SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5xxo'

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.
1DF7_A_MTXA501_2
(DIHYDROFOLATE
REDUCTASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 TRP A 564
ARG A 558
THR A 563
None
1.00A 1df7A-5xxoA:
1.2
1df7A-5xxoA:
20.13
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.
1GMK_A_DVAA8_0
(GRAMICIDIN A)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 4 VAL A 169
TRP A 435
TRP A 166
None
1.28A 1gmkA-5xxoA:
undetectable
1gmkB-5xxoA:
undetectable
1gmkA-5xxoA:
undetectable
1gmkB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GMK_C_DVAC8_0
(GRAMICIDIN A)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 4 VAL A 169
TRP A 435
TRP A 166
None
1.25A 1gmkC-5xxoA:
undetectable
1gmkD-5xxoA:
undetectable
1gmkC-5xxoA:
undetectable
1gmkD-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HRK_B_CHDB2501_0
(FERROCHELATASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
ILE A 461
VAL A 398
None
1.42A 1hrkB-5xxoA:
3.1
1hrkB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJL_A_SAMA200_0
(METHIONINE REPRESSOR
PROTEIN METJ)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 11 ALA A 425
ARG A 491
LEU A 496
GLU A 499
ALA A 500
None
1.20A 1mjlA-5xxoA:
undetectable
1mjlB-5xxoA:
undetectable
1mjlA-5xxoA:
undetectable
1mjlB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 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_G_AG2G7003_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 6 LEU A  49
ASP A 314
GLY A 281
ARG A 274
None
0.87A 1mt1G-5xxoA:
undetectable
1mt1J-5xxoA:
undetectable
1mt1G-5xxoA:
27.38
1mt1J-5xxoA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 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_H_AG2H7012_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 6 ARG A 274
LEU A  49
ASP A 314
GLY A 281
None
0.89A 1n13H-5xxoA:
undetectable
1n13K-5xxoA:
undetectable
1n13H-5xxoA:
19.83
1n13K-5xxoA:
27.38
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.
1N13_J_AG2J7013_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 7 LEU A  49
ASP A 314
GLY A 281
ARG A 274
None
0.90A 1n13G-5xxoA:
undetectable
1n13J-5xxoA:
undetectable
1n13G-5xxoA:
27.38
1n13J-5xxoA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P62_B_GEOB302_1
(DEOXYCYTIDINE KINASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 11 VAL A 692
TRP A 129
MET A 131
ASP A 176
PHE A 178
None
1.48A 1p62B-5xxoA:
2.8
1p62B-5xxoA:
13.95
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.
1S19_A_MC9A500_0
(VITAMIN D3 RECEPTOR)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 392
LEU A 552
VAL A 551
VAL A 575
LEU A 447
None
1.14A 1s19A-5xxoA:
undetectable
1s19A-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AKE_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 THR A 556
GLY A 557
GLY A 522
THR A 434
GLU A 519
None
1.34A 2akeA-5xxoA:
2.4
2akeA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 11 ALA A 513
ALA A 464
SER A 446
LEU A 447
VAL A 448
None
0.86A 2bxeB-5xxoA:
undetectable
2bxeB-5xxoA:
8.29
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.
2BXG_B_IBPB2002_1
(SERUM ALBUMIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 10 ALA A 513
ALA A 464
SER A 446
LEU A 447
VAL A 448
None
0.81A 2bxgB-5xxoA:
2.3
2bxgB-5xxoA:
8.29
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.
2BXQ_A_IMNA2003_1
(SERUM ALBUMIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 10 ARG A 737
LEU A 736
ILE A 697
PHE A 729
GLY A 713
None
1.42A 2bxqA-5xxoA:
undetectable
2bxqA-5xxoA:
8.29
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.
2KUH_A_HLTA150_1
(CALMODULIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 6 LEU A 770
MET A 671
LEU A 772
GLU A 748
None
0.82A 2kuhA-5xxoA:
undetectable
2kuhA-5xxoA:
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.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
6 / 12 ILE A 150
GLY A  78
GLY A 108
VAL A  76
PRO A 104
PHE A 357
None
1.37A 2okcA-5xxoA:
undetectable
2okcA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OZ7_A_CA4A1_2
(ANDROGEN RECEPTOR)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 6 LEU A 105
MET A  40
MET A  37
LEU A 101
None
None
None
PG4  A 804 (-4.6A)
1.44A 2oz7A-5xxoA:
undetectable
2oz7A-5xxoA:
13.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PNJ_B_CHDB501_0
(FERROCHELATASE,
MITOCHONDRIAL)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
ILE A 461
VAL A 398
None
1.33A 2pnjB-5xxoA:
3.7
2pnjB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_A_CHDA501_0
(FERROCHELATASE,
MITOCHONDRIAL)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
PRO A 549
VAL A 398
None
1.16A 2po7A-5xxoA:
3.9
2po7A-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_B_CHDB501_0
(FERROCHELATASE,
MITOCHONDRIAL)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
PRO A 549
VAL A 398
None
1.17A 2po7B-5xxoA:
3.5
2po7B-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QD4_B_CHDB928_0
(FERROCHELATASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
PRO A 549
VAL A 398
None
1.11A 2qd4B-5xxoA:
3.3
2qd4B-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QHF_A_ACTA509_0
(CHORISMATE SYNTHASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 ARG A 527
GLN A 536
PRO A 533
None
0.84A 2qhfA-5xxoA:
undetectable
2qhfA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WA2_A_SAMA1248_0
(NON-STRUCTURAL
PROTEIN 5)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 GLY A 289
GLY A 321
SER A 291
VAL A 335
ILE A 309
None
1.00A 2wa2A-5xxoA:
undetectable
2wa2A-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XF3_A_J01A500_1
(ORF12)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 10 ILE A 418
LEU A 573
LEU A 451
GLY A 587
ALA A 589
None
1.24A 2xf3A-5xxoA:
undetectable
2xf3A-5xxoA:
11.32
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.
3A50_A_VD3A2001_1
(VITAMIN D
HYDROXYLASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 ILE A 586
ASN A 413
LEU A 447
ILE A 511
ALA A 513
None
1.21A 3a50A-5xxoA:
undetectable
3a50A-5xxoA:
10.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AQI_B_CHDB6_0
(FERROCHELATASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
ILE A 461
VAL A 398
None
1.31A 3aqiB-5xxoA:
2.5
3aqiB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 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_G_SVRG506_3
(PHOSPHOLIPASE A2)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 PRO A 707
PHE A 648
LYS A 709
None
1.25A 3bjwG-5xxoA:
undetectable
3bjwG-5xxoA:
20.51
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.
3EEY_C_SAMC300_0
(PUTATIVE RRNA
METHYLASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 ASN A 468
ASP A 534
ILE A 421
LEU A 496
THR A 546
None
1.16A 3eeyC-5xxoA:
2.9
3eeyC-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_E_SAME300_0
(PUTATIVE RRNA
METHYLASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 ASN A 468
ASP A 534
ILE A 421
LEU A 496
THR A 546
None
1.11A 3eeyE-5xxoA:
undetectable
3eeyE-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 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_B_TMQB612_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 9 VAL A 111
ALA A 138
ILE A 134
SER A 173
ILE A 112
None
1.45A 3hbbB-5xxoA:
undetectable
3hbbB-5xxoA:
11.89
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.
3L2W_A_ELVA397_1
(INTEGRASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 5 ASP A 641
TYR A 646
PRO A 644
GLU A 643
None
1.46A 3l2wA-5xxoA:
undetectable
3l2wA-5xxoA:
14.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSL_A_PZIA802_0
(GLUTAMATE RECEPTOR 2)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 ASP A 316
ASN A  50
SER A 291
None
0.78A 3lslA-5xxoA:
undetectable
3lslD-5xxoA:
undetectable
3lslA-5xxoA:
undetectable
3lslD-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSL_D_PZID802_0
(GLUTAMATE RECEPTOR 2)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 SER A 291
ASP A 316
ASN A  50
None
0.86A 3lslA-5xxoA:
undetectable
3lslD-5xxoA:
undetectable
3lslA-5xxoA:
undetectable
3lslD-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P6H_A_IBPA133_1
(FATTY ACID-BINDING
PROTEIN, ADIPOCYTE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 7 PHE A 729
ILE A 717
VAL A 681
TYR A 659
None
1.06A 3p6hA-5xxoA:
undetectable
3p6hA-5xxoA:
22.07
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.
3V4T_E_ACTE503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 GLN A 610
THR A 561
ASN A 607
None
0.89A 3v4tE-5xxoA:
undetectable
3v4tE-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W1W_A_CHDA1502_0
(FERROCHELATASE,
MITOCHONDRIAL)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 590
PHE A 591
LEU A 410
ILE A 461
VAL A 398
None
1.35A 3w1wA-5xxoA:
3.7
3w1wA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IOM_A_FOLA608_0
(FORMATE--TETRAHYDROF
OLATE LIGASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 7 ALA A 571
LEU A 392
TYR A 654
LEU A 410
None
1.05A 4iomA-5xxoA:
3.8
4iomA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K0B_B_SAMB504_1
(S-ADENOSYLMETHIONINE
SYNTHASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 8 HIS A 113
PRO A 122
ALA A 141
TYR A 191
None
0.94A 4k0bB-5xxoA:
undetectable
4k0bB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L7I_B_SAMB501_1
(S-ADENOSYLMETHIONINE
SYNTHASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 8 HIS A 113
PRO A 122
ALA A 141
TYR A 191
None
0.89A 4l7iB-5xxoA:
undetectable
4l7iB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LUH_A_ACTA610_0
(SERUM ALBUMIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 VAL A 335
SER A 336
THR A 339
None
0.45A 4luhA-5xxoA:
2.6
4luhA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MMC_A_29JA604_1
(TRANSPORTER)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 7 ARG A 767
ILE A 731
PHE A 768
LEU A 736
None
1.07A 4mmcA-5xxoA:
undetectable
4mmcA-5xxoA:
8.54
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.
4OK1_A_198A1001_1
(ANDROGEN RECEPTOR)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 496
GLY A 466
LEU A 514
ILE A 510
VAL A 550
None
1.13A 4ok1A-5xxoA:
undetectable
4ok1A-5xxoA:
13.60
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.
4PEV_B_ADNB501_1
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 ASP A 588
VAL A 594
GLY A 587
PHE A 555
PHE A 390
None
1.34A 4pevB-5xxoA:
4.0
4pevB-5xxoA:
12.56
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.
4QOI_A_ML1A303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 8 PHE A 357
PHE A 282
GLY A  77
ILE A  71
None
0.95A 4qoiA-5xxoA:
5.6
4qoiB-5xxoA:
5.7
4qoiA-5xxoA:
15.64
4qoiB-5xxoA:
15.64
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.
4R3A_B_RBFB402_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 LEU A 410
ALA A 419
ILE A 418
LEU A 447
GLY A 587
None
0.83A 4r3aB-5xxoA:
undetectable
4r3aB-5xxoA:
18.29
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.
4RS0_A_IBPA706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 9 VAL A 553
LEU A 552
LEU A 590
GLY A 422
LEU A 447
None
0.90A 4rs0A-5xxoA:
undetectable
4rs0A-5xxoA:
9.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UHX_A_RTZA3009_1
(ALDEHYDE OXIDASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 8 GLU A 519
SER A 525
ARG A 527
ARG A 478
None
1.21A 4uhxA-5xxoA:
undetectable
4uhxA-5xxoA:
5.04
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.
4ZBQ_A_DIFA601_1
(SERUM ALBUMIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 11 VAL A 535
LEU A 543
GLY A 422
SER A 467
LEU A 497
None
1.19A 4zbqA-5xxoA:
undetectable
4zbqA-5xxoA:
9.13
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.
5BTA_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 7 ASP A 220
ARG A 168
GLY A 522
GLU A 171
None
BGC  A 802 (-3.0A)
None
None
0.86A 5btaA-5xxoA:
undetectable
5btaC-5xxoA:
undetectable
5btaD-5xxoA:
undetectable
5btaA-5xxoA:
9.96
5btaC-5xxoA:
9.96
5btaD-5xxoA:
17.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GWX_A_SAMA301_1
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
3 / 3 ARG A 706
ASN A 233
ASP A 176
None
0.85A 5gwxA-5xxoA:
2.4
5gwxA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HS1_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 8 PHE A 412
ILE A 509
PHE A 591
LEU A 447
None
0.85A 5hs1A-5xxoA:
undetectable
5hs1A-5xxoA:
9.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKR_B_ID8B602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 VAL A 553
LEU A 552
LEU A 590
GLY A 422
LEU A 447
None
1.04A 5ikrB-5xxoA:
undetectable
5ikrB-5xxoA:
10.00
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.
5M45_A_ACTA803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 4 GLU A 516
PRO A 533
ILE A 532
LEU A 560
None
1.31A 5m45A-5xxoA:
undetectable
5m45A-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M45_D_ACTD803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 4 GLU A 516
PRO A 533
ILE A 532
LEU A 560
None
1.35A 5m45D-5xxoA:
undetectable
5m45D-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M45_G_ACTG803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 4 GLU A 516
PRO A 533
ILE A 532
LEU A 560
None
1.32A 5m45G-5xxoA:
undetectable
5m45G-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M6G_A_SORA711_0
(BETA-GLUCOSIDASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
10 / 12 ASP A 110
PHE A 154
ARG A 168
LYS A 207
HIS A 208
MET A 251
TYR A 287
MET A 317
TRP A 435
GLU A 523
BGC  A 802 (-3.0A)
BGC  A 802 (-4.4A)
BGC  A 802 (-3.0A)
BGC  A 802 (-2.9A)
BGC  A 802 (-4.1A)
BGC  A 802 (-3.7A)
None
BGC  A 802 ( 3.8A)
None
BGC  A 802 (-2.6A)
0.43A 5m6gA-5xxoA:
43.5
5m6gA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5O96_A_SAMA501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 11 LEU A 573
GLU A 388
GLY A 598
LEU A 590
VAL A 594
None
1.12A 5o96A-5xxoA:
2.0
5o96B-5xxoA:
undetectable
5o96A-5xxoA:
undetectable
5o96B-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OG9_A_TESA503_1
(-)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 9 LEU A 552
LEU A 514
ILE A 586
LEU A 410
ALA A 425
None
1.33A 5og9A-5xxoA:
undetectable
5og9A-5xxoA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X80_B_SALB203_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 6 PRO A 647
GLY A 649
TYR A 650
ARG A 761
None
0.84A 5x80A-5xxoA:
undetectable
5x80B-5xxoA:
undetectable
5x80A-5xxoA:
18.87
5x80B-5xxoA:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AYC_A_1YNA502_1
(PROTEIN CYP51)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 ALA A 500
PHE A 555
PHE A 390
ALA A 387
LEU A 451
None
1.31A 6aycA-5xxoA:
undetectable
6aycA-5xxoA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6E8Q_A_X2NA602_0
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 GLY A 433
ILE A  88
GLY A 108
HIS A 113
THR A 434
None
1.11A 6e8qA-5xxoA:
undetectable
6e8qA-5xxoA:
24.49
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.
6FGD_A_ACTA824_0
(GEPHYRIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
4 / 4 LEU A 530
ASP A 163
PRO A 164
ARG A 165
None
0.95A 6fgdA-5xxoA:
3.1
6fgdA-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6J20_A_GBQA1201_0
(SUBSTANCE-P
RECEPTOR,ENDOLYSIN)
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron)
5 / 12 ASN A  81
ILE A  57
TYR A 115
ILE A 202
MET A 251
BGC  A 802 ( 4.0A)
None
None
None
BGC  A 802 (-3.7A)
1.32A 6j20A-5xxoA:
undetectable
6j20A-5xxoA:
undetectable