SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4iig'

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.
1FBM_B_RTLB951_1
(PROTEIN (CARTILAGE
OLIGOMERIC MATRIX
PROTEIN))		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 4 THR A  63
LEU A  62
VAL A  80
LEU A  83
 None
None
NAG  A 901 ( 4.2A)
None
 1.05A 1fbmB-4iigA:
undetectable		 1fbmB-4iigA:
4.92
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.
1FDU_D_ESTD352_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 SER A 550
VAL A 551
GLY A 552
GLU A 197
 None
 0.89A 1fduD-4iigA:
4.2		 1fduD-4iigA:
19.34
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.
1HSH_A_MK1A401_2
(HIV-II PROTEASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 9 ALA A 127
ILE A 392
GLY A  96
ILE A  97
PRO A 457
 None
 0.96A 1hshB-4iigA:
undetectable		 1hshB-4iigA:
7.68
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.
1IIU_A_RTLA176_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 11 ALA A  43
ALA A  47
MET A 338
TYR A 341
LEU A  62
 None
 1.31A 1iiuA-4iigA:
undetectable		 1iiuA-4iigA:
13.35
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.
1KB9_A_PCFA514_0
(CYTOCHROME B
CYTOCHROME C1, HEME
PROTEIN
UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN I
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 8 SER A 846
ILE A 645
VAL A 401
SER A 550
 None
 1.14A 1kb9A-4iigA:
undetectable
1kb9C-4iigA:
undetectable
1kb9D-4iigA:
undetectable
1kb9E-4iigA:
undetectable		 1kb9A-4iigA:
20.39
1kb9C-4iigA:
19.37
1kb9D-4iigA:
14.01
1kb9E-4iigA:
13.21
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.
1KT5_A_RTLA176_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 ALA A  43
ALA A  47
MET A 338
TYR A 341
LEU A  62
 None
 1.32A 1kt5A-4iigA:
undetectable		 1kt5A-4iigA:
12.20
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.
1QOM_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		3 / 3 ARG A 521
ILE A 548
TRP A 570
 None
 1.20A 1qomA-4iigA:
undetectable		 1qomA-4iigA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RK3_A_VDXA500_2
(VITAMIN D3 RECEPTOR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 4 LEU A 524
ILE A 632
ARG A 635
TYR A 610
 None
 1.44A 1rk3A-4iigA:
undetectable		 1rk3A-4iigA:
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.
1XOT_A_VDNA101_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 LEU A 615
SER A 513
GLN A 196
PHE A 199
ILE A 212
 None
 1.37A 1xotA-4iigA:
undetectable		 1xotA-4iigA:
20.15
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.
2JST_A_HLTA101_1
(FOUR-ALPHA-HELIX
BUNDLE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 ALA A 114
TRP A 570
LEU A 569
ALA A 594
 None
 1.30A 2jstA-4iigA:
undetectable
2jstB-4iigA:
undetectable		 2jstA-4iigA:
6.15
2jstB-4iigA:
6.15
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.
2O4N_A_TPVA300_1
(PROTEASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 ALA A 127
ILE A 392
GLY A  96
ILE A  97
PRO A 457
 None
 0.97A 2o4nA-4iigA:
undetectable		 2o4nA-4iigA:
9.29
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.
2Q63_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		3 / 3 ARG A 802
ASN A 658
THR A 655
 None
 0.89A 2q63A-4iigA:
undetectable		 2q63A-4iigA:
8.38
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.
2QEO_A_LNRA200_1
(D7R4 PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLU A 159
ILE A 512
TYR A 511
ASP A 280
MET A 245
 None
None
BGC  A 943 (-3.8A)
BGC  A 942 (-2.9A)
BGC  A 942 (-4.0A)
 1.34A 2qeoA-4iigA:
undetectable		 2qeoA-4iigA:
9.65
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.
2TCT_A_CTCA222_0
(TETRACYCLINE
REPRESSOR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 SER A  93
PHE A 106
HIS A 388
GLN A 140
ILE A 179
 None
 1.45A 2tctA-4iigA:
undetectable		 2tctA-4iigA:
13.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2TRT_A_TACA222_1
(TETRACYCLINE
REPRESSOR CLASS D)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 11 SER A  93
PHE A 106
HIS A 388
GLN A 140
ILE A 179
 None
 1.41A 2trtA-4iigA:
0.0		 2trtA-4iigA:
14.30
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.
2UVN_A_ECNA1409_1
(CYTOCHROME P450 130)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		6 / 12 MET A  88
THR A  77
THR A  66
GLY A  65
GLY A 301
LEU A 141
 None
None
None
None
None
BGC  A 942 ( 3.9A)
 1.39A 2uvnA-4iigA:
undetectable		 2uvnA-4iigA:
18.11
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.
2WSE_B_PQNB1774_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 10 SER A 260
ARG A 329
ALA A 291
LEU A 292
ALA A 737
 MAN  A 919 ( 4.8A)
None
None
None
None
 1.50A 2wseB-4iigA:
undetectable		 2wseB-4iigA:
22.14
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.
2Y7K_A_SALA1303_1
(LYSR-TYPE REGULATORY
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 7 PHE A 233
ILE A 244
PRO A 147
GLY A 146
 None
 0.88A 2y7kA-4iigA:
undetectable		 2y7kA-4iigA:
13.42
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.
2ZLC_A_VDXA500_2
(VITAMIN D3 RECEPTOR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 LEU A 524
ILE A 632
ARG A 635
TYR A 610
 None
 1.47A 2zlcA-4iigA:
undetectable		 2zlcA-4iigA:
15.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZT7_A_GLYA1300_0
(GLYCYL-TRNA
SYNTHETASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 7 TYR A 248
ARG A 200
GLU A 509
SER A 451
 BGC  A 943 ( 4.5A)
BGC  A 942 (-3.8A)
BGC  A 942 (-3.1A)
BGC  A 942 (-3.4A)
 1.22A 2zt7A-4iigA:
undetectable		 2zt7A-4iigA:
22.44
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.
3E7I_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		3 / 3 ARG A 521
ILE A 548
TRP A 570
 None
 1.08A 3e7iB-4iigA:
undetectable		 3e7iB-4iigA:
19.74
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.
3ID6_C_SAMC301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A 125
ALA A 121
ALA A 182
ILE A 179
GLN A 180
 None
 0.99A 3id6C-4iigA:
undetectable		 3id6C-4iigA:
13.70
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.
3KEE_A_30BA500_1
(GENOME POLYPROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.01A 3keeA-4iigA:
undetectable		 3keeA-4iigA:
13.65
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.
3KEE_B_30BB500_1
(GENOME POLYPROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.04A 3keeB-4iigA:
undetectable		 3keeB-4iigA:
13.65
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.
3KEE_C_30BC500_1
(GENOME POLYPROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.04A 3keeC-4iigA:
undetectable		 3keeC-4iigA:
13.65
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.
3KEE_D_30BD500_1
(GENOME POLYPROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.04A 3keeD-4iigA:
undetectable		 3keeD-4iigA:
13.65
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.
3N3I_A_ROCA201_2
(PROTEASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 ILE A 392
ILE A 466
GLY A 579
VAL A 590
 None
 0.83A 3n3iA-4iigA:
undetectable		 3n3iA-4iigA:
13.47
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.
3ROZ_A_NCAA266_0
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 LEU A 316
ALA A 334
LEU A  62
THR A  63
 None
 1.07A 3rozA-4iigA:
undetectable		 3rozA-4iigA:
15.95
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.
3SUE_A_SUEA1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.06A 3sueA-4iigA:
undetectable		 3sueA-4iigA:
13.31
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.
3SUE_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.06A 3sueB-4iigA:
undetectable		 3sueB-4iigA:
13.31
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.
3SUE_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.03A 3sueC-4iigA:
undetectable		 3sueC-4iigA:
13.31
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.
3SUF_A_SUEA1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.04A 3sufA-4iigA:
undetectable		 3sufA-4iigA:
13.31
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.
3SUF_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 0.99A 3sufB-4iigA:
undetectable		 3sufB-4iigA:
13.31
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.
3SUF_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 11 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 1.09A 3sufC-4iigA:
undetectable		 3sufC-4iigA:
13.31
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.
3SUF_D_SUED1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A  38
GLY A 272
SER A 752
ALA A 239
ALA A 236
 None
 0.97A 3sufD-4iigA:
undetectable		 3sufD-4iigA:
13.31
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.
3TEH_B_DAHB786_1
(PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 7 HIS A 549
LEU A 582
GLY A 575
PHE A 456
 None
 0.91A 3tehB-4iigA:
undetectable		 3tehB-4iigA:
23.65
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.
4AC9_C_DXCC1476_0
(MJ0495-LIKE PROTEIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 ILE A  97
ALA A 454
HIS A 388
ARG A 124
 None
 1.10A 4ac9B-4iigA:
4.0
4ac9C-4iigA:
4.3		 4ac9B-4iigA:
21.22
4ac9C-4iigA:
21.22
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.
4ACA_C_DXCC1476_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 ILE A  97
ALA A 454
HIS A 388
ARG A 124
 None
 1.08A 4acaB-4iigA:
4.5
4acaC-4iigA:
4.5		 4acaB-4iigA:
21.22
4acaC-4iigA:
21.22
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.
4GRK_A_KTRA713_1
(LACTOTRANSFERRIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 GLY A 313
VAL A  60
PRO A 709
TYR A 696
 None
 0.92A 4grkA-4iigA:
undetectable		 4grkA-4iigA:
18.73
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.
4KFJ_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 ALA A 537
ILE A 466
PRO A 462
LEU A 586
VAL A 498
 None
 0.96A 4kfjB-4iigA:
undetectable		 4kfjB-4iigA:
13.85
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.
4L1W_A_STRA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 7 VAL A 565
HIS A 549
LEU A 582
LEU A 586
 None
 1.03A 4l1wA-4iigA:
3.0		 4l1wA-4iigA:
17.38
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.
4MM9_A_FVXA603_1
(TRANSPORTER)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 11 VAL A 112
GLY A 169
SER A 162
GLY A 160
ASP A 117
 None
 1.18A 4mm9A-4iigA:
undetectable		 4mm9A-4iigA:
20.78
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.
4RTP_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A 160
ALA A 145
ASN A 157
SER A 550
PRO A 597
 None
 1.27A 4rtpA-4iigA:
3.1		 4rtpA-4iigA:
17.34
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.
4V2G_B_CTCB222_0
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 SER A  93
PHE A 106
HIS A 388
GLN A 140
ILE A 179
 None
 1.44A 4v2gB-4iigA:
undetectable		 4v2gB-4iigA:
13.76
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.
4XI3_B_29SB601_1
(ESTROGEN RECEPTOR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 ALA A 234
ASP A 235
LEU A 271
LEU A 266
LEU A 758
 None
 1.01A 4xi3B-4iigA:
undetectable		 4xi3B-4iigA:
14.13
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.
4YMG_B_SAMB1001_0
(PUTATIVE
SAM-DEPENDENT
O-METHYLTRANFERASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A 422
SER A 499
ALA A 479
ASP A 424
ALA A 425
 None
 1.33A 4ymgB-4iigA:
undetectable		 4ymgB-4iigA:
14.03
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.
4YV5_A_SVRA205_2
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 LYS A 394
LEU A 395
ASN A 111
PRO A 107
 None
 1.42A 4yv5B-4iigA:
undetectable		 4yv5B-4iigA:
9.06
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.
4YV5_B_SVRB207_1
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 LYS A 394
LEU A 395
ASN A 111
PRO A 107
 None
 1.41A 4yv5A-4iigA:
undetectable		 4yv5A-4iigA:
9.06
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.
5AXA_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 GLU A 810
THR A 811
HIS A 842
LEU A 662
 None
 1.21A 5axaA-4iigA:
3.2		 5axaA-4iigA:
19.95
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.
5AXA_C_ADNC502_2
(ADENOSYLHOMOCYSTEINA
SE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 5 GLU A 810
THR A 811
HIS A 842
LEU A 662
 None
 1.18A 5axaC-4iigA:
3.3		 5axaC-4iigA:
19.95
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.
5EML_A_SAMA701_1
(PROTEIN ARGININE
N-METHYLTRANSFERASE
5)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 TYR A 248
GLY A 510
GLU A 509
ASP A 437
 BGC  A 943 ( 4.5A)
None
BGC  A 942 (-3.1A)
BGC  A 943 ( 4.8A)
 1.33A 5emlA-4iigA:
3.9		 5emlA-4iigA:
21.44
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.
5HFJ_F_SAMF301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 ASP A 398
ALA A 397
PRO A 107
GLY A 572
SER A 550
 None
 1.23A 5hfjF-4iigA:
undetectable		 5hfjF-4iigA:
14.01
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.
5IH0_A_ERYA404_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A 155
ASN A 157
ARG A 150
SER A 217
ILE A 216
 None
 1.21A 5ih0A-4iigA:
undetectable		 5ih0A-4iigA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IL1_A_SAMA601_0
(METTL3)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 ARG A 604
PRO A 553
LEU A 524
SER A 596
GLY A 149
 None
 1.36A 5il1A-4iigA:
undetectable		 5il1A-4iigA:
13.38
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.
5JGL_B_SAMB301_0
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 GLY A 142
ALA A 108
LEU A 573
ALA A 145
GLY A 160
 None
 1.29A 5jglB-4iigA:
undetectable		 5jglB-4iigA:
16.86
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.
5KF8_A_GCSA404_1
(PREDICTED
ACETYLTRANSFERASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 8 ARG A 200
GLU A 197
GLY A 146
PRO A 147
 BGC  A 942 (-3.8A)
None
None
None
 1.16A 5kf8A-4iigA:
undetectable		 5kf8A-4iigA:
16.86
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.
5KGP_A_GCSA407_1
(PREDICTED
ACETYLTRANSFERASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 8 ARG A 200
GLU A 197
GLY A 146
PRO A 147
 BGC  A 942 (-3.8A)
None
None
None
 1.03A 5kgpA-4iigA:
undetectable		 5kgpA-4iigA:
16.86
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.
5KGP_B_GCSB405_1
(PREDICTED
ACETYLTRANSFERASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 8 ARG A 200
GLU A 197
GLY A 146
PRO A 147
 BGC  A 942 (-3.8A)
None
None
None
 1.02A 5kgpB-4iigA:
undetectable		 5kgpB-4iigA:
16.86
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.
5KOX_A_RFPA502_2
(PENTACHLOROPHENOL
4-MONOOXYGENASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		3 / 3 VAL A 546
ARG A 604
PRO A 553
 None
 0.85A 5koxA-4iigA:
undetectable		 5koxA-4iigA:
21.25
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.
5M6G_A_SORA711_0
(BETA-GLUCOSIDASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		6 / 12 ASP A  92
ARG A 156
LYS A 189
HIS A 190
MET A 245
GLU A 509
 BGC  A 942 (-2.8A)
BGC  A 942 (-2.9A)
BGC  A 942 (-2.8A)
BGC  A 942 (-4.1A)
BGC  A 942 (-4.0A)
BGC  A 942 (-3.1A)
 0.42A 5m6gA-4iigA:
32.9		 5m6gA-4iigA:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OM2_B_DXTB501_1
(ALPHA-1-ANTICHYMOTRY
PSIN)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 9 LEU A 856
ALA A 855
VAL A 765
HIS A 663
ILE A 763
 None
 1.16A 5om2A-4iigA:
undetectable
5om2B-4iigA:
undetectable		 5om2A-4iigA:
6.49
5om2B-4iigA:
4.48
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.
5UMD_A_YMZA3801_1
(60S RIBOSOMAL
PROTEIN L28
28S RIBOSOMAL RNA
60S RIBOSOMAL
PROTEIN L4)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 ASN A  35
ALA A  34
PRO A 683
TYR A  44
 None
 1.18A 5umd2-4iigA:
undetectable
5umdF-4iigA:
undetectable		 5umd2-4iigA:
6.56
5umdF-4iigA:
6.78
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.
5VLM_E_CVIE301_1
(REGULATORY PROTEIN
TETR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 7 GLN A  45
GLY A  36
GLN A 180
ASP A 332
 None
 1.03A 5vlmE-4iigA:
undetectable		 5vlmE-4iigA:
12.50
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.
6BXL_B_SAMB401_0
(2-(3-AMINO-3-CARBOXY
PROPYL)HISTIDINE
SYNTHASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 LEU A 263
GLY A 294
VAL A  60
VAL A 330
ASP A 332
 None
 1.35A 6bxlB-4iigA:
4.2		 6bxlB-4iigA:
17.76
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.
6C2M_C_SUEC1203_0
(NS3 PROTEASE)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 HIS A 549
VAL A 501
GLY A 575
SER A 578
ALA A 397
 None
 1.06A 6c2mC-4iigA:
undetectable		 6c2mC-4iigA:
7.42
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.
6DJZ_A_GMJA301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 6 SER A 218
GLN A 196
GLU A 628
THR A 224
 None
 1.45A 6djzA-4iigA:
undetectable		 6djzA-4iigA:
14.63
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.
6FBV_D_FI8D1904_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		4 / 8 ASP A 221
GLU A 792
VAL A 796
GLN A 860
 NAG  A 908 (-4.9A)
None
None
None
 1.18A 6fbvD-4iigA:
undetectable		 6fbvD-4iigA:
20.44
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.
6IBL_A_H98A501_0
(THIOREDOXIN 1,BETA-1
ADRENERGIC RECEPTOR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 THR A 187
VAL A 185
VAL A 184
ASP A 280
VAL A  74
 None
None
None
BGC  A 942 (-2.9A)
None
 1.42A 6iblA-4iigA:
undetectable		 6iblA-4iigA:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6IBL_B_H98B501_0
(THIOREDOXIN 1,BETA-1
ADRENERGIC RECEPTOR)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 THR A 187
VAL A 185
VAL A 184
ASP A 280
VAL A  74
 None
None
None
BGC  A 942 (-2.9A)
None
 1.37A 6iblB-4iigA:
undetectable		 6iblB-4iigA:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MHT_D_SAMD328_0
(CYTOSINE-SPECIFIC
METHYLTRANSFERASE
HHAI)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 12 PHE A 273
GLY A 753
GLY A 750
ASP A 235
ILE A 244
 None
 1.05A 6mhtA-4iigA:
undetectable		 6mhtA-4iigA:
16.17
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.
6NQA_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 4iig BETA-GLUCOSIDASE 1
(Aspergillus
aculeatus) 		5 / 10 GLY A 508
GLY A 155
VAL A 551
GLU A 197
ASN A 517
 None
None
None
None
NAG  A 925 (-3.0A)
 1.26A 6nqaK-4iigA:
undetectable		 6nqaK-4iigA:
18.74