SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ai7'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A4L_B_DCFB853_2
(ADENOSINE DEAMINASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 HIS A 320
LEU A  71
LEU A 190
GLY A  94
 TPP  A 900 (-4.3A)
None
None
None
 1.06A 1a4lB-3ai7A:
undetectable		 1a4lB-3ai7A:
18.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A7Y_B_DVAB8_0
(ACTINOMYCIN D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 115
THR A 113
PRO A 117
 None
 0.77A 1a7yB-3ai7A:
undetectable		 1a7yB-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQG_A_IBPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 9 VAL A 716
VAL A 674
ILE A 575
SER A 679
LEU A 680
 None
 1.20A 1eqgA-3ai7A:
0.0		 1eqgA-3ai7A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ERR_B_RALB600_2
(ESTROGEN RECEPTOR)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 6 LEU A 157
ASP A 182
MET A  93
HIS A  64
 TPP  A 900 (-4.0A)
CA  A 901 ( 3.0A)
None
None
 1.26A 1errB-3ai7A:
undetectable		 1errB-3ai7A:
14.55
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.
1I3W_E_DVAE8_0
(ACTINOMYCIN D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 115
THR A 113
PRO A 117
 None
 0.87A 1i3wE-3ai7A:
undetectable		 1i3wE-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_G_DVAG2_0
(ACTINOMYCIN D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 113
PRO A 117
THR A 115
 None
 0.86A 1i3wG-3ai7A:
undetectable		 1i3wG-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I7Z_A_COCA301_1
(CHIMERA OF IG KAPPA
CHAIN: HUMAN
CONSTANT REGION AND
MOUSE VARIABLE
REGION)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 8 LEU A 157
LEU A 161
GLU A 186
TRP A 194
 TPP  A 900 (-4.0A)
None
None
None
 1.08A 1i7zA-3ai7A:
undetectable		 1i7zA-3ai7A:
14.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LQT_B_ACTB1868_0
(FPRA)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ALA A 332
HIS A 333
VAL A 336
 None
 0.30A 1lqtB-3ai7A:
2.5		 1lqtB-3ai7A:
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.
1LQU_B_ACTB1425_0
(FPRA)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ALA A 332
HIS A 333
VAL A 336
 None
 0.28A 1lquB-3ai7A:
2.1		 1lquB-3ai7A:
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.
1M00_B_H4BB1760_1
(NITRIC-OXIDE
SYNTHASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TRP A 498
GLU A 487
MET A 511
VAL A 505
 None
 1.21A 1m00A-3ai7A:
undetectable
1m00B-3ai7A:
undetectable		 1m00A-3ai7A:
18.91
1m00B-3ai7A:
18.91
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.
1MX1_D_THAD4_2
(LIVER
CARBOXYLESTERASE I)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 PHE A 296
LEU A  74
MET A  93
 None
 0.86A 1mx1D-3ai7A:
undetectable		 1mx1D-3ai7A:
21.07
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.
1QFI_B_DVAB8_0
(ACTINOMYCIN X2)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 115
THR A 113
PRO A 117
 None
 0.74A 1qfiB-3ai7A:
undetectable		 1qfiB-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_F_DVAF2_0
(7-AMINO-ACTINOMYCIN
D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 113
PRO A 117
THR A 115
 None
 0.81A 1unjF-3ai7A:
undetectable		 1unjF-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_F_DVAF8_0
(7-AMINO-ACTINOMYCIN
D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 115
THR A 113
PRO A 117
 None
 0.85A 1unjF-3ai7A:
undetectable		 1unjF-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_L_DVAL2_0
(7-AMINO-ACTINOMYCIN
D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 113
PRO A 117
THR A 115
 None
 0.84A 1unjL-3ai7A:
undetectable		 1unjL-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_W_DVAW8_0
(7-AMINO-ACTINOMYCIN
D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 115
THR A 113
PRO A 117
 None
 0.85A 1unjW-3ai7A:
undetectable		 1unjW-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNM_E_DVAE2_0
(7-AMINOACTINOMYCIN D)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 THR A 113
PRO A 117
THR A 115
 None
 0.81A 1unmE-3ai7A:
undetectable		 1unmE-3ai7A:
1.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VPT_A_SAMA400_1
(VP39)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ASP A 753
ARG A 781
ASP A 745
 None
 0.83A 1vptA-3ai7A:
undetectable		 1vptA-3ai7A:
17.70
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.
2AOX_A_THAA400_1
(HISTAMINE
N-METHYLTRANSFERASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 8 PHE A 133
TYR A  41
TRP A  65
TRP A 340
 None
 1.12A 2aoxA-3ai7A:
undetectable		 2aoxA-3ai7A:
16.65
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.
2JFA_A_RALA600_2
(ESTROGEN RECEPTOR)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 LEU A 157
ASP A 182
MET A  93
HIS A  64
 TPP  A 900 (-4.0A)
CA  A 901 ( 3.0A)
None
None
 1.16A 2jfaA-3ai7A:
undetectable		 2jfaA-3ai7A:
13.88
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.
2Q63_A_1UNA1001_4
(PROTEASE RETROPEPSIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ASP A 790
ASN A 791
THR A 799
 None
 0.75A 2q63B-3ai7A:
undetectable		 2q63B-3ai7A:
8.37
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.
2QM9_A_TDZA201_1
(FATTY ACID-BINDING
PROTEIN, ADIPOCYTE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 ALA A 603
THR A 414
ALA A 581
ASP A 580
TYR A 592
 None
 1.36A 2qm9A-3ai7A:
undetectable		 2qm9A-3ai7A:
12.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QX4_B_ML1B233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 GLY A 102
THR A 147
PHE A 129
PHE A 130
 None
 1.00A 2qx4A-3ai7A:
undetectable
2qx4B-3ai7A:
3.6		 2qx4A-3ai7A:
13.29
2qx4B-3ai7A:
13.29
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.
2QXS_A_RALA600_2
(ESTROGEN RECEPTOR)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 LEU A 157
ASP A 182
MET A  93
HIS A  64
 TPP  A 900 (-4.0A)
CA  A 901 ( 3.0A)
None
None
 1.24A 2qxsA-3ai7A:
undetectable		 2qxsA-3ai7A:
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.
2QXS_B_RALB600_2
(ESTROGEN RECEPTOR)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 LEU A 157
ASP A 182
MET A  93
HIS A  64
 TPP  A 900 (-4.0A)
CA  A 901 ( 3.0A)
None
None
 1.23A 2qxsB-3ai7A:
undetectable		 2qxsB-3ai7A:
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.
2Y7W_B_SALB1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 THR A 298
PHE A 247
GLY A 250
HIS A 260
ILE A 259
 None
 1.23A 2y7wB-3ai7A:
undetectable		 2y7wB-3ai7A:
13.46
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.
2ZBZ_A_VDXA501_1
(CYTOCHROME P450-SU1)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 11 THR A 330
VAL A  57
LEU A 341
ILE A  37
ALA A 325
 None
 1.14A 2zbzA-3ai7A:
undetectable		 2zbzA-3ai7A:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B0W_B_DGXB1_2
(NUCLEAR RECEPTOR
ROR-GAMMA)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 LEU A 690
VAL A 716
ARG A 723
 None
 0.70A 3b0wB-3ai7A:
undetectable		 3b0wB-3ai7A:
13.77
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.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 LEU A 621
GLY A 624
TRP A 611
ASP A 580
ILE A 655
 None
 1.22A 3eeoA-3ai7A:
undetectable		 3eeoA-3ai7A:
17.17
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.
3HSO_B_H4BB1760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TRP A 498
GLU A 487
MET A 511
VAL A 505
 None
 1.27A 3hsoA-3ai7A:
undetectable
3hsoB-3ai7A:
undetectable		 3hsoA-3ai7A:
19.14
3hsoB-3ai7A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT9_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 MET A 511
VAL A 505
TRP A 498
GLU A 487
 None
 1.22A 3jt9A-3ai7A:
undetectable
3jt9B-3ai7A:
undetectable		 3jt9A-3ai7A:
19.14
3jt9B-3ai7A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSL_A_PZIA800_0
(GLUTAMATE RECEPTOR 2)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TYR A 291
ASN A 285
ASP A 455
SER A 470
 None
 1.22A 3lslA-3ai7A:
undetectable
3lslD-3ai7A:
undetectable		 3lslA-3ai7A:
14.75
3lslD-3ai7A:
14.75
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.
3LSL_D_PZID800_0
(GLUTAMATE RECEPTOR 2)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 SER A 470
TYR A 291
ASN A 285
ASP A 455
 None
 1.19A 3lslA-3ai7A:
undetectable
3lslD-3ai7A:
undetectable		 3lslA-3ai7A:
14.75
3lslD-3ai7A:
14.75
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.
3OKX_B_SAMB201_0
(YAEB-LIKE PROTEIN
RPA0152)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 LYS A 605
ARG A 413
LYS A 452
 None
 1.42A 3okxA-3ai7A:
undetectable		 3okxA-3ai7A:
12.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P4W_D_DSFD319_1
(GLR4197 PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 ILE A 432
TYR A 418
THR A 419
ILE A 422
ILE A 423
 None
 1.21A 3p4wD-3ai7A:
undetectable		 3p4wD-3ai7A:
16.00
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.
3P4W_E_DSFE319_1
(GLR4197 PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 ILE A 432
TYR A 418
THR A 419
ILE A 422
ILE A 423
 None
 1.23A 3p4wE-3ai7A:
2.0		 3p4wE-3ai7A:
16.00
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.
3PP7_B_SVRB499_1
(PYRUVATE KINASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 THR A  68
GLY A  76
TYR A  28
GLY A  99
ALA A 101
 None
 1.49A 3pp7B-3ai7A:
undetectable		 3pp7B-3ai7A:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUD_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 GLN A 606
GLY A 604
ILE A 655
ALA A 647
ALA A 646
 None
 1.00A 3sudC-3ai7A:
undetectable		 3sudC-3ai7A:
13.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUE_A_SUEA1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 GLN A 606
GLY A 604
ILE A 655
ALA A 647
ALA A 646
 None
 1.05A 3sueA-3ai7A:
undetectable		 3sueA-3ai7A:
14.07
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.
3SUE_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 GLY A 158
GLY A 484
SER A 162
ALA A 164
ALA A 167
 None
 1.10A 3sueB-3ai7A:
undetectable		 3sueB-3ai7A:
14.07
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.
3SUF_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 11 GLY A 158
GLY A 484
SER A 162
ALA A 164
ALA A 167
 None
 1.19A 3sufC-3ai7A:
undetectable		 3sufC-3ai7A:
13.94
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.
3T3C_A_017A201_2
(HIV-1 PROTEASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 ALA A 167
VAL A  90
ILE A 151
ALA A 178
VAL A 176
 None
 0.88A 3t3cB-3ai7A:
undetectable		 3t3cB-3ai7A:
8.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3S_D_9PLD1_1
(CYTOCHROME P450 2A13)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 8 PHE A 729
ALA A 645
PHE A 707
ALA A 625
 None
 0.94A 3t3sD-3ai7A:
undetectable		 3t3sD-3ai7A:
21.09
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.
3UCB_B_017B202_1
(PROTEASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TRP A 194
PRO A 210
GLY A  94
PRO A  95
 None
None
None
TPP  A 900 ( 4.6A)
 1.23A 3ucbB-3ai7A:
undetectable		 3ucbB-3ai7A:
8.15
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.
3WSJ_A_MK1A201_2
(PROTEASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 LEU A 644
ALA A 708
VAL A 747
ILE A 655
 None
 0.94A 3wsjB-3ai7A:
undetectable		 3wsjB-3ai7A:
9.30
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.
4A97_A_ZPCA1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 PHE A 504
TYR A 501
ASN A 549
GLU A 479
 None
 1.13A 4a97E-3ai7A:
undetectable		 4a97E-3ai7A:
15.67
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.
4A97_J_ZPCJ1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 8 PHE A 504
TYR A 501
ASN A 549
GLU A 479
 None
 1.10A 4a97I-3ai7A:
undetectable		 4a97I-3ai7A:
15.67
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.
4AC9_C_DXCC1476_0
(MJ0495-LIKE PROTEIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 ILE A 573
ALA A 516
HIS A 571
ARG A 524
 None
 1.35A 4ac9B-3ai7A:
1.8
4ac9C-3ai7A:
2.1		 4ac9B-3ai7A:
19.98
4ac9C-3ai7A:
19.98
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.
4AE1_B_NCAB1536_0
(DIPHTHERIA TOXIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 HIS A 152
GLY A  94
TYR A 159
GLU A 156
 None
 1.44A 4ae1B-3ai7A:
undetectable		 4ae1B-3ai7A:
20.75
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.
4AQ7_A_LEUA902_0
(LEUCINE--TRNA LIGASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 MET A 511
LEU A 512
ASP A 509
HIS A 480
 None
 1.28A 4aq7A-3ai7A:
undetectable		 4aq7A-3ai7A:
21.49
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.
4CX7_B_H4BB600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 8 PHE A 263
HIS A  77
GLU A 268
ILE A 270
 None
 1.36A 4cx7A-3ai7A:
undetectable
4cx7B-3ai7A:
undetectable		 4cx7A-3ai7A:
19.52
4cx7B-3ai7A:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 LEU A 294
LEU A  74
THR A 298
TRP A 302
 None
 1.41A 4do3A-3ai7A:
undetectable		 4do3A-3ai7A:
20.83
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.
4DUB_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 9D7)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 6 ALA A 164
GLY A  94
PRO A  95
VAL A 180
 None
None
TPP  A 900 ( 4.6A)
None
 0.95A 4dubA-3ai7A:
undetectable		 4dubA-3ai7A:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJJ_A_NCTA501_1
(CYTOCHROME P450 2A6)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 PHE A 143
ASN A 374
GLY A 372
ILE A  75
 None
 0.91A 4ejjA-3ai7A:
undetectable		 4ejjA-3ai7A:
19.08
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.
4EQL_A_SALA602_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TYR A 447
THR A 438
ILE A 432
GLY A 416
 None
 0.91A 4eqlA-3ai7A:
undetectable		 4eqlA-3ai7A:
21.95
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.
4EQL_B_SALB602_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TYR A 447
THR A 438
ILE A 432
GLY A 416
 None
 0.95A 4eqlB-3ai7A:
undetectable		 4eqlB-3ai7A:
21.95
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.
4J24_D_ESTD600_1
(ESTROGEN RECEPTOR
BETA)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 ALA A 417
LEU A 443
ILE A 601
LEU A 538
LEU A 585
 None
 1.15A 4j24D-3ai7A:
undetectable		 4j24D-3ai7A:
15.76
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.
4JX1_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 PHE A 430
TYR A 592
LEU A 415
GLY A 416
ILE A 423
 None
 1.14A 4jx1B-3ai7A:
undetectable		 4jx1B-3ai7A:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCH_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TRP A 498
GLU A 487
MET A 511
VAL A 505
 None
 1.25A 4kchA-3ai7A:
undetectable
4kchB-3ai7A:
undetectable		 4kchA-3ai7A:
19.14
4kchB-3ai7A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KT0_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 11 GLY A 181
ALA A 160
GLY A  96
ILE A 598
LEU A 562
 TPP  A 900 (-3.2A)
None
None
None
None
 0.95A 4kt0A-3ai7A:
undetectable
4kt0J-3ai7A:
undetectable		 4kt0A-3ai7A:
21.06
4kt0J-3ai7A:
3.89
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.
4L39_B_SALB601_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TYR A 447
THR A 438
ILE A 432
GLY A 416
 None
 0.93A 4l39B-3ai7A:
undetectable		 4l39B-3ai7A:
21.95
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.
4LB2_A_DM5A601_1
(SERUM ALBUMIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 VAL A 747
PRO A 651
TYR A 712
GLU A 735
 None
 1.02A 4lb2A-3ai7A:
undetectable		 4lb2A-3ai7A:
21.68
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.
4LVC_A_ADNA501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 THR A 223
THR A  67
HIS A  97
LEU A 157
 CA  A 901 ( 4.8A)
TPP  A 900 (-3.4A)
TPP  A 900 (-3.8A)
TPP  A 900 (-4.0A)
 1.41A 4lvcA-3ai7A:
2.1		 4lvcA-3ai7A:
21.11
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.
4MK4_B_CHDB502_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 6 PHE A 729
ILE A 720
ARG A 723
VAL A 672
 None
 1.12A 4mk4B-3ai7A:
3.6		 4mk4B-3ai7A:
17.90
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.
4MK4_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 LEU A 212
ILE A 295
ARG A 297
 None
 0.52A 4mk4B-3ai7A:
3.6		 4mk4B-3ai7A:
17.90
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.
4N49_A_SAMA601_0
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 GLY A  94
PRO A  95
GLY A  96
PHE A 143
LEU A 161
 None
TPP  A 900 ( 4.6A)
None
None
None
 0.95A 4n49A-3ai7A:
undetectable		 4n49A-3ai7A:
19.64
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.
4NKV_D_AERD601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 TYR A  34
GLY A 354
ASP A 351
GLU A 347
 None
 1.02A 4nkvD-3ai7A:
undetectable		 4nkvD-3ai7A:
21.42
Potential target for repurposing, i.e. matched protein structure has less than 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_B_ML1B302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 6 GLY A 110
GLN A 105
ILE A 371
PHE A 143
 None
 1.09A 4qogA-3ai7A:
2.6
4qogB-3ai7A:
3.6		 4qogA-3ai7A:
13.29
4qogB-3ai7A:
13.29
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.
4RZV_B_032B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 PHE A 485
SER A 503
HIS A 553
ASP A 436
 None
 1.26A 4rzvB-3ai7A:
undetectable		 4rzvB-3ai7A:
17.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPN_B_H4BB760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TRP A 498
GLU A 487
MET A 511
VAL A 505
 None
 1.29A 4upnA-3ai7A:
undetectable
4upnB-3ai7A:
2.3		 4upnA-3ai7A:
19.14
4upnB-3ai7A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UYM_B_VORB590_1
(14-ALPHA STEROL
DEMETHYLASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TYR A 291
TYR A 242
ALA A 178
ILE A 168
 None
 0.73A 4uymB-3ai7A:
0.6		 4uymB-3ai7A:
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.
4V3V_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 7 TRP A 498
GLU A 487
MET A 511
VAL A 505
 None
 1.24A 4v3vA-3ai7A:
undetectable
4v3vB-3ai7A:
undetectable		 4v3vA-3ai7A:
19.14
4v3vB-3ai7A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4W5N_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 4 TYR A 107
THR A 113
GLY A 110
LEU A 361
 None
 1.13A 4w5nA-3ai7A:
2.4		 4w5nA-3ai7A:
21.74
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.
4ZJO_D_ERYD1101_0
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 11 TYR A 447
SER A 446
SER A 499
ALA A 603
GLU A 437
 None
 1.30A 4zjoD-3ai7A:
undetectable		 4zjoD-3ai7A:
22.46
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.
4ZME_A_ADNA1002_1
(MYOSIN HEAVY CHAIN
KINASE A)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		6 / 11 PHE A 707
VAL A 716
LEU A 563
LEU A 680
PHE A 577
THR A 559
 None
 1.18A 4zmeA-3ai7A:
undetectable		 4zmeA-3ai7A:
16.36
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.
4ZME_B_ADNB902_1
(MYOSIN HEAVY CHAIN
KINASE A)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 LEU A 563
LEU A 680
LEU A 677
PHE A 577
THR A 559
 None
 1.30A 4zmeB-3ai7A:
undetectable		 4zmeB-3ai7A:
16.36
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.
4ZME_B_ADNB902_1
(MYOSIN HEAVY CHAIN
KINASE A)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		6 / 10 PHE A 707
VAL A 716
LEU A 563
LEU A 680
PHE A 577
THR A 559
 None
 1.18A 4zmeB-3ai7A:
undetectable		 4zmeB-3ai7A:
16.36
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.
5I73_A_68PA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 ILE A 587
ALA A 588
GLY A 648
LEU A 415
GLY A 624
 None
 0.94A 5i73A-3ai7A:
undetectable		 5i73A-3ai7A:
21.54
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.
5IK1_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 5 PHE A 237
LEU A 190
GLY A 181
ILE A 295
 None
None
TPP  A 900 (-3.2A)
None
 0.79A 5ik1A-3ai7A:
undetectable		 5ik1A-3ai7A:
19.54
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.
5L6E_A_SAMA601_1
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 6 ASP A 276
ARG A 203
ASN A 201
GLN A 282
 None
 1.25A 5l6eA-3ai7A:
undetectable		 5l6eA-3ai7A:
13.70
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.
5M5C_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 10 VAL A 642
GLU A 641
ALA A 761
GLY A 666
LEU A 665
 None
 1.14A 5m5cE-3ai7A:
undetectable		 5m5cE-3ai7A:
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.
5MQT_A_STIA302_1
(DEOXYCYTIDINE KINASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 ILE A  40
VAL A  57
MET A  48
GLU A 347
SER A 343
 None
 1.41A 5mqtA-3ai7A:
0.7		 5mqtA-3ai7A:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UHB_C_RFPC1201_2
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 PHE A 577
ASP A 676
LEU A 614
 None
 0.65A 5uhbC-3ai7A:
1.2		 5uhbC-3ai7A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UHC_C_RFPC1201_2
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 PHE A 577
ASP A 676
LEU A 614
 None
 0.78A 5uhcC-3ai7A:
0.8		 5uhcC-3ai7A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WYQ_A_SAMA401_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		5 / 12 GLY A  96
GLY A 155
ILE A  40
GLY A  99
GLY A  98
 None
 1.10A 5wyqA-3ai7A:
undetectable		 5wyqA-3ai7A:
16.29
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.
5Y7P_C_CHDC401_0
(BILE SALT HYDROLASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 8 ILE A 575
ASN A 513
LEU A 519
ALA A 516
 None
 0.83A 5y7pC-3ai7A:
undetectable		 5y7pC-3ai7A:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A7P_B_9SCB601_1
(SERUM ALBUMIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		4 / 6 PHE A 236
TYR A 242
LEU A 190
SER A 196
 None
 1.48A 6a7pB-3ai7A:
undetectable		 6a7pB-3ai7A:
21.68
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.
6ECE_C_DVAC3010_0
(VLM2
DODECADEPSIPEPTIDE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ALA A 164
PHE A 485
GLN A 481
 None
 0.64A 6eceA-3ai7A:
undetectable		 6eceA-3ai7A:
17.03
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.
6FGD_A_ACTA819_0
(GEPHYRIN)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ARG A 370
GLY A 367
GLU A 368
 None
 0.50A 6fgdA-3ai7A:
undetectable		 6fgdA-3ai7A:
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.
6NCS_A_ACTA303_0
(N-ACETYLNEURAMINIC
ACID (SIALIC ACID)
SYNTHETASE)		 3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE
(Bifidobacterium
longum) 		3 / 3 ILE A 270
THR A 269
PRO A 292
 None
 0.58A 6ncsA-3ai7A:
undetectable		 6ncsA-3ai7A:
16.36