SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3n9i'

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.
1Z95_A_198A501_2
(ANDROGEN RECEPTOR)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 6 LEU A  37
ASN A  32
LEU A 297
LEU A  78
ILE A 219
 None
 1.43A 1z95A-3n9iA:
undetectable		 1z95A-3n9iA:
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.
2OGY_A_C2FA3000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 12 GLU A 223
ILE A 261
LEU A 258
SER A 227
ILE A 219
 None
 1.29A 2ogyA-3n9iA:
undetectable		 2ogyA-3n9iA:
23.97
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.
2OGY_B_C2FB4000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 12 GLU A 223
ILE A 261
LEU A 258
SER A 227
ILE A 219
 None
 1.36A 2ogyB-3n9iA:
undetectable		 2ogyB-3n9iA:
23.97
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.
2WV2_A_TPFA1_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 9 PHE A  92
ALA A 325
ALA A 329
THR A 332
LEU A 103
 None
 1.38A 2wv2A-3n9iA:
0.0		 2wv2A-3n9iA:
20.73
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 10 GLN A  23
MET A 144
ILE A 148
VAL A 158
GLN A 162
 None
GOL  A1001 (-3.9A)
None
None
None
 0.93A 3fhjA-3n9iA:
39.0		 3fhjA-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		9 / 10 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.41A 3fhjA-3n9iA:
39.0		 3fhjA-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 10 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.22A 3fhjA-3n9iA:
39.0		 3fhjA-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		9 / 10 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.38A 3fhjB-3n9iA:
37.6		 3fhjB-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 10 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.21A 3fhjB-3n9iA:
37.6		 3fhjB-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		9 / 10 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.36A 3fhjC-3n9iA:
36.0		 3fhjC-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 10 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.22A 3fhjC-3n9iA:
36.0		 3fhjC-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.35A 3fhjD-3n9iA:
37.8		 3fhjD-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 9 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.21A 3fhjD-3n9iA:
37.8		 3fhjD-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		9 / 10 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.37A 3fhjE-3n9iA:
13.1		 3fhjE-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 10 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.21A 3fhjE-3n9iA:
13.1		 3fhjE-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.35A 3fhjF-3n9iA:
17.6		 3fhjF-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 9 GLY A  21
VAL A  54
HIS A  57
MET A 144
VAL A 156
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
 1.22A 3fhjF-3n9iA:
17.6		 3fhjF-3n9iA:
54.62
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.47A 3fi0A-3n9iA:
38.2		 3fi0A-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 8 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.40A 3fi0B-3n9iA:
37.8		 3fi0B-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.42A 3fi0C-3n9iA:
38.2		 3fi0C-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
 0.50A 3fi0D-3n9iA:
39.0		 3fi0D-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 9 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.39A 3fi0D-3n9iA:
39.0		 3fi0D-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 7 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.49A 3fi0E-3n9iA:
36.9		 3fi0E-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
 0.41A 3fi0F-3n9iA:
29.2		 3fi0F-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
None
 1.10A 3fi0F-3n9iA:
29.2		 3fi0F-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 9 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.39A 3fi0F-3n9iA:
29.2		 3fi0F-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 8 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.34A 3fi0G-3n9iA:
39.3		 3fi0G-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.50A 3fi0H-3n9iA:
39.0		 3fi0H-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
 0.48A 3fi0J-3n9iA:
38.7		 3fi0J-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
None
 1.14A 3fi0J-3n9iA:
38.7		 3fi0J-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 9 GLY A  21
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.43A 3fi0J-3n9iA:
38.7		 3fi0J-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.49A 3fi0K-3n9iA:
37.7		 3fi0K-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.55A 3fi0L-3n9iA:
38.9		 3fi0L-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.49A 3fi0M-3n9iA:
38.7		 3fi0M-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.45A 3fi0N-3n9iA:
38.7		 3fi0N-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.40A 3fi0O-3n9iA:
38.9		 3fi0O-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 7 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
 0.27A 3fi0P-3n9iA:
37.2		 3fi0P-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		7 / 8 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
 0.37A 3fi0Q-3n9iA:
39.0		 3fi0Q-3n9iA:
54.94
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		8 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
None
None
None
 0.59A 3fi0R-3n9iA:
36.4		 3fi0R-3n9iA:
54.94
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.
4OKW_A_198A1001_2
(ANDROGEN RECEPTOR)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 7 LEU A  37
ASN A  32
LEU A 297
LEU A  78
ILE A 219
 None
 1.40A 4okwA-3n9iA:
undetectable		 4okwA-3n9iA:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE2_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		4 / 5 ALA A 334
TYR A 337
HIS A  57
PRO A  98
 None
None
GOL  A1001 ( 4.7A)
None
 1.23A 4ze2A-3n9iA:
0.8		 4ze2A-3n9iA:
20.54
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.
5BMV_C_VLBC507_2
(TUBULIN ALPHA-1B
CHAIN)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		4 / 7 PRO A 225
VAL A 228
ILE A 232
VAL A 293
 None
 0.71A 5bmvC-3n9iA:
undetectable		 5bmvC-3n9iA:
22.86
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.
5HYR_B_ESTB601_1
(ESTROGEN RECEPTOR)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 11 LEU A 222
LEU A 300
MET A 296
LEU A 297
LEU A  37
 None
 1.39A 5hyrB-3n9iA:
undetectable		 5hyrB-3n9iA:
22.78
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.
5KQY_B_017B101_2
(PROTEASE E35D-DRV)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		4 / 7 GLY A 195
ALA A 196
ASP A 260
GLY A 267
 None
 0.66A 5kqyB-3n9iA:
undetectable		 5kqyB-3n9iA:
15.34
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.
5ODC_A_ACTA703_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		4 / 4 GLN A 268
GLN A 276
PRO A 271
ALA A 275
 None
 1.37A 5odcA-3n9iA:
0.6
5odcG-3n9iA:
0.8		 5odcA-3n9iA:
17.92
5odcG-3n9iA:
17.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ODC_G_ACTG704_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		4 / 5 PRO A 271
ALA A 275
GLN A 268
GLN A 276
 None
 1.36A 5odcA-3n9iA:
undetectable
5odcG-3n9iA:
undetectable		 5odcA-3n9iA:
17.92
5odcG-3n9iA:
17.92
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		9 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.19A 5v0iA-3n9iA:
45.2		 5v0iA-3n9iA:
83.48
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)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		9 / 9 GLY A  21
GLN A  23
VAL A  54
HIS A  57
MET A 144
ASP A 147
ILE A 148
VAL A 156
GLN A 162
 GOL  A1001 (-3.6A)
None
GOL  A1001 (-4.6A)
GOL  A1001 ( 4.7A)
GOL  A1001 (-3.9A)
GOL  A1001 (-3.9A)
None
None
None
 0.24A 5v0iB-3n9iA:
44.8		 5v0iB-3n9iA:
83.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AZ3_1_PAR11803_1
(RRNA ALPHA
RIBOSOMAL PROTEIN
EL18)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		3 / 3 SER A 211
LYS A 210
SER A 209
 None
 0.77A 6az3P-3n9iA:
undetectable		 6az3P-3n9iA:
11.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EF6_A_BEZA401_0
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 3n9i TRYPTOPHANYL-TRNA
SYNTHETASE
(Yersinia
pestis) 		5 / 9 LEU A 201
SER A 200
ILE A 261
VAL A 293
ILE A 219
 None
 1.07A 6ef6A-3n9iA:
undetectable		 6ef6A-3n9iA:
24.32