SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5ekd'

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.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 GLY A  50
GLY A 179
ASP A 181
GLN A 182
VAL A 217
 ATP  A 402 (-3.6A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
5BX  A 401 ( 3.0A)
ATP  A 402 (-3.3A)
 0.83A 1ffyA-5ekdA:
4.1		 1ffyA-5ekdA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 HIS A  48
GLY A  50
GLY A 179
ASP A 181
VAL A 217
 ATP  A 402 (-4.0A)
ATP  A 402 (-3.6A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
ATP  A 402 (-3.3A)
 0.78A 1ffyA-5ekdA:
4.1		 1ffyA-5ekdA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GWR_A_ESTA600_1
(OESTROGEN RECEPTOR)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 LEU A  99
LEU A 100
ALA A  97
LEU A 331
LEU A 335
 None
 1.14A 1gwrA-5ekdA:
undetectable		 1gwrA-5ekdA:
20.45
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.
1JZS_A_MRCA1301_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 GLY A  40
HIS A  48
GLY A 179
ASP A 181
GLN A 182
 5BX  A 401 (-3.9A)
ATP  A 402 (-4.0A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
5BX  A 401 ( 3.0A)
 0.84A 1jzsA-5ekdA:
6.0		 1jzsA-5ekdA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 11 HIS A  48
GLY A  50
GLY A 179
ASP A 181
VAL A 217
 ATP  A 402 (-4.0A)
ATP  A 402 (-3.6A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
ATP  A 402 (-3.3A)
 0.79A 1pg2A-5ekdA:
9.2		 1pg2A-5ekdA:
22.12
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.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 GLY A  50
GLY A 179
ASP A 181
GLN A 182
VAL A 217
 ATP  A 402 (-3.6A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
5BX  A 401 ( 3.0A)
ATP  A 402 (-3.3A)
 0.83A 1qu2A-5ekdA:
3.8		 1qu2A-5ekdA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 HIS A  48
GLY A  50
GLY A 179
ASP A 181
VAL A 217
 ATP  A 402 (-4.0A)
ATP  A 402 (-3.6A)
ATP  A 402 (-3.0A)
ATP  A 402 (-2.9A)
ATP  A 402 (-3.3A)
 0.78A 1qu2A-5ekdA:
3.8		 1qu2A-5ekdA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WEK_A_DIFA1373_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 ASN A 274
MET A 227
VAL A 217
TYR A 302
 None
None
ATP  A 402 (-3.3A)
None
 1.27A 2wekA-5ekdA:
undetectable		 2wekA-5ekdA:
22.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_A_TRPA1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 10 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.60A 3fhjA-5ekdA:
36.2		 3fhjA-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_B_TRPB1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 10 GLY A  40
GLN A  42
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.73A 3fhjB-5ekdA:
34.7		 3fhjB-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_B_TRPB1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 10 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.50A 3fhjB-5ekdA:
34.7		 3fhjB-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_C_TRPC1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 10 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.65A 3fhjC-5ekdA:
33.7		 3fhjC-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_D_TRPD1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.50A 3fhjD-5ekdA:
35.3		 3fhjD-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_E_TRPE1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 10 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.61A 3fhjE-5ekdA:
35.2		 3fhjE-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FHJ_F_TRPF1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.50A 3fhjF-5ekdA:
36.9		 3fhjF-5ekdA:
40.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_A_TRPA1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.66A 3fi0A-5ekdA:
35.8		 3fi0A-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_A_TRPA1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
VAL A 176
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
None
 1.25A 3fi0A-5ekdA:
35.8		 3fi0A-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_B_TRPB1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 8 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.53A 3fi0B-5ekdA:
35.3		 3fi0B-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_C_TRPC1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.69A 3fi0C-5ekdA:
36.2		 3fi0C-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_D_TRPD1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.65A 3fi0D-5ekdA:
36.5		 3fi0D-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_E_TRPE1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		6 / 7 GLY A  40
VAL A  74
ASP A 167
ILE A 168
VAL A 176
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
5BX  A 401 ( 3.0A)
 0.60A 3fi0E-5ekdA:
34.6		 3fi0E-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_E_TRPE1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		6 / 7 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
 0.35A 3fi0E-5ekdA:
34.6		 3fi0E-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_E_TRPE1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 7 GLY A  40
VAL A  74
HIS A  77
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
ATP  A 402 (-3.2A)
 0.80A 3fi0E-5ekdA:
34.6		 3fi0E-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_F_TRPF1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.73A 3fi0F-5ekdA:
35.1		 3fi0F-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_G_TRPG1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 8 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.48A 3fi0G-5ekdA:
36.5		 3fi0G-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_H_TRPH1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.70A 3fi0H-5ekdA:
36.0		 3fi0H-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_J_TRPJ1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.66A 3fi0J-5ekdA:
27.2		 3fi0J-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_K_TRPK1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.72A 3fi0K-5ekdA:
14.0		 3fi0K-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_L_TRPL1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.58A 3fi0L-5ekdA:
36.3		 3fi0L-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_M_TRPM1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.68A 3fi0M-5ekdA:
35.9		 3fi0M-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_N_TRPN1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.69A 3fi0N-5ekdA:
36.3		 3fi0N-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_O_TRPO1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.60A 3fi0O-5ekdA:
35.9		 3fi0O-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_O_TRPO1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
ATP  A 402 (-3.2A)
 1.08A 3fi0O-5ekdA:
35.9		 3fi0O-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_P_TRPP1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		7 / 7 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 ( 3.0A)
 0.65A 3fi0P-5ekdA:
35.4		 3fi0P-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_Q_TRPQ1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		7 / 8 GLY A  40
GLN A  42
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
 0.69A 3fi0Q-5ekdA:
35.9		 3fi0Q-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_Q_TRPQ1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		7 / 8 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
 0.38A 3fi0Q-5ekdA:
35.9		 3fi0Q-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_R_TRPR1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		9 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
VAL A 178
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
ATP  A 402 (-3.2A)
5BX  A 401 ( 3.0A)
 0.55A 3fi0R-5ekdA:
34.2		 3fi0R-5ekdA:
40.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FI0_R_TRPR1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
VAL A 176
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
None
 1.20A 3fi0R-5ekdA:
34.2		 3fi0R-5ekdA:
40.75
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.
4J24_A_ESTA600_1
(ESTROGEN RECEPTOR
BETA)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 LEU A  99
LEU A 100
LEU A 331
LEU A 335
ILE A  41
 None
None
None
None
ATP  A 402 (-3.8A)
 1.11A 4j24A-5ekdA:
undetectable		 4j24A-5ekdA:
21.75
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.
5GQB_A_GCSA605_1
(CHITINASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 TRP A  59
ILE A 104
SER A 109
 None
 1.01A 5gqbA-5ekdA:
undetectable		 5gqbA-5ekdA:
23.01
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.
5JMN_C_FUAC1101_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 VAL A 217
HIS A 279
VAL A 282
 ATP  A 402 (-3.3A)
None
None
 0.54A 5jmnC-5ekdA:
undetectable		 5jmnC-5ekdA:
15.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V0I_A_TRPA402_0
(TRYPTOPHAN--TRNA
LIGASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		7 / 9 GLY A  40
GLN A  42
HIS A  77
ASP A 167
ILE A 168
VAL A 176
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
5BX  A 401 ( 3.0A)
 0.63A 5v0iA-5ekdA:
38.1		 5v0iA-5ekdA:
42.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V0I_A_TRPA402_0
(TRYPTOPHAN--TRNA
LIGASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		7 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
5BX  A 401 ( 3.0A)
 0.34A 5v0iA-5ekdA:
38.1		 5v0iA-5ekdA:
42.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V0I_A_TRPA402_0
(TRYPTOPHAN--TRNA
LIGASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
ATP  A 402 (-3.2A)
 1.18A 5v0iA-5ekdA:
38.1		 5v0iA-5ekdA:
42.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V0I_B_TRPB402_0
(TRYPTOPHAN--TRNA
LIGASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		8 / 9 GLY A  40
GLN A  42
VAL A  74
HIS A  77
ASP A 167
ILE A 168
VAL A 176
GLN A 182
 5BX  A 401 (-3.9A)
5BX  A 401 ( 3.4A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
None
5BX  A 401 ( 3.0A)
 0.60A 5v0iB-5ekdA:
38.9		 5v0iB-5ekdA:
42.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V0I_B_TRPB402_0
(TRYPTOPHAN--TRNA
LIGASE)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 9 GLY A  40
VAL A  74
HIS A  77
ASP A 167
VAL A 178
 5BX  A 401 (-3.9A)
5BX  A 401 ( 4.9A)
5BX  A 401 (-3.5A)
5BX  A 401 (-3.9A)
ATP  A 402 (-3.2A)
 1.19A 5v0iB-5ekdA:
38.9		 5v0iB-5ekdA:
42.52
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.
5Y2T_A_8LXA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5ekd TRYPTOPHAN--TRNA
LIGASE,
MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 SER A  72
HIS A 120
TYR A 171
 None
 0.97A 5y2tA-5ekdA:
undetectable		 5y2tA-5ekdA:
undetectable