SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3k8k'

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.
1A4L_B_DCFB853_1
(ADENOSINE DEAMINASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 642
PHE A 470
LEU A 458
PHE A 644
ALA A 518
 None
 1.40A 1a4lB-3k8kA:
7.2		 1a4lB-3k8kA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 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_A_QPSA1001_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		8 / 12 HIS A 112
TYR A 114
ASP A 388
ALA A 389
HIS A 497
ASP A 498
ASP A 545
ARG A 549
 EDO  A 901 ( 3.8A)
ACT  A 961 ( 4.4A)
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
None
EDO  A 901 (-4.4A)
EDO  A 902 ( 2.7A)
EDO  A 901 (-3.1A)
 0.81A 1dedA-3k8kA:
30.6		 1dedA-3k8kA:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 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_A_QPSA1001_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 112
TYR A 114
GLU A 431
HIS A 497
ASP A 498
ASP A 545
ARG A 549
 EDO  A 901 ( 3.8A)
ACT  A 961 ( 4.4A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
EDO  A 902 ( 2.7A)
EDO  A 901 (-3.1A)
 1.13A 1dedA-3k8kA:
30.6		 1dedA-3k8kA:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 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)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		9 / 12 HIS A 112
TYR A 114
ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
ARG A 549
 EDO  A 901 ( 3.8A)
ACT  A 961 ( 4.4A)
None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
EDO  A 901 (-3.1A)
 0.68A 1dedB-3k8kA:
34.9		 1dedB-3k8kA:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 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_A_PFLA4001_1
(SERUM ALBUMIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 9 LEU A 680
ASN A 643
LEU A 515
GLY A 467
ALA A 628
 None
 1.29A 1e7aA-3k8kA:
undetectable		 1e7aA-3k8kA:
23.16
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.
1E7W_A_MTXA301_1
(PTERIDINE REDUCTASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 PHE A 405
TYR A 367
TYR A 355
LEU A 387
LEU A 446
 None
 1.24A 1e7wA-3k8kA:
undetectable		 1e7wA-3k8kA:
18.14
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.
1EQG_A_IBPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 9 VAL A  85
LEU A 102
ILE A 144
ALA A 139
LEU A 135
 None
 1.12A 1eqgA-3k8kA:
undetectable		 1eqgA-3k8kA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQG_B_IBPB1701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 11 VAL A  85
LEU A 102
ILE A 144
ALA A 139
LEU A 135
 None
 1.13A 1eqgB-3k8kA:
undetectable		 1eqgB-3k8kA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ESW_A_ACRA652_1
(AMYLOMALTASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 6 TYR A 558
GLY A  84
ASP A  81
GLY A  76
 None
None
MG  A 700 (-3.3A)
None
 0.93A 1eswA-3k8kA:
15.4		 1eswA-3k8kA:
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.
1HWI_B_115B1_1
(HMG-COA REDUCTASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 9 GLU A 499
ASN A 496
ALA A 516
LEU A 520
LEU A 458
 None
 1.23A 1hwiA-3k8kA:
undetectable		 1hwiA-3k8kA:
21.57
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.
1HWI_C_115C4_2
(HMG-COA REDUCTASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 8 ASN A 599
LEU A 521
ALA A 517
LEU A 520
 None
 0.82A 1hwiD-3k8kA:
undetectable		 1hwiD-3k8kA:
21.57
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.
1MXD_A_ACRA735_1
(ALPHA AMYLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		8 / 12 TYR A 114
HIS A 154
ARG A 386
ASP A 388
LYS A 391
GLU A 431
HIS A 497
ASP A 498
 ACT  A 961 ( 4.4A)
ACT  A 961 (-4.8A)
None
ACT  A 961 (-2.8A)
None
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.43A 1mxdA-3k8kA:
26.8		 1mxdA-3k8kA:
22.56
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.
1MXD_A_ACRA735_1
(ALPHA AMYLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		7 / 12 TYR A 114
HIS A 154
PHE A 345
ARG A 386
ASP A 388
HIS A 497
ASP A 498
 ACT  A 961 ( 4.4A)
ACT  A 961 (-4.8A)
ACT  A 961 ( 4.2A)
None
ACT  A 961 (-2.8A)
None
EDO  A 901 (-4.4A)
 1.04A 1mxdA-3k8kA:
26.8		 1mxdA-3k8kA:
22.56
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.
1P33_A_MTXA351_1
(PTERIDINE REDUCTASE
1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 PHE A 405
TYR A 367
TYR A 355
LEU A 387
LEU A 446
 None
 1.22A 1p33A-3k8kA:
undetectable		 1p33A-3k8kA:
17.46
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.
1P33_B_MTXB352_1
(PTERIDINE REDUCTASE
1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 PHE A 405
TYR A 367
TYR A 355
LEU A 387
LEU A 446
 None
 1.16A 1p33B-3k8kA:
undetectable		 1p33B-3k8kA:
17.46
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.
1RJD_A_SAMA801_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 105
ASP A  81
GLY A  84
LEU A 100
LEU A  66
 None
MG  A 700 (-3.3A)
None
None
None
 0.99A 1rjdA-3k8kA:
undetectable		 1rjdA-3k8kA:
18.51
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.
1X7P_B_SAMB302_0
(RRNA
METHYLTRANSFERASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 10 THR A 502
GLY A 536
ILE A 462
LEU A 515
ALA A 516
 None
 1.02A 1x7pA-3k8kA:
undetectable
1x7pB-3k8kA:
3.4		 1x7pA-3k8kA:
16.69
1x7pB-3k8kA:
16.69
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.
2BFM_B_TOPB1290_1
(PTERIDINE REDUCTASE
1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 9 PHE A 405
TYR A 367
TYR A 355
LEU A 387
LEU A 446
 None
 1.32A 2bfmB-3k8kA:
1.8
2bfmC-3k8kA:
0.2		 2bfmB-3k8kA:
18.14
2bfmC-3k8kA:
18.14
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.
2NV4_A_SAMA201_0
(UPF0066 PROTEIN
AF_0241)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A 516
LYS A 505
GLY A 536
LEU A 535
SER A 495
 None
 1.31A 2nv4A-3k8kA:
undetectable		 2nv4A-3k8kA:
12.11
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.
2ZM8_A_ACAA511_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 8 ALA A 369
TYR A 176
ILE A 370
TYR A 355
 None
EDO  A 903 (-4.9A)
None
None
 1.01A 2zm8A-3k8kA:
undetectable		 2zm8A-3k8kA:
20.32
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.
2ZMA_A_ACAA501_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 8 ALA A 369
TYR A 176
ILE A 370
TYR A 355
 None
EDO  A 903 (-4.9A)
None
None
 1.01A 2zmaA-3k8kA:
undetectable		 2zmaA-3k8kA:
20.32
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.
3AIC_A_ACRA5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.62A 3aicA-3k8kA:
6.7		 3aicA-3k8kA:
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.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.64A 3aicB-3k8kA:
6.5		 3aicB-3k8kA:
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.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		7 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
TYR A 114
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
ACT  A 961 ( 4.4A)
 0.66A 3aicC-3k8kA:
6.7		 3aicC-3k8kA:
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.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.70A 3aicD-3k8kA:
6.8		 3aicD-3k8kA:
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.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.70A 3aicE-3k8kA:
6.7		 3aicE-3k8kA:
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.64A 3aicF-3k8kA:
6.7		 3aicF-3k8kA:
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.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.60A 3aicG-3k8kA:
6.7		 3aicG-3k8kA:
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.
3AIC_H_ACRH5044_1
(GLUCOSYLTRANSFERASE-
SI)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 ARG A 386
ASP A 388
ALA A 389
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.2A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.72A 3aicH-3k8kA:
6.7		 3aicH-3k8kA:
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.
3CR4_X_PNTX101_0
(PROTEIN S100-B)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		3 / 3 CYH A 346
HIS A 344
PHE A 345
 None
None
ACT  A 961 ( 4.2A)
 1.17A 3cr4X-3k8kA:
undetectable		 3cr4X-3k8kA:
8.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 GLN A 478
PHE A 470
THR A 610
VAL A 519
THR A 492
 None
 1.16A 3elzA-3k8kA:
undetectable		 3elzA-3k8kA:
12.03
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.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 PHE A 688
THR A 522
VAL A 519
VAL A 660
THR A 667
 None
 1.31A 3elzA-3k8kA:
undetectable		 3elzA-3k8kA:
12.03
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.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 PHE A 688
VAL A 519
VAL A 660
LEU A  47
THR A 667
 None
 1.15A 3elzA-3k8kA:
undetectable		 3elzA-3k8kA:
12.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3K8M_A_ACRA720_1
(ALPHA-AMYLASE, SUSG)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		7 / 7 TYR A 260
GLU A 263
TRP A 287
LEU A 290
TRP A 299
LYS A 304
ASN A 330
 None
None
EDO  A 909 ( 4.1A)
None
None
None
EDO  A 909 ( 4.2A)
 0.31A 3k8mA-3k8kA:
66.4		 3k8mA-3k8kA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3K8M_A_ACRA730_1
(ALPHA-AMYLASE, SUSG)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 5 ARG A 457
TRP A 460
TYR A 469
LYS A 472
ASP A 473
 ACT  A 972 (-3.9A)
ACT  A 972 (-4.1A)
None
None
None
 0.40A 3k8mA-3k8kA:
66.4		 3k8mA-3k8kA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3K8M_B_ACRB820_1
(ALPHA-AMYLASE, SUSG)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		7 / 7 TYR A 260
GLU A 263
TRP A 287
LEU A 290
TRP A 299
LYS A 304
ASN A 330
 None
None
EDO  A 909 ( 4.1A)
None
None
None
EDO  A 909 ( 4.2A)
 0.57A 3k8mB-3k8kA:
65.9		 3k8mB-3k8kA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3K8M_B_ACRB830_1
(ALPHA-AMYLASE, SUSG)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 5 ARG A 457
TRP A 460
TYR A 469
LYS A 472
ASP A 473
 ACT  A 972 (-3.9A)
ACT  A 972 (-4.1A)
None
None
None
 0.35A 3k8mB-3k8kA:
65.9		 3k8mB-3k8kA:
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.
3QEO_B_LLTB261_1
(DEOXYCYTIDINE KINASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 7 LEU A  92
TYR A  64
GLN A 581
LEU A 588
 None
 0.96A 3qeoB-3k8kA:
undetectable		 3qeoB-3k8kA:
17.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUG_A_SUEA1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 5 GLN A 336
PHE A 333
TYR A 261
LYS A 313
 None
 1.43A 3sugA-3k8kA:
undetectable		 3sugA-3k8kA:
15.22
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.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 6 PHE A 470
PHE A 644
ALA A 518
LEU A 494
 None
 0.96A 4ejgD-3k8kA:
undetectable		 4ejgD-3k8kA:
20.49
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.
4FEV_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 7 ASP A 388
ASP A 545
ASP A 498
GLU A 431
 ACT  A 961 (-2.8A)
EDO  A 902 ( 2.7A)
EDO  A 901 (-4.4A)
ACT  A 961 ( 4.3A)
 1.22A 4fevD-3k8kA:
4.2		 4fevD-3k8kA:
17.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 388
ASP A 545
ASP A 498
GLU A 431
 ACT  A 961 (-2.8A)
EDO  A 902 ( 2.7A)
EDO  A 901 (-4.4A)
ACT  A 961 ( 4.3A)
 1.21A 4fewD-3k8kA:
3.0		 4fewD-3k8kA:
17.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LB0_B_ACTB401_0
(UNCHARACTERIZED
PROTEIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 5 VAL A 218
LEU A 222
VAL A 238
PHE A 333
 None
 0.99A 4lb0B-3k8kA:
undetectable		 4lb0B-3k8kA:
19.46
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.
4M7T_A_SAMA503_0
(BTRN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 11 TYR A 150
TYR A 114
HIS A 106
LEU A 148
LEU A 385
 None
ACT  A 961 ( 4.4A)
None
None
None
 1.15A 4m7tA-3k8kA:
3.2		 4m7tA-3k8kA:
16.77
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.
4O4D_A_ACTA406_0
(INOSITOL
HEXAKISPHOSPHATE
KINASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 7 TRP A 349
THR A 157
PHE A 350
SER A 343
 ACT  A 962 (-4.3A)
None
ACT  A 962 ( 4.7A)
None
 1.08A 4o4dA-3k8kA:
undetectable		 4o4dA-3k8kA:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PFJ_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 497
ASP A 498
GLU A 499
LEU A  67
PHE A 452
 None
EDO  A 901 (-4.4A)
None
None
None
 1.44A 4pfjB-3k8kA:
undetectable		 4pfjB-3k8kA:
19.25
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.
4PGF_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 497
ASP A 498
GLU A 499
LEU A  67
PHE A 452
 None
EDO  A 901 (-4.4A)
None
None
None
 1.38A 4pgfB-3k8kA:
undetectable		 4pgfB-3k8kA:
19.25
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.
4WAN_C_ACTC303_0
(BRANCHPOINT-BRIDGING
PROTEIN)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		3 / 3 ASP A 425
ARG A 485
PRO A 447
 None
 0.98A 4wanC-3k8kA:
undetectable		 4wanC-3k8kA:
12.52
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.
4XO7_A_ASDA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 7 VAL A 382
ILE A 146
LEU A 126
LEU A  82
 None
 0.96A 4xo7A-3k8kA:
8.9		 4xo7A-3k8kA:
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.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 617
LYS A 472
ASN A 616
 None
 1.03A 4y1dA-3k8kA:
2.9
4y1dD-3k8kA:
undetectable		 4y1dA-3k8kA:
13.69
4y1dD-3k8kA:
1.02
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.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 ARG A 386
ASP A 388
GLU A 431
HIS A 497
ASP A 498
 None
ACT  A 961 (-2.8A)
ACT  A 961 ( 4.3A)
None
EDO  A 901 (-4.4A)
 0.51A 5csyB-3k8kA:
4.8		 5csyB-3k8kA:
22.54
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.
5ESG_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 4 LEU A  66
TYR A 111
PRO A 104
ILE A 105
 None
EDO  A 908 (-3.9A)
None
None
 1.18A 5esgA-3k8kA:
undetectable		 5esgA-3k8kA:
21.63
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.
5IFU_B_GBMB801_1
(PROLINE--TRNA LIGASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 9 TYR A 150
LEU A 385
ARG A 380
ILE A 378
GLY A 376
 None
None
None
None
EDO  A 911 ( 4.5A)
 1.29A 5ifuB-3k8kA:
undetectable		 5ifuB-3k8kA:
20.57
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.
5IH0_A_ERYA404_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 342
ASN A 354
GLU A 397
PHE A 405
ALA A 361
 None
 1.25A 5ih0A-3k8kA:
undetectable		 5ih0A-3k8kA:
19.20
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.
5K4P_A_SORA611_0
(PROBABLE
PHOSPHATIDYLETHANOLA
MINE TRANSFERASE
MCR-1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		4 / 6 GLY A 362
SER A 364
TYR A 367
GLY A 356
 None
 0.70A 5k4pA-3k8kA:
undetectable		 5k4pA-3k8kA:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L0Z_B_SAMB304_0
(PROBABLE RNA
METHYLTRANSFERASE,
TRMH FAMILY)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 10 THR A 502
GLY A 536
ILE A 462
LEU A 515
ALA A 516
 None
 1.03A 5l0zB-3k8kA:
undetectable		 5l0zB-3k8kA:
19.56
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.
5ZV2_A_LEVA801_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A 659
LEU A 597
ASP A  52
 None
PEG  A 951 ( 4.0A)
None
 0.93A 5zv2A-3k8kA:
undetectable		 5zv2A-3k8kA:
7.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZWR_B_9KLB402_0
(EST-Y29)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 SER A  63
TYR A 427
ILE A 489
TYR A 147
HIS A 526
 None
 1.28A 5zwrB-3k8kA:
undetectable		 5zwrB-3k8kA:
19.85
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.
6A94_A_ZOTA3001_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 2A,SOLUBLE
CYTOCHROME B562)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 135
VAL A  85
GLY A  84
SER A  74
VAL A 122
 None
 1.37A 6a94A-3k8kA:
undetectable		 6a94A-3k8kA:
19.85
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.
6AG0_A_ACRA610_0
(ALPHA-AMYLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		7 / 12 TYR A 114
HIS A 154
ASP A 388
LYS A 391
HIS A 392
HIS A 497
ASP A 498
 ACT  A 961 ( 4.4A)
ACT  A 961 (-4.8A)
ACT  A 961 (-2.8A)
None
None
None
EDO  A 901 (-4.4A)
 0.54A 6ag0A-3k8kA:
25.4		 6ag0A-3k8kA:
8.74
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.
6AG0_A_ACRA610_0
(ALPHA-AMYLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		6 / 12 TYR A 114
HIS A 154
GLU A 397
HIS A 392
HIS A 497
ASP A 498
 ACT  A 961 ( 4.4A)
ACT  A 961 (-4.8A)
None
None
None
EDO  A 901 (-4.4A)
 1.44A 6ag0A-3k8kA:
25.4		 6ag0A-3k8kA:
8.74
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.
6AG0_C_ACRC608_0
(ALPHA-AMYLASE)		 3k8k ALPHA-AMYLASE, SUSG
(Bacteroides
thetaiotaomicron) 		5 / 12 ASP A 388
LYS A 391
HIS A 392
HIS A 497
ASP A 498
 ACT  A 961 (-2.8A)
None
None
None
EDO  A 901 (-4.4A)
 0.41A 6ag0C-3k8kA:
25.5		 6ag0C-3k8kA:
8.74