SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3tqx'

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.
1EA1_A_TPFA470_1
(CYTOCHROME P450
51-LIKE RV0764C)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 8 PHE A 317
MET A 312
PHE A 308
LEU A 344
 None
 1.03A 1ea1A-3tqxA:
undetectable		 1ea1A-3tqxA:
21.86
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.
1VE3_A_SAMA302_0
(HYPOTHETICAL PROTEIN
PH0226)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		5 / 12 TYR A 106
GLY A 238
ILE A 235
ALA A 177
PHE A 117
 None
 1.16A 1ve3A-3tqxA:
3.0		 1ve3A-3tqxA:
21.04
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.
2VOU_A_ACTA1397_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 PRO A 268
GLY A 115
TYR A 106
 None
 0.66A 2vouA-3tqxA:
undetectable		 2vouA-3tqxA:
22.35
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.
2VOU_B_ACTB1391_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 PRO A 268
GLY A 115
TYR A 106
 None
 0.56A 2vouB-3tqxA:
undetectable		 2vouB-3tqxA:
22.35
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.
2VOU_C_ACTC1391_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 PRO A 268
GLY A 115
TYR A 106
 None
 0.56A 2vouC-3tqxA:
undetectable		 2vouC-3tqxA:
22.35
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.
2YGN_A_ACTA1181_0
(WNT INHIBITORY
FACTOR 1)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 TYR A 251
VAL A 213
THR A 237
 None
 0.78A 2ygnA-3tqxA:
undetectable		 2ygnA-3tqxA:
15.99
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.
3GWV_A_RFXA801_1
(TRANSPORTER)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		5 / 12 GLY A 180
ILE A 194
PHE A 182
ALA A 177
LEU A 159
 None
 0.97A 3gwvA-3tqxA:
undetectable		 3gwvA-3tqxA:
23.52
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.
3IJD_B_C2FB314_1
(UNCHARACTERIZED
PROTEIN)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 THR A 375
LYS A  61
GLU A  34
 None
 0.83A 3ijdB-3tqxA:
undetectable		 3ijdB-3tqxA:
23.72
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.
3L4D_D_TPFD490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 8 MET A 156
TYR A 151
ALA A 189
THR A 223
 None
 1.02A 3l4dD-3tqxA:
undetectable		 3l4dD-3tqxA:
22.38
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.
3W9T_B_W9TB513_1
(HEMOLYTIC LECTIN
CEL-III)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 6 CYH A 109
THR A 239
ASP A 208
ILE A 137
 PLP  A 397 (-3.6A)
PLP  A 397 (-3.4A)
PLP  A 397 (-2.9A)
None
 1.43A 3w9tB-3tqxA:
undetectable		 3w9tB-3tqxA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WIP_J_ACHJ301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 8 LEU A 120
THR A 252
TYR A 269
TYR A 106
 None
 1.30A 3wipF-3tqxA:
undetectable
3wipJ-3tqxA:
undetectable		 3wipF-3tqxA:
19.19
3wipJ-3tqxA:
19.19
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.
4IIL_A_RBFA401_1
(MEMBRANE LIPOPROTEIN
TPN38(B))		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		5 / 12 SER A 253
TYR A 251
ALA A 212
ASP A 208
GLY A 254
 None
None
None
PLP  A 397 (-2.9A)
None
 1.42A 4iilA-3tqxA:
7.7		 4iilA-3tqxA:
24.02
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.
5DV4_A_NMYA601_1
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		5 / 12 ASN A 153
ASP A 179
ASN A 133
PHE A 117
ILE A 137
 None
PLP  A 397 ( 4.1A)
None
None
None
 1.37A 5dv4A-3tqxA:
undetectable		 5dv4A-3tqxA:
21.92
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.
5FHZ_C_REAC602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		5 / 10 ILE A 188
GLY A 180
LEU A 191
GLN A 302
LEU A 236
 None
 1.22A 5fhzC-3tqxA:
2.2		 5fhzC-3tqxA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LJE_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 6 LEU A 105
ILE A 235
THR A 252
MET A 206
 None
 1.34A 5ljeA-3tqxA:
undetectable		 5ljeA-3tqxA:
16.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UTU_H_ADNH503_2
(ADENOSYLHOMOCYSTEINA
SE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 5 THR A 274
GLU A  91
THR A 103
LEU A 240
 None
 1.30A 5utuH-3tqxA:
2.4		 5utuH-3tqxA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UUN_A_ACTA305_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 THR A 338
MET A 340
HIS A 343
 None
 0.86A 5uunA-3tqxA:
undetectable		 5uunA-3tqxA:
22.49
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.
5X80_C_SALC201_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		4 / 7 VAL A 181
VAL A 207
GLY A 222
TYR A 226
 None
 0.94A 5x80C-3tqxA:
0.8
5x80D-3tqxA:
undetectable		 5x80C-3tqxA:
18.32
5x80D-3tqxA:
18.32
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.
6BEC_C_RBTC601_1
(SCAFFOLD PROTEIN D13)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		5 / 12 VAL A 181
VAL A 352
GLN A  31
PRO A 328
ILE A 366
 None
 1.33A 6becA-3tqxA:
undetectable
6becB-3tqxA:
undetectable
6becC-3tqxA:
undetectable		 6becA-3tqxA:
21.96
6becB-3tqxA:
21.96
6becC-3tqxA:
21.96
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.
6F7L_B_ACTB505_0
(AMINE OXIDASE LKCE)		 3tqx 2-AMINO-3-KETOBUTYRA
TE COENZYME A LIGASE
(Coxiella
burnetii) 		3 / 3 HIS A 343
ASN A 339
LEU A 336
 None
 0.90A 6f7lB-3tqxA:
undetectable		 6f7lB-3tqxA:
21.06