SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wfa'

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.
1D4F_B_ADNB602_1
(S-ADENOSYLHOMOCYSTEI
NE HYDROLASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.42A 1d4fB-3wfaA:
undetectable		 1d4fB-3wfaA:
19.86
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.
1NBH_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 603
GLY A 339
ALA A 342
MET A 334
TYR A 376
 None
 1.40A 1nbhA-3wfaA:
undetectable		 1nbhA-3wfaA:
18.34
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.
1NBH_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 603
GLY A 339
ALA A 342
MET A 334
TYR A 376
 None
 1.40A 1nbhD-3wfaA:
undetectable		 1nbhD-3wfaA:
18.34
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.
1RG7_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A 732
LYS A 674
SER A 722
ILE A 723
LEU A 670
 None
 1.13A 1rg7A-3wfaA:
undetectable		 1rg7A-3wfaA:
13.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2D55_C_DVAC8_0
(ACTINOMYCIN D)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 PRO A 548
THR A 545
PRO A 634
 None
 0.75A 2d55C-3wfaA:
undetectable		 2d55C-3wfaA:
2.95
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.
2DCF_A_ACAA501_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ALA A 601
TYR A 590
TYR A 607
ILE A 328
 None
 1.15A 2dcfA-3wfaA:
undetectable		 2dcfA-3wfaA:
20.08
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.
2DDW_B_PXLB1005_1
(PYRIDOXINE KINASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 270
PRO A 271
HIS A 480
GLY A 188
 None
 0.86A 2ddwB-3wfaA:
2.6		 2ddwB-3wfaA:
16.55
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.
2PH9_A_GNTA301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 492
TYR A 470
TYR A 447
ILE A 502
 EDT  A 802 (-4.8A)
None
None
None
 1.35A 2ph9A-3wfaA:
undetectable
2ph9B-3wfaA:
undetectable		 2ph9A-3wfaA:
15.66
2ph9B-3wfaA:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZM7_A_ACAA501_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ALA A 601
TYR A 590
TYR A 607
ILE A 328
 None
 1.16A 2zm7A-3wfaA:
undetectable		 2zm7A-3wfaA:
19.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_A_ACRA801_1
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		12 / 12 GLU A 194
ASN A 216
SER A 217
ILE A 335
GLU A 391
TRP A 397
PHE A 401
HIS A 437
LYS A 467
GLU A 526
GLU A 532
TYR A 533
 NA  A 801 (-3.0A)
None
None
None
None
None
None
None
None
NA  A 801 (-2.6A)
NA  A 801 (-2.8A)
None
 0.36A 2zq0A-3wfaA:
63.0		 2zq0A-3wfaA:
97.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_A_ACRA801_2
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A 331
TRP A 341
TRP A 400
GLU A 439
VAL A 471
HIS A 507
GLU A 508
PHE A 536
GLY A 537
 None
None
None
None
None
None
NA  A 801 (-3.8A)
None
None
 0.19A 2zq0A-3wfaA:
63.0		 2zq0A-3wfaA:
97.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_A_ACRA801_2
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A 331
TRP A 341
TRP A 400
GLU A 439
VAL A 471
HIS A 507
GLU A 508
PHE A 536
GLY A 538
 None
None
None
None
None
None
NA  A 801 (-3.8A)
None
None
 0.85A 2zq0A-3wfaA:
63.0		 2zq0A-3wfaA:
97.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_B_ACRB811_1
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		12 / 12 GLU A 194
ASN A 216
SER A 217
ILE A 335
TRP A 397
PHE A 401
HIS A 437
LYS A 467
GLU A 508
GLU A 526
GLU A 532
TYR A 533
 NA  A 801 (-3.0A)
None
None
None
None
None
None
None
NA  A 801 (-3.8A)
NA  A 801 (-2.6A)
NA  A 801 (-2.8A)
None
 0.36A 2zq0B-3wfaA:
66.8		 2zq0B-3wfaA:
97.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_B_ACRB811_1
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		6 / 12 GLU A 194
ASN A 216
TRP A 397
HIS A 437
GLU A 508
GLU A 526
 NA  A 801 (-3.0A)
None
None
None
NA  A 801 (-3.8A)
NA  A 801 (-2.6A)
 1.44A 2zq0B-3wfaA:
66.8		 2zq0B-3wfaA:
97.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_B_ACRB811_2
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A 331
TRP A 341
GLU A 391
TRP A 400
GLU A 439
VAL A 471
HIS A 507
PHE A 536
GLY A 537
 None
 0.18A 2zq0B-3wfaA:
66.8		 2zq0B-3wfaA:
97.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZQ0_B_ACRB811_2
(ALPHA-GLUCOSIDASE
(ALPHA-GLUCOSIDASE
SUSB))		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A 331
TRP A 341
GLU A 391
TRP A 400
GLU A 439
VAL A 471
HIS A 507
PHE A 536
GLY A 538
 None
 0.85A 2zq0B-3wfaA:
66.8		 2zq0B-3wfaA:
97.29
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.
3AIC_F_ACRF5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 LEU A 547
TRP A 185
TYR A 542
 None
 1.01A 3aicF-3wfaA:
undetectable		 3aicF-3wfaA:
21.38
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.
3AIC_G_ACRG5044_2
(GLUCOSYLTRANSFERASE-
SI)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 LEU A 547
TRP A 185
TYR A 542
 None
 1.00A 3aicG-3wfaA:
4.4		 3aicG-3wfaA:
21.38
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.
3AY0_A_ADNA401_1
(UNCHARACTERIZED
PROTEIN MJ0883)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 10 TYR A 197
ILE A 205
ALA A 212
LEU A 231
PHE A 265
 None
 1.12A 3ay0A-3wfaA:
2.2		 3ay0A-3wfaA:
18.33
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.
3CCF_B_BEZB261_0
(CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASN A 461
TRP A 393
PHE A 418
TYR A 463
 None
 1.47A 3ccfB-3wfaA:
undetectable		 3ccfB-3wfaA:
18.13
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.
3DDY_A_RBFA187_1
(LUMAZINE PROTEIN)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 VAL A 541
ASP A 683
ALA A 713
THR A 662
ASN A 659
 None
 1.17A 3ddyA-3wfaA:
undetectable		 3ddyA-3wfaA:
14.29
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.
3DH0_B_SAMB300_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 589
GLY A 717
VAL A 541
ALA A 584
THR A 582
 None
 1.14A 3dh0B-3wfaA:
undetectable		 3dh0B-3wfaA:
15.29
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.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 THR A  60
VAL A 129
LEU A 127
ILE A 142
TYR A 155
 None
 1.41A 3elzA-3wfaA:
undetectable		 3elzA-3wfaA:
11.30
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.
3ELZ_B_CHDB150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 THR A  60
VAL A 129
LEU A 127
ILE A 142
TYR A 155
 None
 1.40A 3elzB-3wfaA:
undetectable		 3elzB-3wfaA:
11.30
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.
3ELZ_C_CHDC150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 THR A  60
VAL A 129
LEU A 127
ILE A 142
TYR A 155
 None
 1.34A 3elzC-3wfaA:
2.2		 3elzC-3wfaA:
11.30
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.
3HBB_C_TMQC613_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 VAL A 652
ALA A 588
LEU A 709
ILE A 721
THR A 592
 None
 1.07A 3hbbC-3wfaA:
2.2		 3hbbC-3wfaA:
20.70
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.
3HKU_A_TORA300_1
(CARBONIC ANHYDRASE 2)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A 713
HIS A 661
PHE A 667
LEU A 630
THR A 639
 None
 1.08A 3hkuA-3wfaA:
undetectable		 3hkuA-3wfaA:
16.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WFA_B_EDTB802_0
(ALPHA-GLUCOSIDASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ASP A 250
ASN A 488
TYR A 492
LYS A 495
 EDT  A 802 ( 4.5A)
EDT  A 802 (-2.7A)
EDT  A 802 (-4.8A)
EDT  A 802 (-2.7A)
 0.48A 3wfaA-3wfaA:
72.0
3wfaB-3wfaA:
63.0		 3wfaA-3wfaA:
100.00
3wfaB-3wfaA:
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.
4AFG_C_QMRC1214_1
(CAPITELLA TELETA
ACHBP)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 8 VAL A 466
TYR A 327
ILE A 502
ILE A 523
 None
 1.02A 4afgD-3wfaA:
undetectable
4afgE-3wfaA:
undetectable		 4afgD-3wfaA:
16.50
4afgE-3wfaA:
16.50
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.
4AQ7_A_LEUA902_0
(LEUCINE--TRNA LIGASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 7 LEU A 239
ASP A 295
SER A 294
GLU A 633
 None
 1.23A 4aq7A-3wfaA:
undetectable		 4aq7A-3wfaA:
22.63
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.
4BUP_B_SAMB500_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 HIS A 255
GLU A 245
ASN A 487
 None
 1.01A 4bupB-3wfaA:
undetectable		 4bupB-3wfaA:
16.85
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.
4G8Z_X_TOPX301_1
(DIHYDROFOLATE
REDUCTASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 10 ILE A 723
LEU A 630
PHE A 667
SER A 663
ILE A 721
 None
 1.25A 4g8zX-3wfaA:
undetectable		 4g8zX-3wfaA:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M2X_A_TMQA202_2
(DIHYDROFOLATE
REDUCTASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 TRP A 268
GLN A 193
THR A 270
 None
 0.81A 4m2xA-3wfaA:
undetectable		 4m2xA-3wfaA:
12.41
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.
4MI4_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 7 GLU A 170
GLU A 171
GLU A 266
ARG A 289
 None
 1.15A 4mi4B-3wfaA:
undetectable
4mi4C-3wfaA:
undetectable		 4mi4B-3wfaA:
15.61
4mi4C-3wfaA:
15.61
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.
4MJ8_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 8 GLU A 170
GLU A 171
GLU A 266
ARG A 289
 None
 1.14A 4mj8B-3wfaA:
undetectable
4mj8C-3wfaA:
undetectable		 4mj8B-3wfaA:
15.04
4mj8C-3wfaA:
15.04
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.
4P7N_A_GCSA702_1
(POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
N-DEACETYLASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ASP A 602
TYR A 607
TRP A 332
 None
 1.36A 4p7nA-3wfaA:
5.0		 4p7nA-3wfaA:
19.24
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.
4QOG_A_ML1A302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ILE A 328
PHE A 614
GLY A 384
ILE A 432
 None
 0.95A 4qogA-3wfaA:
undetectable
4qogB-3wfaA:
undetectable		 4qogA-3wfaA:
14.17
4qogB-3wfaA:
14.17
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.
4RVD_A_SAMA502_0
(D-MYCAROSE
3-C-METHYLTRANSFERAS
E)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 328
GLY A 329
ALA A 368
PHE A 379
VAL A 388
 None
 1.13A 4rvdA-3wfaA:
undetectable		 4rvdA-3wfaA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RVG_A_SAMA503_0
(D-MYCAROSE
3-C-METHYLTRANSFERAS
E)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 328
GLY A 329
ALA A 368
PHE A 379
VAL A 388
 None
 1.12A 4rvgA-3wfaA:
undetectable		 4rvgA-3wfaA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UCK_A_SAMA2409_0
(RNA-DIRECTED RNA
POLYMERASE L)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		6 / 12 THR A 544
GLY A 718
GLY A 716
GLY A 657
THR A 697
ALA A 584
 None
 1.43A 4uckA-3wfaA:
undetectable		 4uckA-3wfaA:
20.41
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.
4ZE0_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 9 PHE A 616
GLY A 653
THR A 639
LEU A 665
LEU A 709
 None
 1.24A 4ze0A-3wfaA:
undetectable		 4ze0A-3wfaA:
21.41
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.
4ZME_A_ADNA1002_1
(MYOSIN HEAVY CHAIN
KINASE A)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 GLY A 660
LEU A 630
GLU A 631
LEU A 665
THR A 639
 None
 1.16A 4zmeA-3wfaA:
undetectable		 4zmeA-3wfaA:
16.03
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.
5CVT_B_ACTB200_0
(N5-CARBOXYAMINOIMIDA
ZOLE RIBONUCLEOTIDE
MUTASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ASN A 369
ALA A 371
ARG A 375
 None
 0.45A 5cvtB-3wfaA:
2.1		 5cvtB-3wfaA:
14.53
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.
5F9Z_A_HFGA702_0
(AMINOACYL-TRNA
SYNTHETASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 389
GLY A 392
GLU A 508
PHE A 409
GLY A 472
 None
None
NA  A 801 (-3.8A)
None
None
 1.29A 5f9zA-3wfaA:
undetectable		 5f9zA-3wfaA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FHZ_D_READ602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 168
GLU A 170
ASN A 285
CYH A 284
LEU A  92
 None
 1.44A 5fhzD-3wfaA:
undetectable		 5fhzD-3wfaA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_A_ADNA501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8A-3wfaA:
undetectable		 5hm8A-3wfaA:
22.55
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.
5HM8_B_ADNB501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8B-3wfaA:
undetectable		 5hm8B-3wfaA:
22.55
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.
5HM8_C_ADNC501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8C-3wfaA:
undetectable		 5hm8C-3wfaA:
22.55
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.
5HM8_D_ADND501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8D-3wfaA:
undetectable		 5hm8D-3wfaA:
22.55
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.
5HM8_E_ADNE501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.45A 5hm8E-3wfaA:
undetectable		 5hm8E-3wfaA:
22.55
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.
5HM8_F_ADNF501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8F-3wfaA:
undetectable		 5hm8F-3wfaA:
22.55
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.
5HM8_G_ADNG501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8G-3wfaA:
2.2		 5hm8G-3wfaA:
22.55
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.
5HM8_H_ADNH501_1
(ADENOSYLHOMOCYSTEINA
SE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 597
ASP A 558
HIS A 507
LEU A 389
GLY A 329
 None
 1.46A 5hm8H-3wfaA:
undetectable		 5hm8H-3wfaA:
22.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HQA_A_ACRA705_1
(ALPHA-GLUCOSIDASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		9 / 12 GLU A 194
GLU A 391
TRP A 397
HIS A 437
LYS A 467
VAL A 471
GLU A 508
GLU A 526
GLU A 532
 NA  A 801 (-3.0A)
None
None
None
None
None
NA  A 801 (-3.8A)
NA  A 801 (-2.6A)
NA  A 801 (-2.8A)
 0.19A 5hqaA-3wfaA:
54.6		 5hqaA-3wfaA:
41.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HQA_A_ACRA705_1
(ALPHA-GLUCOSIDASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLU A 526
TRP A 397
GLU A 532
GLU A 194
GLU A 508
 NA  A 801 (-2.6A)
None
NA  A 801 (-2.8A)
NA  A 801 (-3.0A)
NA  A 801 (-3.8A)
 1.40A 5hqaA-3wfaA:
54.6		 5hqaA-3wfaA:
41.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HQA_A_ACRA705_2
(ALPHA-GLUCOSIDASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		6 / 8 ASN A 216
TRP A 331
TRP A 341
TRP A 400
GLU A 439
HIS A 507
 None
 0.68A 5hqaA-3wfaA:
54.6		 5hqaA-3wfaA:
41.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HQA_A_ACRA705_2
(ALPHA-GLUCOSIDASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 8 ASN A 216
TRP A 400
PHE A 401
GLU A 439
HIS A 507
 None
 1.46A 5hqaA-3wfaA:
54.6		 5hqaA-3wfaA:
41.26
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.
5LF3_K_BO2K305_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-1)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.92A 5lf3K-3wfaA:
undetectable
5lf3L-3wfaA:
undetectable		 5lf3K-3wfaA:
14.16
5lf3L-3wfaA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF3_Y_BO2Y305_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-1)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.92A 5lf3Y-3wfaA:
undetectable
5lf3Z-3wfaA:
undetectable		 5lf3Y-3wfaA:
14.16
5lf3Z-3wfaA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF7_K_6V8K305_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-5)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.88A 5lf7K-3wfaA:
undetectable
5lf7L-3wfaA:
undetectable		 5lf7K-3wfaA:
14.16
5lf7L-3wfaA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF7_Y_6V8Y306_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-5)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.87A 5lf7Y-3wfaA:
undetectable
5lf7Z-3wfaA:
undetectable		 5lf7Y-3wfaA:
14.16
5lf7Z-3wfaA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TL8_A_X2NA502_2
(PROTEIN CYP51)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 6 TYR A 240
PRO A 548
LEU A 547
LEU A 301
 None
 1.08A 5tl8A-3wfaA:
undetectable		 5tl8A-3wfaA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TRQ_B_ACTB306_0
(WELO5)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 126
ARG A 145
TYR A 124
 None
 0.65A 5trqB-3wfaA:
undetectable		 5trqB-3wfaA:
17.78
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.
5TZO_B_7V7B201_1
(ENDO-1,4-BETA-XYLANA
SE A)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 491
VAL A 249
TRP A 288
ALA A 246
ALA A 247
 None
 1.14A 5tzoB-3wfaA:
undetectable		 5tzoB-3wfaA:
13.36
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.
5UXD_A_ZITA501_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E MPHH)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 124
PHE A 147
ALA A 246
GLY A 514
 None
 1.00A 5uxdA-3wfaA:
undetectable		 5uxdA-3wfaA:
17.36
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.
5WBV_A_SAMA402_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 HIS A 255
GLU A 245
ASN A 487
 None
 0.99A 5wbvA-3wfaA:
undetectable		 5wbvA-3wfaA:
17.29
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.
5WBV_B_SAMB402_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		3 / 3 HIS A 255
GLU A 245
ASN A 487
 None
 0.99A 5wbvB-3wfaA:
undetectable		 5wbvB-3wfaA:
17.29
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.
5WM7_A_ACTA603_0
(SALICYLATE-AMP
LIGASE)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		4 / 4 THR A 545
THR A 655
ALA A 656
ARG A 585
 None
 1.47A 5wm7A-3wfaA:
2.1		 5wm7A-3wfaA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HWD_K_BO2K301_0
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.82A 6hwdK-3wfaA:
undetectable
6hwdL-3wfaA:
undetectable		 6hwdK-3wfaA:
8.18
6hwdL-3wfaA:
8.00
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.
6HWD_Y_BO2Y301_0
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3wfa ALPHA-GLUCOSIDASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 695
GLY A 718
GLY A 717
ALA A 714
ASP A 688
 None
 0.81A 6hwdY-3wfaA:
undetectable
6hwdZ-3wfaA:
undetectable		 6hwdY-3wfaA:
8.18
6hwdZ-3wfaA:
8.00