDT7)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
3 / 3 VAL A  10
TYR A 170
GLN A 171
None
0.58A 5qgrA-1vraA:
undetectable
5qgrA-1vraA:
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.
5QGT_A_ACTA301_0
(PEROXISOMAL COENZYME
A DIPHOSPHATASE
NUDT7)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
3 / 3 VAL A  10
TYR A 170
GLN A 171
None
0.62A 5qgtA-1vraA:
undetectable
5qgtA-1vraA:
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.
6HLO_A_GBQA1501_1
(SUBSTANCE-P
RECEPTOR,GLGA
GLYCOGEN
SYNTHASE,SUBSTANCE-P
RECEPTOR)
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans)
5 / 9 ILE B 333
ILE B 329
GLU B 339
VAL B 305
ILE B 309
None
1.28A 6hloA-1vraB:
undetectable
6hloA-1vraB:
18.85