SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3aib'

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.
1BDW_B_DVAB6_0
(GRAMICIDIN A)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 TRP A 819
ALA A 763
VAL A 820
 None
 0.99A 1bdwA-3aibA:
undetectable
1bdwB-3aibA:
undetectable		 1bdwA-3aibA:
2.46
1bdwB-3aibA:
2.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		7 / 12 TYR A 916
ARG A 475
ASP A 477
ALA A 478
GLU A 515
HIS A 587
ASP A 588
 None
 0.90A 1dedB-3aibA:
8.4		 1dedB-3aibA:
23.55
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.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		7 / 12 TYR A 916
LEU A 434
ARG A 475
ASP A 477
ALA A 478
GLU A 515
HIS A 587
 None
 1.03A 1dedB-3aibA:
8.4		 1dedB-3aibA:
23.55
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.
1DF7_A_MTXA501_2
(DIHYDROFOLATE
REDUCTASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 TRP A 299
ARG A 273
THR A 298
 None
 0.95A 1df7A-3aibA:
undetectable		 1df7A-3aibA:
11.02
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.
1E73_M_ASCM995_0
(MYROSINASE MA1)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 6 GLN A1003
ILE A 926
PHE A 459
PHE A1011
 None
 1.39A 1e73M-3aibA:
3.5		 1e73M-3aibA:
20.55
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.
1E7A_B_PFLB4001_1
(SERUM ALBUMIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 9 ILE A 775
LEU A 646
VAL A 818
GLY A 817
LEU A 683
 None
 1.13A 1e7aB-3aibA:
undetectable		 1e7aB-3aibA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E7B_A_HLTA4003_1
(SERUM ALBUMIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 9 ILE A 775
LEU A 646
VAL A 818
GLY A 817
LEU A 683
 None
 1.11A 1e7bA-3aibA:
undetectable		 1e7bA-3aibA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KQE_A_DVAA6_0
(MINI-GRAMICIDIN A)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ALA A 478
VAL A 476
TRP A 956
 None
 0.68A 1kqeA-3aibA:
undetectable
1kqeE-3aibA:
undetectable		 1kqeA-3aibA:
1.74
1kqeE-3aibA:
1.74
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.
1KQE_B_DVAB6_0
(MINI-GRAMICIDIN A)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ALA A 478
VAL A 476
TRP A 956
 None
 0.68A 1kqeB-3aibA:
undetectable
1kqeD-3aibA:
undetectable		 1kqeB-3aibA:
1.74
1kqeD-3aibA:
1.74
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.
1KQE_D_DVAD6_0
(MINI-GRAMICIDIN A)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 TRP A 956
ALA A 478
VAL A 476
 None
 0.68A 1kqeB-3aibA:
undetectable
1kqeD-3aibA:
undetectable		 1kqeB-3aibA:
1.74
1kqeD-3aibA:
1.74
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.
1KQE_E_DVAE6_0
(MINI-GRAMICIDIN A)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 TRP A 956
ALA A 478
VAL A 476
 None
 0.68A 1kqeA-3aibA:
undetectable
1kqeE-3aibA:
undetectable		 1kqeA-3aibA:
1.74
1kqeE-3aibA:
1.74
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.
1MIC_A_DVAA6_0
(GRAMICIDIN A)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ALA A 478
VAL A 476
TRP A 956
 None
 0.81A 1micA-3aibA:
undetectable
1micB-3aibA:
undetectable		 1micA-3aibA:
2.46
1micB-3aibA:
2.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MT1_A_AG2A7005_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 6 LEU A 547
LEU A 539
ILE A 561
GLU A 737
 None
 1.01A 1mt1A-3aibA:
undetectable
1mt1F-3aibA:
undetectable		 1mt1A-3aibA:
5.58
1mt1F-3aibA:
8.06
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.
1N13_L_AG2L7014_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 LEU A 547
LEU A 539
ILE A 561
GLU A 737
 None
 1.07A 1n13I-3aibA:
undetectable
1n13L-3aibA:
undetectable		 1n13I-3aibA:
5.58
1n13L-3aibA:
8.06
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.
1NW3_A_ACTA600_0
(HISTONE
METHYLTRANSFERASE
DOT1L)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 5 LEU A 387
VAL A 994
TYR A 992
THR A1051
 None
 1.45A 1nw3A-3aibA:
1.3		 1nw3A-3aibA:
19.58
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.
1NW5_A_SAMA401_0
(MODIFICATION
METHYLASE RSRI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 ASP A 570
THR A 728
GLY A 693
SER A 692
ALA A 696
 None
 1.16A 1nw5A-3aibA:
undetectable		 1nw5A-3aibA:
17.95
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.
1NW5_A_SAMA401_1
(MODIFICATION
METHYLASE RSRI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ASP A 955
HIS A 587
ASP A 909
 None
 0.85A 1nw5A-3aibA:
undetectable		 1nw5A-3aibA:
17.95
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.
1Y7I_A_SALA502_1
(SALICYLIC
ACID-BINDING PROTEIN
2)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 544
HIS A 637
LYS A 549
 None
 0.98A 1y7iA-3aibA:
undetectable		 1y7iA-3aibA:
14.44
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.
2AOU_A_CQAA403_0
(HISTAMINE
N-METHYLTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 8 GLY A 859
PHE A 860
ASP A 665
TYR A 658
 None
 1.01A 2aouA-3aibA:
undetectable		 2aouA-3aibA:
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.
2IEO_A_017A402_1
(PROTEASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 LEU A 514
GLY A 491
ALA A 490
ILE A1028
VAL A 479
 None
 0.88A 2ieoA-3aibA:
undetectable		 2ieoA-3aibA:
8.35
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.
2OWC_A_ACRA600_1
(4-ALPHA-GLUCANOTRANS
FERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 11 TYR A 916
ASP A 477
HIS A 587
ASP A 588
ASN A 862
 None
 1.27A 2owcA-3aibA:
undetectable		 2owcA-3aibA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQD_A_AG2A671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 LEU A 547
LEU A 539
ILE A 561
GLU A 737
 None
 1.08A 2qqdA-3aibA:
undetectable
2qqdE-3aibA:
undetectable		 2qqdA-3aibA:
5.46
2qqdE-3aibA:
8.06
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.
2W3A_A_TOPA1190_1
(DIHYDROFOLATE
REDUCTASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 11 ALA A 586
GLU A 858
PHE A 857
THR A 640
ILE A 680
 None
 1.21A 2w3aA-3aibA:
undetectable		 2w3aA-3aibA:
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.
2W4X_A_STZA1591_1
(O-GLCNACASE BT_4395)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 11 ASP A 477
TYR A 916
ASN A 862
VAL A 591
TYR A 658
 None
 1.25A 2w4xA-3aibA:
5.4		 2w4xA-3aibA:
22.92
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.
3A27_A_SAMA250_1
(UNCHARACTERIZED
PROTEIN MJ1557)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 MET A 535
GLU A 858
ASN A 862
 None
 1.02A 3a27A-3aibA:
undetectable		 3a27A-3aibA:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A27_A_SAMA250_1
(UNCHARACTERIZED
PROTEIN MJ1557)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 MET A 535
GLU A 858
ASN A 914
 None
 0.93A 3a27A-3aibA:
undetectable		 3a27A-3aibA:
16.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_A_ACRA5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.25A 3aicA-3aibA:
71.4		 3aicA-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_A_ACRA5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 434
TRP A 517
TYR A 916
 None
 0.11A 3aicA-3aibA:
71.4		 3aicA-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.26A 3aicB-3aibA:
69.9		 3aicB-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_B_ACRB5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 434
TRP A 517
TYR A 916
 None
 0.15A 3aicB-3aibA:
69.9		 3aicB-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
TYR A 916
GLN A 960
 None
 0.24A 3aicC-3aibA:
70.9		 3aicC-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.27A 3aicD-3aibA:
70.9		 3aicD-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.15A 3aicE-3aibA:
71.0		 3aicE-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_E_ACRE5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 434
TRP A 517
TYR A 916
 None
 0.17A 3aicE-3aibA:
71.0		 3aicE-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.25A 3aicF-3aibA:
70.8		 3aicF-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_F_ACRF5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 434
TRP A 517
TYR A 916
 None
 0.25A 3aicF-3aibA:
70.8		 3aicF-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.24A 3aicG-3aibA:
70.6		 3aicG-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_G_ACRG5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 434
TRP A 517
TYR A 916
 None
 0.12A 3aicG-3aibA:
70.6		 3aicG-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_H_ACRH5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		12 / 12 LEU A 433
ARG A 475
ASP A 477
ALA A 478
ASN A 481
GLU A 515
ASN A 537
ARG A 540
HIS A 587
ASP A 588
ASP A 909
GLN A 960
 None
 0.19A 3aicH-3aibA:
71.0		 3aicH-3aibA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AIC_H_ACRH5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LEU A 434
TRP A 517
TYR A 916
 None
 0.21A 3aicH-3aibA:
71.0		 3aicH-3aibA:
100.00
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.
3BJW_F_SVRF509_3
(PHOSPHOLIPASE A2)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 VAL A 752
ILE A 707
GLY A 738
LEU A 642
 None
 0.91A 3bjwF-3aibA:
undetectable		 3bjwF-3aibA:
9.48
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.
3BJW_H_SVRH511_3
(PHOSPHOLIPASE A2)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 VAL A 752
ILE A 707
GLY A 738
LEU A 642
 None
 0.87A 3bjwH-3aibA:
undetectable		 3bjwH-3aibA:
9.48
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.
3BOG_D_DVAD10_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 GLY A 732
GLY A 693
GLY A 714
 None
 0.41A 3bogD-3aibA:
undetectable		 3bogD-3aibA:
7.11
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.
3BVB_B_017B401_1
(PROTEASE
(RETROPEPSIN))		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 LEU A 514
GLY A 491
ALA A 490
ILE A1028
VAL A 479
 None
 0.88A 3bvbA-3aibA:
undetectable		 3bvbA-3aibA:
8.35
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.
3BWC_B_SAMB501_1
(SPERMIDINE SYNTHASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 5 GLN A 413
GLN A1027
ASP A 528
ASP A 521
 None
 1.40A 3bwcB-3aibA:
1.7		 3bwcB-3aibA:
16.92
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.
3IA4_B_MTXB164_2
(DIHYDROFOLATE
REDUCTASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 4 PHE A 885
LYS A 884
ILE A 878
THR A 891
 None
 1.29A 3ia4B-3aibA:
undetectable		 3ia4B-3aibA:
11.18
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.
3IV6_B_SAMB301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 GLY A 703
ASP A 749
ILE A 707
LEU A 743
ARG A 744
 None
 1.34A 3iv6B-3aibA:
undetectable		 3iv6B-3aibA:
15.16
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.
3K8M_B_ACRB820_1
(ALPHA-AMYLASE, SUSG)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 TYR A 610
GLU A 590
LEU A 908
ASN A 862
 None
 1.31A 3k8mB-3aibA:
6.9		 3k8mB-3aibA:
23.33
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.
3LOQ_A_ACTA279_0
(UNIVERSAL STRESS
PROTEIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 4 SER A 906
SER A 902
THR A 903
SER A 910
 None
 1.22A 3loqA-3aibA:
0.9		 3loqA-3aibA:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N8X_A_NIMA701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 VAL A 578
SER A 580
LEU A 565
 None
 0.73A 3n8xA-3aibA:
undetectable		 3n8xA-3aibA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NRR_A_D16A520_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 ALA A 645
LEU A 547
ARG A 554
SER A 705
LEU A 560
 None
 1.13A 3nrrA-3aibA:
undetectable		 3nrrA-3aibA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 6 PHE A 259
THR A1078
ALA A 257
ALA A 256
 None
 1.23A 3ns1C-3aibA:
undetectable		 3ns1C-3aibA:
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.
3O5R_A_FK5A1001_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 11 ASP A 883
VAL A 877
ILE A 878
LYS A 948
ILE A 950
 None
 1.19A 3o5rA-3aibA:
undetectable		 3o5rA-3aibA:
9.77
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.
3OKX_B_SAMB201_0
(YAEB-LIKE PROTEIN
RPA0152)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 LYS A 505
ARG A 854
LYS A 715
 None
 1.22A 3okxA-3aibA:
undetectable		 3okxA-3aibA:
11.76
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.
3U8Q_A_NPUA7231_1
(LACTOTRANSFERRIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 5 GLY A 925
PRO A 929
ASN A 930
TYR A 873
 None
 1.25A 3u8qA-3aibA:
undetectable		 3u8qA-3aibA:
17.06
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.
3UJ6_A_SAMA300_1
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 4 SER A 652
ASP A 530
ASP A 527
ALA A 577
 None
 1.34A 3uj6A-3aibA:
undetectable		 3uj6A-3aibA:
15.32
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.
3W9T_F_W9TF512_1
(HEMOLYTIC LECTIN
CEL-III)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 6 THR A1051
ASN A1052
GLY A 385
ILE A 987
 None
 0.90A 3w9tF-3aibA:
undetectable		 3w9tF-3aibA:
19.39
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.
4AZT_A_SAMA1472_0
(METHYLTRANSFERASE
WBDD)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 ALA A 435
ASN A 436
ILE A1053
GLU A 375
LEU A 382
 None
 1.11A 4aztA-3aibA:
2.8		 4aztA-3aibA:
20.56
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.
4DJE_A_C2FA300_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 MET A 961
PHE A 918
ASP A1002
GLY A1008
GLN A 449
 None
 1.47A 4djeA-3aibA:
4.6		 4djeA-3aibA:
15.86
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.
4DJE_B_C2FB302_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 MET A 961
PHE A 918
ASP A1002
GLY A1008
GLN A 449
 None
 1.02A 4djeB-3aibA:
4.1		 4djeB-3aibA:
15.86
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.
4DJF_B_C2FB300_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 MET A 961
PHE A 918
ASP A1002
GLY A1008
GLN A 449
 None
 1.19A 4djfB-3aibA:
4.6		 4djfB-3aibA:
15.86
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.
4FP9_A_SAMA401_0
(METHYLTRANSFERASE
NSUN4)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 GLY A 693
LEU A 684
GLY A 889
ASP A 852
PRO A 655
 None
 0.98A 4fp9A-3aibA:
undetectable		 4fp9A-3aibA:
16.16
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.
4FP9_C_SAMC401_0
(METHYLTRANSFERASE
NSUN4)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 GLY A 693
LEU A 684
GLY A 889
ASP A 852
PRO A 655
 None
 0.98A 4fp9C-3aibA:
undetectable		 4fp9C-3aibA:
16.16
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.
4FP9_F_SAMF401_0
(METHYLTRANSFERASE
NSUN4)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 GLY A 693
LEU A 684
GLY A 889
ASP A 852
PRO A 655
 None
 0.98A 4fp9F-3aibA:
undetectable		 4fp9F-3aibA:
16.16
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.
4IK7_A_IMNA201_1
(TRANSTHYRETIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 LYS A 549
LEU A 544
ALA A 548
THR A 640
 None
 1.00A 4ik7A-3aibA:
undetectable		 4ik7A-3aibA:
9.52
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.
4IKI_B_IMNB201_1
(TRANSTHYRETIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 6 LYS A 549
LEU A 544
SER A 643
THR A 640
 None
 0.94A 4ikiB-3aibA:
undetectable		 4ikiB-3aibA:
9.52
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.
4IKJ_A_SUZA201_1
(TRANSTHYRETIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 LYS A 549
LEU A 544
SER A 643
THR A 640
 None
 1.03A 4ikjA-3aibA:
undetectable
4ikjB-3aibA:
undetectable		 4ikjA-3aibA:
9.52
4ikjB-3aibA:
9.52
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.
4IKJ_B_SUZB201_1
(TRANSTHYRETIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 8 LYS A 549
LEU A 544
SER A 643
THR A 640
 None
 0.90A 4ikjA-3aibA:
undetectable
4ikjB-3aibA:
undetectable		 4ikjA-3aibA:
9.52
4ikjB-3aibA:
9.52
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.
4IKK_B_SUZB201_1
(TRANSTHYRETIN)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 LYS A 549
LEU A 544
SER A 643
THR A 640
 None
 0.88A 4ikkA-3aibA:
undetectable
4ikkB-3aibA:
undetectable		 4ikkA-3aibA:
9.52
4ikkB-3aibA:
9.52
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.
4LAX_A_FK5A301_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP4)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 10 ASP A 883
VAL A 877
ILE A 878
LYS A 948
ILE A 950
 None
 1.24A 4laxA-3aibA:
undetectable		 4laxA-3aibA:
15.17
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.
4M48_A_21BA704_1
(TRANSPORTER)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 8 ASP A 665
TYR A 658
SER A 861
GLY A 859
 None
 0.85A 4m48A-3aibA:
undetectable		 4m48A-3aibA:
21.64
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.
4MUB_A_OAQA302_0
(SULFOTRANSFERASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 PHE A1071
VAL A1085
PHE A 259
THR A 254
THR A 298
 None
 1.22A 4mubA-3aibA:
undetectable		 4mubA-3aibA:
14.56
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.
4N49_A_SAMA601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 4 ASN A 930
GLY A 925
ASP A 468
ASP A 937
 None
 1.26A 4n49A-3aibA:
undetectable		 4n49A-3aibA:
18.59
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.
4NNR_A_FK5A201_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP2)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 ASP A 883
VAL A 877
ILE A 878
LYS A 948
ILE A 950
 None
 1.32A 4nnrA-3aibA:
undetectable
4nnrB-3aibA:
undetectable		 4nnrA-3aibA:
10.51
4nnrB-3aibA:
10.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NNR_B_FK5B201_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP2)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 10 ASP A 883
VAL A 877
ILE A 878
LYS A 948
ILE A 950
 None
 1.37A 4nnrB-3aibA:
undetectable		 4nnrB-3aibA:
10.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_A_GCSA306_1
(CHITOSANASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 SER A 902
ASP A 904
GLN A 383
 None
 0.96A 4oltA-3aibA:
undetectable
4oltB-3aibA:
undetectable		 4oltA-3aibA:
16.17
4oltB-3aibA:
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.
4PCU_A_SAMA603_0
(CYSTATHIONINE
BETA-SYNTHASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 7 PHE A 860
GLN A 864
THR A 874
ILE A 878
 None
 0.94A 4pcuA-3aibA:
2.3		 4pcuA-3aibA:
19.32
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.
4QWU_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 9 ALA A 268
THR A 267
LYS A 365
GLY A1057
GLY A1059
 None
 1.18A 4qwuK-3aibA:
undetectable
4qwuL-3aibA:
undetectable		 4qwuK-3aibA:
12.32
4qwuL-3aibA:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QWU_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 9 ALA A 268
THR A 267
LYS A 365
GLY A1057
GLY A1059
 None
 1.15A 4qwuY-3aibA:
undetectable
4qwuZ-3aibA:
undetectable		 4qwuY-3aibA:
12.32
4qwuZ-3aibA:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UUU_A_SAMA1546_0
(CYSTATHIONINE
BETA-SYNTHASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 11 LEU A 433
ALA A 478
THR A 409
ILE A 427
ASP A 424
 None
None
None
MES  A5001 ( 4.5A)
None
 1.02A 4uuuA-3aibA:
undetectable
4uuuB-3aibA:
undetectable		 4uuuA-3aibA:
10.78
4uuuB-3aibA:
10.78
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.
4WOZ_B_MN9B401_0
(N-ACETYLNEURAMINATE
LYASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 6 SER A 473
ASP A 472
TYR A 493
LEU A 494
 None
 1.01A 4wozA-3aibA:
3.6
4wozB-3aibA:
undetectable		 4wozA-3aibA:
17.59
4wozB-3aibA:
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.
4Y28_A_PQNA5001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 9 PHE A1048
ALA A 963
LEU A 964
GLY A 996
PHE A1011
 None
 1.24A 4y28A-3aibA:
undetectable
4y28J-3aibA:
0.0		 4y28A-3aibA:
21.37
4y28J-3aibA:
3.69
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.
4YO9_B_ACTB401_0
(3C-LIKE PROTEINASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ARG A 420
ASP A 418
TYR A 524
 None
 0.89A 4yo9B-3aibA:
undetectable		 4yo9B-3aibA:
16.35
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.
5AXA_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 5 THR A1067
THR A1078
HIS A 261
LEU A 266
 None
 1.30A 5axaA-3aibA:
undetectable		 5axaA-3aibA:
19.18
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.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 ARG A 475
ASP A 477
GLU A 515
HIS A 587
ASP A 588
 None
 0.77A 5csyB-3aibA:
2.0		 5csyB-3aibA:
21.04
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.
5IAO_C_URFC301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ARG A 656
HIS A 587
ARG A 475
 None
 1.16A 5iaoC-3aibA:
undetectable		 5iaoC-3aibA:
13.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IAO_F_URFF301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 ARG A 656
HIS A 587
ARG A 475
 None
 1.15A 5iaoF-3aibA:
undetectable		 5iaoF-3aibA:
13.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L66_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5
PROTEASOME SUBUNIT
BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA TYPE-6)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 10 ALA A 268
THR A 267
LYS A 365
GLY A1057
ALA A 369
 None
 1.18A 5l66K-3aibA:
undetectable
5l66L-3aibA:
undetectable		 5l66K-3aibA:
13.91
5l66L-3aibA:
14.05
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.
5L66_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5
PROTEASOME SUBUNIT
BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA TYPE-6)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 10 ALA A 268
THR A 267
LYS A 365
GLY A1057
ALA A 369
 None
 1.18A 5l66Y-3aibA:
undetectable
5l66Z-3aibA:
undetectable		 5l66Y-3aibA:
13.91
5l66Z-3aibA:
14.05
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.
5UTU_H_ADNH503_2
(ADENOSYLHOMOCYSTEINA
SE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 5 THR A1067
THR A1078
HIS A 261
LEU A 266
 None
 1.34A 5utuH-3aibA:
undetectable		 5utuH-3aibA:
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.
5VCY_A_DB8A401_2
(MEMBRANE-ASSOCIATED
TYROSINE- AND
THREONINE-SPECIFIC
CDC2-INHIBITORY
KINASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		4 / 4 VAL A 812
LEU A 768
ASN A 773
ASP A 772
 None
 1.25A 5vcyA-3aibA:
undetectable		 5vcyA-3aibA:
16.08
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.
5W7B_B_PA1B204_1
(ACYLOXYACYL
HYDROLASE SMALL
SUBUNIT
ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		3 / 3 GLY A1009
ASN A 451
ARG A 921
 None
 0.75A 5w7bD-3aibA:
undetectable		 5w7bD-3aibA:
7.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AG0_A_ACRA610_0
(ALPHA-AMYLASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		6 / 12 TYR A 916
TYR A 430
LEU A 433
ASP A 477
HIS A 587
ASP A 588
 None
 0.75A 6ag0A-3aibA:
11.7		 6ag0A-3aibA:
7.12
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.
6AG0_C_ACRC608_0
(ALPHA-AMYLASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 TYR A 430
LEU A 433
ASP A 477
HIS A 587
ASP A 588
 None
 0.79A 6ag0C-3aibA:
11.6		 6ag0C-3aibA:
7.12
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.
6AYB_A_KKKA508_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 3aib GLUCOSYLTRANSFERASE-
SI
(Streptococcus
mutans) 		5 / 12 TYR A 272
ALA A 257
THR A1078
LEU A1080
LEU A 266
 None
 1.12A 6aybA-3aibA:
undetectable		 6aybA-3aibA:
19.48