SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5mqs'

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.
1HPK_A_ACAA80_1
(PLASMINOGEN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ASP A 385
ASP A 387
TRP A 389
TYR A 115
 None
 1.48A 1hpkA-5mqsA:
undetectable		 1hpkA-5mqsA:
5.71
Potential target for repurposing, i.e. matched protein structure has less than 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)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 MET A 693
LEU A 680
LEU A 723
ILE A 995
VAL A 765
 None
 1.44A 1hrkB-5mqsA:
undetectable		 1hrkB-5mqsA:
15.02
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.
1HWK_A_117A2_2
(HMG-COA REDUCTASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 GLU A 719
ARG A1034
ASN A1023
LEU A1025
LEU A 956
 None
 1.44A 1hwkB-5mqsA:
undetectable		 1hwkB-5mqsA:
18.30
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.
1HWK_B_117B1_1
(HMG-COA REDUCTASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 GLU A 719
ARG A1034
ASN A1023
LEU A1025
LEU A 956
 None
 1.44A 1hwkA-5mqsA:
undetectable		 1hwkA-5mqsA:
18.30
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.
1HWK_C_117C4_2
(HMG-COA REDUCTASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 GLU A 719
ARG A1034
ASN A1023
LEU A1025
LEU A 956
 None
 1.45A 1hwkD-5mqsA:
undetectable		 1hwkD-5mqsA:
18.30
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.
1HWK_D_117D3_1
(HMG-COA REDUCTASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 GLU A 719
ARG A1034
ASN A1023
LEU A1025
LEU A 956
 None
 1.43A 1hwkC-5mqsA:
undetectable		 1hwkC-5mqsA:
18.30
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.
1IG3_B_VIBB501_1
(THIAMIN
PYROPHOSPHOKINASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 7 TRP A 400
LEU A 335
SER A 402
ASN A  54
 None
 1.15A 1ig3A-5mqsA:
undetectable
1ig3B-5mqsA:
undetectable		 1ig3A-5mqsA:
13.72
1ig3B-5mqsA:
13.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OIP_A_VIVA1278_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 TRP A 722
LEU A1046
ILE A1043
LEU A1084
ILE A1086
 None
 1.01A 1oipA-5mqsA:
2.2		 1oipA-5mqsA:
12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OXR_A_AINA141_1
(PHOSPHOLIPASE A2
ISOFORM 3)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 4 LEU A1007
GLY A 937
ASP A 944
TYR A 998
 None
 1.03A 1oxrA-5mqsA:
undetectable		 1oxrA-5mqsA:
7.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PK2_A_ACAA91_1
(TISSUE-TYPE
PLASMINOGEN
ACTIVATOR)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 179
ASP A 182
HIS A 151
LEU A  93
 None
 1.09A 1pk2A-5mqsA:
undetectable		 1pk2A-5mqsA:
7.13
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.
1YA3_B_STRB2001_2
(MINERALOCORTICOID
RECEPTOR)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 LEU A 773
LEU A 779
MET A 846
 None
 0.77A 1ya3B-5mqsA:
undetectable		 1ya3B-5mqsA:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Z9H_B_IMNB381_1
(MEMBRANE-ASSOCIATED
PROSTAGLANDIN E
SYNTHASE-2)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 TYR A 435
PRO A 441
TYR A 115
ILE A 434
LEU A 444
 None
 1.46A 1z9hB-5mqsA:
undetectable		 1z9hB-5mqsA:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Z9H_C_IMNC379_1
(MEMBRANE-ASSOCIATED
PROSTAGLANDIN E
SYNTHASE-2)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 TYR A 435
PRO A 441
TYR A 115
ILE A 434
LEU A 444
 None
 1.45A 1z9hC-5mqsA:
undetectable		 1z9hC-5mqsA:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B25_B_SAMB602_1
(HYPOTHETICAL PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLY A 945
GLU A1001
ASP A 944
 None
 0.63A 2b25B-5mqsA:
undetectable		 2b25B-5mqsA:
15.45
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.
2EIN_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ILE A 717
MET A 775
THR A 776
LEU A 779
 None
 0.98A 2einN-5mqsA:
undetectable
2einW-5mqsA:
undetectable		 2einN-5mqsA:
17.25
2einW-5mqsA:
4.24
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.
2EJT_A_SAMA501_1
(N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 512
ASP A 491
ASP A 494
 None
 0.87A 2ejtA-5mqsA:
undetectable		 2ejtA-5mqsA:
15.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OTH_A_IMNA301_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ASP A 586
TYR A 365
LYS A 176
 None
 1.21A 2othA-5mqsA:
undetectable		 2othA-5mqsA:
7.46
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.
2VQY_A_PARA1201_2
(AAC(6')-IB)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 TRP A 389
GLN A 315
TRP A 400
 None
 1.38A 2vqyA-5mqsA:
undetectable		 2vqyA-5mqsA:
11.46
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.
2X45_B_HSMB1162_1
(ALLERGEN ARG R 1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 874
HIS A 930
GLU A 927
 None
 0.83A 2x45B-5mqsA:
undetectable		 2x45B-5mqsA:
8.03
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.
2X45_C_HSMC1162_1
(ALLERGEN ARG R 1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 874
HIS A 930
GLU A 927
 None
 0.81A 2x45C-5mqsA:
undetectable		 2x45C-5mqsA:
8.03
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.
2XAT_A_CLMA301_0
(XENOBIOTIC
ACETYLTRANSFERASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLY A 996
TYR A1017
SER A1014
 None
 0.64A 2xatA-5mqsA:
undetectable		 2xatA-5mqsA:
10.74
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.
3AG1_W_CHDW1059_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ILE A 717
MET A 775
THR A 776
LEU A 779
 None
 0.98A 3ag1N-5mqsA:
undetectable
3ag1W-5mqsA:
undetectable		 3ag1N-5mqsA:
17.25
3ag1W-5mqsA:
4.24
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.
3AIA_A_SAMA206_0
(UPF0217 PROTEIN
MJ1640)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 LEU A 349
GLY A  33
LEU A  46
SER A  47
 None
 0.96A 3aiaA-5mqsA:
undetectable		 3aiaA-5mqsA:
11.04
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.
3HJO_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE P)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 VAL A 189
VAL A 123
ASN A 169
GLY A 168
 None
 0.86A 3hjoB-5mqsA:
2.0		 3hjoB-5mqsA:
12.38
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.
3KMO_B_EAAB213_1
(GLUTATHIONE
S-TRANSFERASE P)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 7 VAL A 189
VAL A 123
ASN A 169
GLY A 168
 None
 0.84A 3kmoB-5mqsA:
2.0		 3kmoB-5mqsA:
12.38
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.
3KU1_G_SAMG226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ARG A1034
PRO A 898
ALA A 960
LEU A 971
ILE A 911
 None
 1.16A 3ku1G-5mqsA:
undetectable		 3ku1G-5mqsA:
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.
3M7R_A_VDXA425_1
(VITAMIN D3 RECEPTOR)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 537
LEU A 472
SER A 611
SER A 475
GLN A 545
 None
 1.23A 3m7rA-5mqsA:
undetectable		 3m7rA-5mqsA:
12.17
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.
3SFE_C_TMGC1_1
(SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL
SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ILE A 165
TRP A 246
MET A 167
ILE A 205
 None
 1.06A 3sfeB-5mqsA:
undetectable
3sfeC-5mqsA:
undetectable		 3sfeB-5mqsA:
12.74
3sfeC-5mqsA:
7.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUF_B_SUEB1201_3
(NS3 PROTEASE, NS4A
PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 5 SER A 367
ARG A 332
PRO A 370
VAL A 394
 None
PTR  A 372 ( 2.6A)
None
None
 1.38A 3sufC-5mqsA:
undetectable		 3sufC-5mqsA:
12.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UGR_A_IMNA2001_2
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 718
ASN A 896
TYR A 890
TYR A 966
 None
 1.25A 3ugrA-5mqsA:
undetectable		 3ugrA-5mqsA:
15.88
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.
3UQ6_B_ADNB401_2
(ADENOSINE KINASE,
PUTATIVE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 5 LEU A1030
GLY A1029
PHE A1055
ASN A1044
 None
 1.10A 3uq6B-5mqsA:
undetectable		 3uq6B-5mqsA:
17.51
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.
3W1W_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 MET A 693
LEU A 680
LEU A 723
ILE A 995
VAL A 765
 None
 1.37A 3w1wB-5mqsA:
undetectable		 3w1wB-5mqsA:
15.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WIP_A_ACHA301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 346
THR A 321
TYR A 269
TYR A 322
 None
 1.35A 3wipA-5mqsA:
undetectable
3wipB-5mqsA:
undetectable		 3wipA-5mqsA:
12.50
3wipB-5mqsA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WIP_B_ACHB301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 TYR A 346
THR A 321
TYR A 269
TYR A 322
 None
 1.36A 3wipB-5mqsA:
undetectable
3wipC-5mqsA:
undetectable		 3wipB-5mqsA:
12.50
3wipC-5mqsA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WIP_F_ACHF301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 7 TYR A 346
THR A 321
TYR A 269
TYR A 322
 None
 1.34A 3wipF-5mqsA:
undetectable
3wipG-5mqsA:
undetectable		 3wipF-5mqsA:
12.50
3wipG-5mqsA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A6N_A_T1CA392_1
(TETX2 PROTEIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ASN A 169
GLY A 155
ALA A  94
ASN A  76
MET A 399
 None
 1.30A 4a6nA-5mqsA:
undetectable		 4a6nA-5mqsA:
17.04
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.
4A97_J_ZPCJ1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 5 GLU A 638
PHE A 634
TYR A1016
HIS A 683
 None
 1.41A 4a97J-5mqsA:
undetectable		 4a97J-5mqsA:
14.35
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.
4ACB_C_DXCC1477_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 THR A 294
GLY A 292
ARG A  28
ILE A 276
 None
 1.02A 4acbC-5mqsA:
undetectable		 4acbC-5mqsA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AT0_A_ACTA1490_0
(3-KETOSTEROID-DELTA4
-5ALPHA-DEHYDROGENAS
E)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 656
TYR A 624
SER A 628
 None
 0.85A 4at0A-5mqsA:
undetectable		 4at0A-5mqsA:
19.07
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.
4BLV_A_SAMA1281_1
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 HIS A  77
SER A 367
GLU A 397
ASP A 458
 PTR  A 372 ( 4.0A)
None
None
None
 1.39A 4blvA-5mqsA:
undetectable		 4blvA-5mqsA:
13.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEU_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 593
ASP A 455
ASP A 453
ASN A  61
 None
None
CA  A1203 (-2.4A)
None
 1.12A 4feuD-5mqsA:
undetectable		 4feuD-5mqsA:
13.87
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.
4FFW_B_715B801_2
(DIPEPTIDYL PEPTIDASE
4)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A1077
TYR A 346
ASN A 350
 None
 0.79A 4ffwB-5mqsA:
3.7		 4ffwB-5mqsA:
21.36
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.
4G10_A_ACTA301_0
(GLUTATHIONE
S-TRANSFERASE
HOMOLOG)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 PRO A 125
ILE A 147
TYR A 218
TYR A 170
 None
 1.00A 4g10A-5mqsA:
undetectable		 4g10A-5mqsA:
13.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L6V_1_PQN12001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 MET A 523
PHE A 511
GLY A 509
ALA A 480
ALA A 416
 None
 1.15A 4l6v1-5mqsA:
undetectable
4l6v6-5mqsA:
undetectable		 4l6v1-5mqsA:
20.48
4l6v6-5mqsA:
7.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L6V_1_PQN12001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 MET A 806
SER A 809
GLY A 812
GLY A 800
ALA A 833
 None
 1.12A 4l6v1-5mqsA:
undetectable
4l6v6-5mqsA:
undetectable		 4l6v1-5mqsA:
20.48
4l6v6-5mqsA:
7.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LF7_A_PARA1817_1
(16S RRNA
RIBOSOMAL PROTEIN S9
RIBOSOMAL PROTEIN
S10)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 TYR A1017
ARG A1013
SER A1014
 None
 1.21A 4lf7I-5mqsA:
undetectable
4lf7J-5mqsA:
undetectable		 4lf7I-5mqsA:
8.55
4lf7J-5mqsA:
7.77
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.
4LF8_A_PARA1817_1
(16S RRNA
RIBOSOMAL PROTEIN S9
RIBOSOMAL PROTEIN
S10)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 TYR A1017
ARG A1013
SER A1014
 None
 1.21A 4lf8I-5mqsA:
undetectable
4lf8J-5mqsA:
undetectable		 4lf8I-5mqsA:
8.55
4lf8J-5mqsA:
7.77
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.
4QTU_B_SAMB301_0
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLY A 945
ILE A 810
SER A 809
MET A 806
ILE A 947
 None
 1.10A 4qtuB-5mqsA:
undetectable		 4qtuB-5mqsA:
11.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ARG A 576
ARG A 360
ASP A 458
PHE A 457
 None
 1.04A 4xqgA-5mqsA:
undetectable		 4xqgA-5mqsA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ARG A 576
ARG A 360
ASP A 458
PHE A 457
 None
 1.03A 4xqgB-5mqsA:
undetectable		 4xqgB-5mqsA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XYZ_A_ACTA103_0
(POLYUBIQUITIN-C)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 4 LEU A 339
ILE A 410
HIS A1079
VAL A 408
 None
 1.31A 4xyzA-5mqsA:
undetectable		 4xyzA-5mqsA:
5.49
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.
5B1A_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ILE A 490
LEU A 503
ARG A 604
THR A 530
 None
 0.94A 5b1aN-5mqsA:
0.8
5b1aW-5mqsA:
undetectable		 5b1aN-5mqsA:
17.25
5b1aW-5mqsA:
4.24
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.
5DQY_A_BEZA401_0
(THIOREDOXIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ILE A 568
LYS A 465
VAL A 569
GLU A 566
 None
 1.19A 5dqyA-5mqsA:
undetectable		 5dqyA-5mqsA:
6.35
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.
5H8T_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 317
LEU A 339
ALA A 323
ILE A 404
LEU A  81
 None
 1.01A 5h8tA-5mqsA:
undetectable		 5h8tA-5mqsA:
8.85
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.
5HFJ_E_SAME301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ASP A 491
ASP A 453
PRO A 437
SER A 436
TYR A 435
 None
CA  A1203 (-2.4A)
None
None
None
 1.25A 5hfjE-5mqsA:
undetectable		 5hfjE-5mqsA:
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.
5KBW_A_RBFA201_1
(RIBOFLAVIN
TRANSPORTER RIBU)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLU A 445
LEU A 451
LYS A 450
GLY A 481
LEU A 478
 None
 1.11A 5kbwA-5mqsA:
undetectable		 5kbwA-5mqsA:
8.88
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.
5LG3_E_Z80E401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 466
ILE A 568
PHE A 492
ASN A 607
ALA A 535
 None
 0.82A 5lg3E-5mqsA:
undetectable		 5lg3E-5mqsA:
14.35
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.
5LJE_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 317
LEU A 339
ALA A 323
ILE A 404
LEU A  81
 None
 1.11A 5ljeA-5mqsA:
undetectable		 5ljeA-5mqsA:
9.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OWR_A_1N1A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 10)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ALA A 645
GLU A 657
ILE A 646
ASP A 725
 None
 0.72A 5owrA-5mqsA:
undetectable		 5owrA-5mqsA:
13.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SYE_B_TA1B502_1
(TUBULIN BETA CHAIN)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLU A 874
VAL A 884
GLN A 803
ARG A 936
GLY A 813
 None
 1.26A 5syeB-5mqsA:
undetectable		 5syeB-5mqsA:
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.
5TZO_B_7V7B201_2
(ENDO-1,4-BETA-XYLANA
SE A)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A  59
PRO A 456
TYR A 361
 None
 0.80A 5tzoB-5mqsA:
6.0		 5tzoB-5mqsA:
11.24
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.
6AG0_A_ACRA608_0
(ALPHA-AMYLASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 GLY A 509
THR A 506
TYR A 603
TYR A 525
 None
 1.21A 6ag0A-5mqsA:
undetectable		 6ag0A-5mqsA:
5.36
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.
6AG0_C_ACRC606_0
(ALPHA-AMYLASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 GLY A 509
THR A 506
TYR A 603
TYR A 525
 None
 1.21A 6ag0C-5mqsA:
undetectable		 6ag0C-5mqsA:
5.36
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.
6G31_L_ZOLL401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ASP A 458
ASP A 455
ARG A 576
GLN A  56
 None
 1.50A 6g31L-5mqsA:
undetectable		 6g31L-5mqsA:
5.63
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.
6GH9_A_MIXA1003_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 15)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		4 / 5 ASN A 215
TYR A 170
GLY A 171
ASP A 217
 None
 0.90A 6gh9A-5mqsA:
undetectable		 6gh9A-5mqsA:
5.78
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.
6HUP_B_DZPB502_0
(GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1
GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT BETA-3)		 5mqs BETA-L-ARABINOBIOSID
ASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ILE A1031
THR A1021
MET A 959
THR A 957
LEU A1046
 None
 1.16A 6hupA-5mqsA:
undetectable
6hupB-5mqsA:
undetectable		 6hupA-5mqsA:
6.04
6hupB-5mqsA:
4.78