SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3aiv'

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.
2BR4_C_SAMC301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 LEU A 311
SER A 339
ASP A 356
ALA A 357
ALA A 359
None
1.06A 2br4C-3aivA:
undetectable
2br4C-3aivA:
17.13
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.
2BXE_A_1FLA2002_1
(SERUM ALBUMIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 10 LEU A 322
LEU A 236
ALA A 239
GLU A 243
VAL A 165
None
0.99A 2bxeA-3aivA:
undetectable
2bxeA-3aivA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2F7F_A_NIOA601_1
(NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE, PUTATIVE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 6 PHE A 187
GLY A 330
THR A 406
ARG A 101
None
1.24A 2f7fA-3aivA:
3.4
2f7fA-3aivA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2GVC_B_MMZB501_1
(MONOOXYGENASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 ASN A 460
TYR A 334
SER A  38
None
HBO  A 900 ( 4.9A)
None
0.89A 2gvcB-3aivA:
undetectable
2gvcB-3aivA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2GVC_E_MMZE501_1
(MONOOXYGENASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 ASN A 460
TYR A 334
SER A  38
None
HBO  A 900 ( 4.9A)
None
0.92A 2gvcE-3aivA:
undetectable
2gvcE-3aivA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2LH6_A_NIOA155_1
(LEGHEMOGLOBIN A
(NICOTINATE MET))
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 5 PHE A  33
PHE A  35
PHE A 496
VAL A 439
None
1.27A 2lh6A-3aivA:
0.9
2lh6A-3aivA:
13.25
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.
2Q72_A_IXXA802_1
(TRANSPORTER)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 6 ILE A 104
ARG A 101
ILE A 257
PHE A 176
None
1.00A 2q72A-3aivA:
undetectable
2q72A-3aivA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V3D_B_NBVB1504_1
(GLUCOSYLCERAMIDASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 11 ASN A 190
GLU A 191
TYR A 334
GLU A 407
TRP A 455
None
HBO  A 900 (-2.5A)
HBO  A 900 ( 4.9A)
HBO  A 900 (-3.9A)
None
0.82A 2v3dB-3aivA:
2.7
2v3dB-3aivA:
21.54
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.
2XCT_G_CPFG1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 ARG A 470
GLY A 472
SER A  81
None
0.60A 2xctB-3aivA:
1.0
2xctB-3aivA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y00_B_Y00B601_2
(BETA-1 ADRENERGIC
RECEPTOR)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 VAL A  99
ASN A 185
TRP A 186
None
0.90A 2y00B-3aivA:
undetectable
2y00B-3aivA:
16.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7H_B_SAMB530_0
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 GLY A 180
LEU A 128
ASN A 185
PRO A 139
PHE A 102
None
1.07A 2y7hB-3aivA:
undetectable
2y7hB-3aivA:
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.
2Y7H_C_SAMC530_0
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 GLY A 180
LEU A 128
ASN A 185
PRO A 139
PHE A 102
None
1.07A 2y7hC-3aivA:
undetectable
2y7hC-3aivA:
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.
2Y7W_A_SALA1300_1
(LYSR-TYPE REGULATORY
PROTEIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 9 ILE A 164
TYR A 168
GLY A 231
PHE A 189
ILE A 234
None
1.26A 2y7wA-3aivA:
undetectable
2y7wA-3aivA:
16.64
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.
3EM0_B_CHDB150_0
(ILEAL BILE
ACID-BINDING PROTEIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 ILE A  23
PHE A  35
VAL A 449
LEU A 391
THR A 388
None
1.28A 3em0B-3aivA:
undetectable
3em0B-3aivA:
13.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IB1_A_IMNA701_1
(LACTOTRANSFERRIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 4 PRO A 207
THR A  57
GLY A 113
THR A 114
None
0.97A 3ib1A-3aivA:
undetectable
3ib1A-3aivA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TOP_A_ACRA1_2
(MALTASE-GLUCOAMYLASE
, INTESTINAL)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 5 ILE A  44
TRP A 463
TRP A 146
THR A 188
None
1.26A 3topA-3aivA:
10.3
3topA-3aivA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A79_A_P1BA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 PRO A 312
TRP A 289
LEU A 224
ILE A 307
TYR A 348
None
1.40A 4a79A-3aivA:
undetectable
4a79A-3aivA:
22.50
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.
4C5N_C_PXLC300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 GLY A  46
ASP A  76
GLY A  75
HIS A  63
None
0.87A 4c5nC-3aivA:
2.8
4c5nC-3aivA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DJE_B_C2FB302_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 ASP A  51
GLY A  46
SER A  81
ASN A  80
ARG A 484
None
1.45A 4djeB-3aivA:
5.6
4djeB-3aivA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K7G_B_ACTB902_0
(3-HYDROXYPROLINE
DEHYDRATSE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASP A  59
PRO A 149
ASP A 147
SER A 105
None
1.27A 4k7gB-3aivA:
undetectable
4k7gB-3aivA:
22.32
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.
4PEV_C_ADNC501_2
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 PRO A 350
VAL A 342
HIS A 341
None
0.61A 4pevC-3aivA:
undetectable
4pevC-3aivA:
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.
4U15_A_0HKA2001_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 ASN A 190
PHE A 453
TYR A 100
None
0.69A 4u15A-3aivA:
undetectable
4u15A-3aivA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V2Y_A_EF2A151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.35A 4v2yA-3aivA:
undetectable
4v2yA-3aivA:
13.13
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.
4V2Y_B_EF2B151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.38A 4v2yB-3aivA:
undetectable
4v2yB-3aivA:
13.13
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.
4V2Z_B_Y70B151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.35A 4v2zB-3aivA:
undetectable
4v2zB-3aivA:
13.13
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.
4V30_A_LVYA151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.36A 4v30A-3aivA:
0.0
4v30A-3aivA:
13.13
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.
4V30_B_LVYB151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.22A 4v30B-3aivA:
undetectable
4v30B-3aivA:
13.13
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.
4XYZ_A_ACTA103_0
(POLYUBIQUITIN-C)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 4 LEU A 387
ILE A 436
HIS A 435
VAL A 439
None
1.13A 4xyzA-3aivA:
undetectable
4xyzA-3aivA:
8.87
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.
5AMI_A_EF2A151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.40A 5amiA-3aivA:
0.0
5amiA-3aivA:
13.13
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.
5AMI_B_EF2B151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.38A 5amiB-3aivA:
undetectable
5amiB-3aivA:
13.13
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.
5AMJ_B_EF2B151_1
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.36A 5amjB-3aivA:
undetectable
5amjB-3aivA:
13.13
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.
5E4D_B_BEZB203_0
(HYDROXYNITRILE LYASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 4 VAL A 263
ALA A 260
ILE A 405
THR A 406
None
1.11A 5e4dB-3aivA:
undetectable
5e4dB-3aivA:
15.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HWK_A_BEZA301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 10 GLY A 203
GLY A 208
LEU A 160
ARG A 209
GLU A 153
None
1.38A 5hwkA-3aivA:
undetectable
5hwkA-3aivA:
17.28
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.
5HWK_B_BEZB301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 10 GLY A 203
GLY A 208
LEU A 160
ARG A 209
GLU A 153
None
1.37A 5hwkB-3aivA:
undetectable
5hwkB-3aivA:
17.28
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.
5IKT_B_TLFB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 TYR A 168
TYR A 125
SER A 103
None
0.98A 5iktB-3aivA:
0.0
5iktB-3aivA:
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.
5KM8_B_L8PB201_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 2,
MITOCHONDRIAL)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 TRP A  48
GLN A 150
SER A  56
HIS A  63
None
1.18A 5km8A-3aivA:
undetectable
5km8B-3aivA:
undetectable
5km8A-3aivA:
12.93
5km8B-3aivA:
12.93
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.
5LJC_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 LEU A 236
ILE A 307
MET A 303
TRP A 289
None
1.43A 5ljcA-3aivA:
undetectable
5ljcA-3aivA:
12.26
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.
5NNA_A_BZMA301_0
(ISATIN HYDROLASE A)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 HIS A 193
TRP A 289
SER A 211
GLY A 201
TYR A 228
None
1.07A 5nnaA-3aivA:
undetectable
5nnaA-3aivA:
20.63
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.
5NNA_B_BZMB301_0
(ISATIN HYDROLASE A)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 HIS A 193
TRP A 289
SER A 211
GLY A 201
TYR A 228
None
1.03A 5nnaB-3aivA:
undetectable
5nnaB-3aivA:
20.63
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.
5NNA_C_BZMC301_0
(ISATIN HYDROLASE A)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 HIS A 193
TRP A 289
SER A 211
GLY A 201
TYR A 228
None
1.02A 5nnaC-3aivA:
undetectable
5nnaC-3aivA:
20.63
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.
5NNA_D_BZMD301_0
(ISATIN HYDROLASE A)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 HIS A 193
TRP A 289
SER A 211
GLY A 201
TYR A 228
None
1.08A 5nnaD-3aivA:
undetectable
5nnaD-3aivA:
20.63
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.
5NOO_C_D16C402_1
(THYMIDYLATE SYNTHASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 6 TYR A 168
LEU A 152
GLY A 158
PHE A 159
None
1.06A 5nooC-3aivA:
undetectable
5nooC-3aivA:
19.66
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.
5OH1_A_EF2A202_0
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.34A 5oh1A-3aivA:
0.0
5oh1A-3aivA:
9.79
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.
5OH1_B_EF2B202_0
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.29A 5oh1B-3aivA:
undetectable
5oh1B-3aivA:
9.79
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.
5OH3_A_9V2A202_0
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.40A 5oh3A-3aivA:
undetectable
5oh3A-3aivA:
13.13
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.
5OH3_B_9V2B202_0
(CEREBLON ISOFORM 4)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 ASN A 190
PHE A 187
TRP A 144
TYR A 168
None
1.32A 5oh3B-3aivA:
undetectable
5oh3B-3aivA:
13.13
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.
5OV9_A_CVIA608_0
(ACETYLCHOLINESTERASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 7 TYR A 348
ASP A 355
THR A 351
THR A 354
None
1.00A 5ov9A-3aivA:
undetectable
5ov9A-3aivA:
22.29
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.
5OV9_B_CVIB602_0
(ACETYLCHOLINESTERASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 TYR A 348
ASP A 355
THR A 351
THR A 354
None
0.98A 5ov9B-3aivA:
1.8
5ov9B-3aivA:
22.29
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.
5UUN_B_ACTB309_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
3 / 3 TYR A 228
ALA A 357
TYR A 285
None
0.87A 5uunB-3aivA:
undetectable
5uunB-3aivA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y7P_E_CHDE401_0
(BILE SALT HYDROLASE)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 8 TYR A 333
ILE A 405
ASN A 286
LEU A 391
None
0.78A 5y7pE-3aivA:
undetectable
5y7pE-3aivA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YCP_A_BRLA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
5 / 12 PHE A 493
SER A  38
ILE A 137
HIS A 452
LEU A 432
None
1.21A 5ycpA-3aivA:
undetectable
5ycpA-3aivA:
7.59
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.
6DJZ_C_GMJC301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)
3aiv BETA-GLUCOSIDASE
(Secale
cereale)
4 / 6 TRP A 106
LEU A 236
TYR A 156
GLN A 150
None
1.28A 6djzC-3aivA:
undetectable
6djzC-3aivA:
14.85