SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1ile'

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.
1AV2_D_DVAD6_0
(GRAMICIDIN A)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 TRP A 679
ALA A 797
VAL A 799
 None
 0.99A 1av2C-1ileA:
undetectable
1av2D-1ileA:
undetectable		 1av2C-1ileA:
1.97
1av2D-1ileA:
1.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		6 / 12 HIS A  57
GLY A  56
SER A 521
GLY A 551
GLN A 554
HIS A 581
 None
 1.21A 1ffyA-1ileA:
32.9		 1ffyA-1ileA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		8 / 12 PRO A  46
GLY A  56
SER A 521
GLY A 551
ASP A 553
GLN A 554
HIS A 581
MET A 592
 None
 0.86A 1ffyA-1ileA:
32.9		 1ffyA-1ileA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		8 / 12 PRO A  46
HIS A  54
GLY A  56
SER A 521
GLY A 551
GLN A 554
HIS A 581
MET A 592
 None
 0.73A 1ffyA-1ileA:
32.9		 1ffyA-1ileA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FFY_A_MRCA1993_2
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 6 PRO A  47
HIS A  57
TRP A 518
GLU A 550
TRP A 558
 None
 0.56A 1ffyA-1ileA:
32.9		 1ffyA-1ileA:
30.94
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.
1HMY_A_SAMA328_0
(HAEIII
METHYLTRANSFERASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 8 PHE A 209
ILE A 226
THR A 228
PRO A 292
 None
 0.86A 1hmyA-1ileA:
undetectable		 1hmyA-1ileA:
15.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JZS_A_MRCA1301_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		11 / 11 GLY A  45
PRO A  46
HIS A  54
HIS A  57
SER A 521
GLU A 550
GLY A 551
ASP A 553
GLN A 554
LEU A 583
ILE A 584
 None
 0.51A 1jzsA-1ileA:
50.0		 1jzsA-1ileA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N13_B_AG2B7011_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 GLU A 745
ARG A 726
LEU A 681
ASP A 677
 None
 1.19A 1n13B-1ileA:
0.0
1n13C-1ileA:
0.0		 1n13B-1ileA:
8.16
1n13C-1ileA:
5.69
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.
1NT2_A_SAMA301_1
(FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 THR A 278
GLU A 261
ASP A 313
 None
 0.87A 1nt2A-1ileA:
undetectable		 1nt2A-1ileA:
15.41
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.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 11 HIS A  54
GLY A  56
HIS A  57
GLY A 551
ASP A 553
 None
 0.87A 1pg2A-1ileA:
19.4		 1pg2A-1ileA:
22.47
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.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 11 HIS A  54
HIS A  57
GLY A 551
ASP A 553
HIS A 581
 None
 0.84A 1pg2A-1ileA:
19.4		 1pg2A-1ileA:
22.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		6 / 12 HIS A  57
GLY A  56
SER A 521
GLY A 551
GLN A 554
HIS A 581
 None
 1.21A 1qu2A-1ileA:
32.9		 1qu2A-1ileA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		9 / 12 PRO A  46
GLY A  56
HIS A  57
SER A 521
GLY A 551
ASP A 553
GLN A 554
HIS A 581
MET A 592
 None
 0.82A 1qu2A-1ileA:
32.9		 1qu2A-1ileA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		9 / 12 PRO A  46
HIS A  54
GLY A  56
HIS A  57
SER A 521
GLY A 551
GLN A 554
HIS A 581
MET A 592
 None
 0.69A 1qu2A-1ileA:
32.9		 1qu2A-1ileA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QU3_A_MRCA993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		8 / 12 HIS A  54
GLY A  56
HIS A  57
SER A 521
GLU A 550
ASP A 553
GLN A 554
HIS A 581
 None
 0.86A 1qu3A-1ileA:
29.1		 1qu3A-1ileA:
30.94
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.
1W5U_B_DVAB6_0
(GRAMICIDIN D)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 TRP A 679
ALA A 797
VAL A 799
 None
 1.00A 1w5uA-1ileA:
undetectable
1w5uB-1ileA:
undetectable		 1w5uA-1ileA:
1.97
1w5uB-1ileA:
1.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XDK_B_9CRB600_2
(RETINOIC ACID
RECEPTOR, BETA)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 LEU A 101
PHE A 115
ARG A 391
 None
 0.71A 1xdkB-1ileA:
0.0		 1xdkB-1ileA:
17.18
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.
2A1M_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 7 PHE A 209
TYR A 289
GLY A 236
THR A 233
 None
 0.96A 2a1mA-1ileA:
0.0		 2a1mA-1ileA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BM9_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 LEU A 695
ARG A 615
ASP A 612
ALA A 754
ALA A 762
 None
 1.06A 2bm9A-1ileA:
undetectable		 2bm9A-1ileA:
13.90
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.
2BR4_A_SAMA301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 LYS A 341
ASP A 174
ASP A 443
 None
 0.96A 2br4A-1ileA:
undetectable		 2br4A-1ileA:
13.90
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.
2IZQ_A_DVAA6_0
(GRAMICIDIN D)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ALA A 797
VAL A 799
TRP A 679
 None
 1.00A 2izqA-1ileA:
undetectable
2izqB-1ileA:
undetectable		 2izqA-1ileA:
1.97
2izqB-1ileA:
1.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PKK_A_2FAA501_2
(ADENOSINE KINASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 4 ALA A 240
VAL A 238
PHE A 302
THR A 331
 None
 1.39A 2pkkA-1ileA:
undetectable		 2pkkA-1ileA:
17.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QD4_A_CHDA803_0
(FERROCHELATASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 LEU A 162
LEU A 456
ILE A 515
ARG A 448
 None
 0.77A 2qd4A-1ileA:
undetectable		 2qd4A-1ileA:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 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_ACTA502_0
(CHORISMATE SYNTHASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 GLY A 314
ASP A 313
SER A 310
 None
 0.74A 2qhfA-1ileA:
undetectable		 2qhfA-1ileA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2UVN_B_ECNB1406_1
(CYTOCHROME P450 130)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 11 PRO A 292
PRO A 291
GLY A 236
THR A 342
VAL A 351
 None
 1.16A 2uvnB-1ileA:
1.0		 2uvnB-1ileA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VXA_K_RBFK200_1
(DODECIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 8 HIS A 388
ARG A 183
TYR A 358
ARG A 360
 None
 1.46A 2vxaH-1ileA:
0.0
2vxaJ-1ileA:
0.0
2vxaK-1ileA:
0.0		 2vxaH-1ileA:
6.90
2vxaJ-1ileA:
6.90
2vxaK-1ileA:
6.90
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.
2VXA_L_RBFL200_1
(DODECIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 8 HIS A 388
ARG A 183
TYR A 358
ARG A 360
 None
 1.45A 2vxaA-1ileA:
0.0
2vxaK-1ileA:
0.0
2vxaL-1ileA:
0.0		 2vxaA-1ileA:
6.90
2vxaK-1ileA:
6.90
2vxaL-1ileA:
6.90
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.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		6 / 11 HIS A  54
GLY A  56
HIS A  57
GLY A 551
ASP A 553
HIS A 581
 None
 0.85A 2x1lA-1ileA:
21.4		 2x1lA-1ileA:
23.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_B_ADNB601_1
(METHIONYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		6 / 12 HIS A  54
GLY A  56
HIS A  57
GLY A 551
ASP A 553
HIS A 581
 None
 0.86A 2x1lB-1ileA:
21.6		 2x1lB-1ileA:
23.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		6 / 11 HIS A  54
GLY A  56
HIS A  57
GLY A 551
ASP A 553
HIS A 581
 None
 0.81A 2x1lC-1ileA:
21.5		 2x1lC-1ileA:
23.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CYX_A_ROCA201_4
(HIV-1 PROTEASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 4 LEU A 329
ASP A 443
VAL A 178
THR A 401
 None
 1.21A 3cyxB-1ileA:
0.0		 3cyxB-1ileA:
8.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D9L_A_ACTA501_0
(CTD-PEPTIDE
RNA-BINDING PROTEIN
16)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 PRO A  79
PRO A  68
TYR A  40
TYR A  76
 None
 1.31A 3d9lA-1ileA:
undetectable
3d9lY-1ileA:
undetectable		 3d9lA-1ileA:
11.08
3d9lY-1ileA:
1.46
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.
3FPJ_A_SAMA301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 6 TYR A 382
GLY A 314
THR A 229
GLU A 261
 None
 1.07A 3fpjA-1ileA:
undetectable		 3fpjA-1ileA:
17.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SAN_A_ZMRA901_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 ASP A 496
ARG A 510
ARG A 509
TRP A 459
 None
 1.49A 3sanA-1ileA:
undetectable		 3sanA-1ileA:
17.74
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.
3SAN_B_ZMRB901_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 ASP A 496
ARG A 510
ARG A 509
TRP A 459
 None
 1.48A 3sanB-1ileA:
undetectable		 3sanB-1ileA:
17.74
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.
3TGV_C_BEZC1_0
(HEME-BINDING PROTEIN
HUTZ)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 TYR A 293
PHE A 354
PRO A 353
LEU A 349
 None
 1.41A 3tgvC-1ileA:
0.0		 3tgvC-1ileA:
10.84
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.
4B7N_A_ZMRA601_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A 510
ARG A 509
TRP A 459
 None
 1.01A 4b7nA-1ileA:
undetectable		 4b7nA-1ileA:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_A_ZMRA1471_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 ASP A 496
ARG A 510
ARG A 509
TRP A 459
 None
 1.49A 4cpzA-1ileA:
undetectable		 4cpzA-1ileA:
19.02
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.
4CPZ_B_ZMRB1471_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 4 ASP A 496
ARG A 510
ARG A 509
TRP A 459
 None
 1.49A 4cpzB-1ileA:
undetectable		 4cpzB-1ileA:
19.02
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.
4CPZ_C_ZMRC1470_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A 510
ARG A 509
TRP A 459
 None
 1.07A 4cpzC-1ileA:
undetectable		 4cpzC-1ileA:
19.02
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.
4CPZ_E_ZMRE1471_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A 510
ARG A 509
TRP A 459
 None
 1.06A 4cpzE-1ileA:
undetectable		 4cpzE-1ileA:
19.02
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.
4CPZ_F_ZMRF1470_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A 510
ARG A 509
TRP A 459
 None
 1.05A 4cpzF-1ileA:
undetectable		 4cpzF-1ileA:
19.02
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.
4CPZ_G_ZMRG1471_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A 510
ARG A 509
TRP A 459
 None
 1.00A 4cpzG-1ileA:
undetectable		 4cpzG-1ileA:
19.02
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.
4CPZ_H_ZMRH1470_2
(NEURAMINIDASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A 510
ARG A 509
TRP A 459
 None
 1.05A 4cpzH-1ileA:
undetectable		 4cpzH-1ileA:
19.02
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.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 LEU A 438
LEU A 441
MET A 568
TRP A 444
 None
 1.22A 4do3A-1ileA:
undetectable		 4do3A-1ileA:
21.78
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.
4NOS_D_H4BD3011_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 6 PHE A 133
GLU A 135
ARG A  61
ILE A 606
 None
 1.49A 4nosC-1ileA:
0.0
4nosD-1ileA:
0.0		 4nosC-1ileA:
20.78
4nosD-1ileA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NX6_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 4 ILE A 155
ASP A 520
ARG A 510
THR A 149
 None
 1.19A 4nx6A-1ileA:
undetectable		 4nx6A-1ileA:
10.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NX7_A_FOLA202_1
(DIHYDROFOLATE
REDUCTASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 4 ILE A 155
ASP A 520
ARG A 510
THR A 149
 None
 1.21A 4nx7A-1ileA:
undetectable		 4nx7A-1ileA:
10.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ODO_B_FK5B203_2
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ALA A 704
GLN A  59
GLY A  56
 None
 0.65A 4odoC-1ileA:
undetectable		 4odoC-1ileA:
11.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_C_377C401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 6 TYR A  40
GLU A 696
TYR A  70
LEU A  66
 None
 1.30A 4twdB-1ileA:
3.7
4twdC-1ileA:
3.6		 4twdB-1ileA:
16.67
4twdC-1ileA:
16.67
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.
4TWD_E_377E401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 6 TYR A  40
GLU A 696
TYR A  70
LEU A  66
 None
 1.30A 4twdD-1ileA:
3.5
4twdE-1ileA:
3.7		 4twdD-1ileA:
16.67
4twdE-1ileA:
16.67
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.
4TWD_F_377F401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 7 GLU A  44
LEU A  66
PHE A 547
TYR A 139
 None
 1.15A 4twdF-1ileA:
0.0
4twdJ-1ileA:
2.4		 4twdF-1ileA:
16.67
4twdJ-1ileA:
16.67
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.
4Y8W_A_STRA604_1
(CYTOCHROME P450
21-HYDROXYLASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 VAL A 781
VAL A 770
LEU A 769
VAL A 649
LEU A 646
 None
 1.03A 4y8wA-1ileA:
undetectable		 4y8wA-1ileA:
21.85
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.
4Y8W_B_STRB603_1
(CYTOCHROME P450
21-HYDROXYLASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 VAL A 781
VAL A 770
LEU A 769
VAL A 649
LEU A 646
 None
 1.01A 4y8wB-1ileA:
undetectable		 4y8wB-1ileA:
21.85
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.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 LEU A 753
GLU A 693
VAL A 691
ARG A 690
GLU A 713
 None
 1.36A 4ydqA-1ileA:
undetectable		 4ydqA-1ileA:
20.10
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.
4YV5_A_SVRA205_2
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 6 PHE A 710
LEU A 646
ASN A 648
ARG A 683
 None
 1.41A 4yv5B-1ileA:
undetectable		 4yv5B-1ileA:
9.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z90_F_4LEF402_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 7 LEU A 287
LEU A 211
ALA A 222
ALA A 250
LEU A 284
 None
 1.24A 4z90F-1ileA:
3.5
4z90G-1ileA:
3.6
4z90H-1ileA:
3.6
4z90J-1ileA:
2.1		 4z90F-1ileA:
17.36
4z90G-1ileA:
17.36
4z90H-1ileA:
17.36
4z90J-1ileA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZGF_A_BEZA210_0
(UNCHARACTERIZED
PROTEIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 4 VAL A 303
ALA A 239
ASN A 237
GLN A 320
 None
 1.45A 4zgfA-1ileA:
0.0		 4zgfA-1ileA:
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.
5BW4_B_SAMB301_1
(16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ASP A 546
GLU A 696
SER A 572
 None
 0.87A 5bw4B-1ileA:
undetectable		 5bw4B-1ileA:
16.87
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.
5ESL_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 ALA A 332
TYR A 335
GLY A 265
LEU A 284
 None
 0.89A 5eslA-1ileA:
0.0		 5eslA-1ileA:
21.02
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.
5HG0_A_SAMA301_0
(PANTOTHENATE
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 HIS A  54
GLY A  56
VAL A 517
GLY A 551
ASP A 553
 None
 1.00A 5hg0A-1ileA:
undetectable		 5hg0A-1ileA:
13.85
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.
5HG0_B_SAMB301_0
(PANTOTHENATE
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 HIS A  54
GLY A  56
HIS A  57
VAL A 517
GLY A 551
 None
 0.99A 5hg0B-1ileA:
undetectable		 5hg0B-1ileA:
13.85
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.
5HG0_B_SAMB301_0
(PANTOTHENATE
SYNTHETASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 12 HIS A  54
GLY A  56
VAL A 517
GLY A 551
ASP A 553
 None
 1.04A 5hg0B-1ileA:
undetectable		 5hg0B-1ileA:
13.85
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.
5JHD_J_EDTJ301_0
(TCRBETA CHAIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 5 TYR A 650
GLU A   4
GLY A   6
SER A 651
 None
 1.50A 5jhdJ-1ileA:
0.0		 5jhdJ-1ileA:
14.74
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.
5M0O_C_EPAC502_1
(TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		4 / 8 LEU A 162
ILE A 515
PRO A 455
PRO A 532
 None
 1.05A 5m0oC-1ileA:
0.0		 5m0oC-1ileA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MM4_B_TA1B501_1
(TUBULIN BETA CHAIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		5 / 10 GLU A 731
LEU A 793
ALA A 739
PRO A 662
LEU A 664
 None
 1.18A 5mm4B-1ileA:
0.8		 5mm4B-1ileA:
6.58
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.
5UUN_A_ACTA303_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 GLU A 713
TYR A 719
ARG A 722
 None
 0.72A 5uunA-1ileA:
1.7		 5uunA-1ileA:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UUN_B_ACTB305_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 GLU A 713
TYR A 719
ARG A 722
 None
 0.75A 5uunB-1ileA:
1.6		 5uunB-1ileA:
16.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VCG_A_08YA602_2
(CYTOCHROME P450 3A4)		 1ile ISOLEUCYL-TRNA
SYNTHETASE
(Thermus
thermophilus) 		3 / 3 ARG A  80
ARG A  39
ARG A  81
 None
 1.02A 5vcgA-1ileA:
0.0		 5vcgA-1ileA:
20.48