SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1j3n'

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.
1CQP_A_803A311_1
(ANTIGEN CD11A (P180))
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 10 VAL A 102
ILE A 144
GLU A  84
LEU A  83
VAL A 237
None
1.14A 1cqpA-1j3nA:
undetectable
1cqpB-1j3nA:
undetectable
1cqpA-1j3nA:
17.17
1cqpB-1j3nA:
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.
1MJ2_A_SAMA2201_1
(PROTEIN (METHIONINE
REPRESSOR))
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 4 HIS A 399
ALA A 395
PHE A 396
GLY A 397
None
1.37A 1mj2B-1j3nA:
undetectable
1mj2B-1j3nA:
15.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJ2_C_SAMC1200_1
(PROTEIN (METHIONINE
REPRESSOR))
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 4 HIS A 399
ALA A 395
PHE A 396
GLY A 397
None
1.40A 1mj2D-1j3nA:
undetectable
1mj2D-1j3nA:
15.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJO_A_SAMA199_1
(METHIONINE REPRESSOR)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 4 HIS A 399
ALA A 395
PHE A 396
GLY A 397
None
1.41A 1mjoB-1j3nA:
undetectable
1mjoB-1j3nA:
15.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJO_D_SAMD200_1
(METHIONINE REPRESSOR)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 4 HIS A 399
ALA A 395
PHE A 396
GLY A 397
None
1.39A 1mjoD-1j3nA:
undetectable
1mjoD-1j3nA:
15.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BM9_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A  83
LEU A  93
GLY A 149
ALA A 145
ALA A 142
None
1.16A 2bm9A-1j3nA:
undetectable
2bm9A-1j3nA:
18.29
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.
2BXK_A_IMNA2001_1
(SERUM ALBUMIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 8 PHE A 405
ALA A 348
LEU A 168
ASP A  85
None
1.10A 2bxkA-1j3nA:
undetectable
2bxkA-1j3nA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NMZ_B_ROCB401_1
(PROTEASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
6 / 12 LEU A 236
ALA A  11
ILE A 336
GLY A 232
ALA A 348
ILE A 349
None
1.42A 2nmzA-1j3nA:
undetectable
2nmzA-1j3nA:
13.45
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.
2NPN_A_SAMA4633_0
(PUTATIVE COBALAMIN
SYNTHESIS RELATED
PROTEIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 9 GLY A 341
LEU A 339
ALA A 345
LEU A  12
LEU A 168
None
1.20A 2npnA-1j3nA:
undetectable
2npnA-1j3nA:
25.00
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.
2V0M_C_KLNC1499_1
(CYTOCHROME P450 3A4)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 7 LEU A 340
PHE A 227
ILE A 197
GLY A 105
None
0.96A 2v0mC-1j3nA:
undetectable
2v0mC-1j3nA:
21.05
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.
2V3K_A_SAMA1254_0
(ESSENTIAL FOR
MITOTIC GROWTH 1)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 10 LEU A 101
GLY A  99
GLY A 186
LEU A 238
ALA A 171
None
0.91A 2v3kA-1j3nA:
undetectable
2v3kA-1j3nA:
20.92
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.
2WUZ_A_TPFA1460_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE
, PUTATIVE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 10 MET A 281
ALA A 404
ALA A 389
LEU A 327
VAL A 329
None
1.36A 2wuzA-1j3nA:
undetectable
2wuzA-1j3nA:
21.47
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.
2WUZ_B_TPFB1460_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE
, PUTATIVE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 10 MET A 281
ALA A 404
ALA A 389
LEU A 327
VAL A 329
None
1.34A 2wuzB-1j3nA:
0.0
2wuzB-1j3nA:
21.47
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.
2XFH_A_CL6A1413_1
(ERYTHROMYCIN B/D
C-12 HYDROXYLASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 6 GLN A  26
ALA A 345
ALA A 348
THR A 351
None
1.02A 2xfhA-1j3nA:
0.0
2xfhA-1j3nA:
23.98
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.
3DMH_A_SAMA384_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 GLY A 103
GLY A 186
ALA A  79
ASP A 166
VAL A 158
None
1.12A 3dmhA-1j3nA:
undetectable
3dmhA-1j3nA:
24.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 GLY A 164
GLY A 344
ALA A 348
ALA A 401
ALA A 185
None
1.00A 3jb2A-1j3nA:
0.0
3jb2A-1j3nA:
17.60
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.
3LN1_A_CELA682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A 182
ALA A 167
VAL A 235
GLY A  10
ALA A  82
None
0.95A 3ln1A-1j3nA:
0.0
3ln1A-1j3nA:
20.07
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.
3LN1_A_CELA682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 VAL A 237
LEU A 182
ALA A 167
ALA A  79
LEU A  83
None
1.00A 3ln1A-1j3nA:
0.0
3ln1A-1j3nA:
20.07
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.
3LN1_B_CELB682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A 182
ALA A 167
VAL A 235
GLY A  10
ALA A  82
None
0.95A 3ln1B-1j3nA:
0.0
3ln1B-1j3nA:
20.07
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.
3LN1_B_CELB682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 VAL A 237
LEU A 182
ALA A 167
ALA A  79
LEU A  83
None
1.00A 3ln1B-1j3nA:
0.0
3ln1B-1j3nA:
20.07
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.
3LN1_C_CELC682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A 182
ALA A 167
VAL A 235
GLY A  10
ALA A  82
None
0.96A 3ln1C-1j3nA:
undetectable
3ln1C-1j3nA:
20.07
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.
3LN1_C_CELC682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 VAL A 237
LEU A 182
ALA A 167
ALA A  79
LEU A  83
None
1.00A 3ln1C-1j3nA:
undetectable
3ln1C-1j3nA:
20.07
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.
3LN1_D_CELD682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A 182
ALA A 167
VAL A 235
GLY A  10
ALA A  82
None
0.95A 3ln1D-1j3nA:
0.0
3ln1D-1j3nA:
20.07
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.
3LN1_D_CELD682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 VAL A 237
LEU A 182
ALA A 167
ALA A  79
LEU A  83
None
1.00A 3ln1D-1j3nA:
0.0
3ln1D-1j3nA:
20.07
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.
3LOQ_A_ACTA278_0
(UNIVERSAL STRESS
PROTEIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
3 / 3 SER A 331
GLY A 302
SER A 217
None
0.66A 3loqA-1j3nA:
undetectable
3loqA-1j3nA:
22.25
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.
3T3S_D_9PLD1_1
(CYTOCHROME P450 2A13)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 8 PHE A 258
ALA A 280
ALA A 162
THR A 159
None
0.93A 3t3sD-1j3nA:
undetectable
3t3sD-1j3nA:
23.68
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.
3T3S_E_9PLE1_1
(CYTOCHROME P450 2A13)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 8 PHE A 258
ALA A 280
ALA A 162
THR A 159
None
0.94A 3t3sE-1j3nA:
undetectable
3t3sE-1j3nA:
23.68
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.
3TKD_A_CYZA266_2
(GLUTAMATE RECEPTOR 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 5 PRO A 362
SER A  31
LYS A  30
GLY A  29
None
1.17A 3tkdB-1j3nA:
undetectable
3tkdB-1j3nA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U6T_A_KANA4699_1
(RIBOSOME
INACTIVATING PROTEIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 10 ILE A 197
GLU A 113
ILE A  36
ALA A  49
GLU A  51
None
1.16A 3u6tA-1j3nA:
undetectable
3u6tA-1j3nA:
20.53
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.
4C49_A_HCYA1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 ALA A 165
GLN A  26
THR A 332
PHE A  22
ILE A 349
None
1.26A 4c49A-1j3nA:
0.0
4c49A-1j3nA:
21.87
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.
4KIC_A_SAMA401_0
(METHYLTRANSFERASE
MPPJ)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 GLY A  99
GLY A 152
ILE A 144
ALA A 145
ALA A 185
None
1.24A 4kicA-1j3nA:
undetectable
4kicA-1j3nA:
22.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LS7_A_1X9A504_1
(3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
10 / 12 GLY A 105
ALA A 160
CYH A 161
GLU A 189
PHE A 200
HIS A 301
THR A 303
HIS A 338
LEU A 340
PHE A 396
None
0.76A 4ls7A-1j3nA:
70.0
4ls7A-1j3nA:
53.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LS7_A_1X9A504_1
(3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
6 / 12 GLY A 341
ALA A 160
CYH A 161
PHE A 227
HIS A 301
PHE A 396
None
1.10A 4ls7A-1j3nA:
70.0
4ls7A-1j3nA:
53.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LS7_B_1X9B503_1
(3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
8 / 12 ILE A 106
ALA A 160
CYH A 161
PHE A 200
HIS A 301
HIS A 338
LEU A 340
PHE A 396
None
0.95A 4ls7A-1j3nA:
70.0
4ls7B-1j3nA:
69.9
4ls7A-1j3nA:
53.88
4ls7B-1j3nA:
53.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LS7_B_1X9B503_1
(3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
8 / 12 ILE A 106
ALA A 160
CYH A 161
PHE A 200
HIS A 301
THR A 303
HIS A 338
LEU A 340
None
0.76A 4ls7A-1j3nA:
70.0
4ls7B-1j3nA:
69.9
4ls7A-1j3nA:
53.88
4ls7B-1j3nA:
53.88
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.
4O2B_D_LOCD503_2
(TUBULIN BETA-2B
CHAIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A 206
LEU A  44
ILE A  36
ALA A  41
ILE A 192
None
0.96A 4o2bD-1j3nA:
undetectable
4o2bD-1j3nA:
22.06
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.
4OR0_A_NPSA602_1
(SERUM ALBUMIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 9 PHE A 405
ALA A 288
SER A 391
LEU A 403
VAL A 402
None
1.32A 4or0A-1j3nA:
undetectable
4or0A-1j3nA:
21.29
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.
4RS0_A_IBPA706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 9 VAL A 237
LEU A 236
LEU A 182
ALA A  79
LEU A  83
None
1.02A 4rs0A-1j3nA:
0.0
4rs0A-1j3nA:
20.07
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.
4TWD_F_377F402_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 8 SER A 393
ALA A 348
SER A 391
ALA A 167
None
0.73A 4twdF-1j3nA:
0.0
4twdG-1j3nA:
0.0
4twdH-1j3nA:
0.0
4twdI-1j3nA:
0.0
4twdJ-1j3nA:
0.0
4twdF-1j3nA:
20.70
4twdG-1j3nA:
20.70
4twdH-1j3nA:
20.70
4twdI-1j3nA:
20.70
4twdJ-1j3nA:
20.70
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.
4V20_A_ACTA1444_0
(CELLOBIOHYDROLASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 5 GLY A 105
THR A 104
GLY A 108
GLU A 189
None
1.08A 4v20A-1j3nA:
undetectable
4v20A-1j3nA:
21.34
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.
4WQ4_A_ACTA403_0
(TRNA N6-ADENOSINE
THREONYLCARBAMOYLTRA
NSFERASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
3 / 3 VAL A  17
LEU A  12
VAL A  52
None
0.59A 4wq4A-1j3nA:
2.0
4wq4A-1j3nA:
23.74
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.
4Z91_J_4LEJ401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
6 / 9 LEU A 403
ALA A 165
ALA A 167
ALA A 185
LEU A 238
ALA A 348
None
1.22A 4z91F-1j3nA:
0.0
4z91G-1j3nA:
0.0
4z91H-1j3nA:
0.0
4z91I-1j3nA:
0.0
4z91J-1j3nA:
0.0
4z91F-1j3nA:
20.77
4z91G-1j3nA:
20.77
4z91H-1j3nA:
20.77
4z91I-1j3nA:
20.77
4z91J-1j3nA:
20.77
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.
4ZJO_D_ERYD1101_0
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 11 THR A 159
SER A 393
ALA A 284
GLU A 347
GLY A 186
None
1.15A 4zjoD-1j3nA:
0.0
4zjoD-1j3nA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 8 ALA A 167
VAL A 157
GLY A 164
ALA A 345
GLY A 187
None
1.28A 4zjzB-1j3nA:
undetectable
4zjzB-1j3nA:
25.14
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.
5JW1_A_CELA602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 LEU A 182
ALA A 167
VAL A 235
GLY A  10
ALA A  82
None
1.00A 5jw1A-1j3nA:
0.0
5jw1A-1j3nA:
20.49
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.
5JW1_A_CELA602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 VAL A 237
LEU A 182
ALA A 167
ALA A  79
LEU A  83
None
1.01A 5jw1A-1j3nA:
0.0
5jw1A-1j3nA:
20.49
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.
5KB6_A_ADNA401_1
(ADENOSINE KINASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 GLY A 186
THR A 163
ALA A  75
ALA A 140
ILE A 144
None
0.87A 5kb6A-1j3nA:
undetectable
5kb6A-1j3nA:
22.91
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.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 VAL A 402
SER A 393
ALA A 160
GLY A 276
ALA A 277
None
0.81A 5kirB-1j3nA:
0.0
5kirB-1j3nA:
21.16
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.
5L5Z_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA
TYPE-5,PROTEASOME
SUBUNIT BETA TYPE-5
PROTEASOME SUBUNIT
BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA TYPE-6)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 9 THR A  13
ALA A 233
ALA A  79
ALA A  75
ALA A 345
None
1.06A 5l5zK-1j3nA:
undetectable
5l5zL-1j3nA:
undetectable
5l5zK-1j3nA:
21.81
5l5zL-1j3nA:
20.00
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.
5L5Z_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA
TYPE-5,PROTEASOME
SUBUNIT BETA TYPE-5
PROTEASOME SUBUNIT
BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA TYPE-6)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 9 THR A  13
ALA A 233
ALA A  79
ALA A  75
ALA A 345
None
1.06A 5l5zY-1j3nA:
undetectable
5l5zZ-1j3nA:
undetectable
5l5zY-1j3nA:
21.81
5l5zZ-1j3nA:
20.00
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.
5MXB_A_ML1A222_1
(CLASS 10 PLANT
PATHOGENESIS-RELATED
PROTEIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 10 ILE A 336
LEU A 339
GLY A  18
ALA A  21
PHE A  22
None
1.08A 5mxbA-1j3nA:
0.0
5mxbA-1j3nA:
10.46
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.
5TE8_C_08JC602_1
(CYTOCHROME P450 3A4)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 7 ALA A  11
THR A  13
ILE A 336
LEU A 339
None
0.90A 5te8C-1j3nA:
undetectable
5te8C-1j3nA:
21.17
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 ARG A 173
GLY A 186
PHE A 405
ALA A 404
GLY A 164
None
1.03A 5veuH-1j3nA:
0.0
5veuH-1j3nA:
22.75
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.
5VKQ_B_PCFB1804_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 8 GLY A 337
VAL A 346
ILE A  15
GLY A  32
ILE A  77
None
1.06A 5vkqB-1j3nA:
undetectable
5vkqC-1j3nA:
undetectable
5vkqB-1j3nA:
14.50
5vkqC-1j3nA:
14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BRD_B_RFPB502_1
(RIFAMPIN
MONOOXYGENASE)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
5 / 12 GLY A   8
VAL A   6
PHE A 405
GLY A 164
GLY A 344
None
1.21A 6brdB-1j3nA:
0.0
6brdB-1j3nA:
11.36
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.
6MDQ_A_TESA605_0
(SERUM ALBUMIN)
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus)
4 / 8 GLY A 257
LEU A 168
GLY A 169
LEU A 172
None
0.76A 6mdqA-1j3nA:
undetectable
6mdqA-1j3nA:
11.17