SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3tqg'

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.
1DG5_A_TOPA201_1
(DIHYDROFOLATE
REDUCTASE)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
5 / 11 ILE A 328
ILE A 170
PHE A 156
LEU A 161
ILE A 320
None
1.15A 1dg5A-3tqgA:
undetectable
1dg5A-3tqgA:
17.47
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.
1E7C_A_HLTA4004_1
(SERUM ALBUMIN)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
4 / 4 VAL A 123
PHE A  44
SER A 332
VAL A 334
None
1.34A 1e7cA-3tqgA:
undetectable
1e7cA-3tqgA:
18.62
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.
1RG1_A_SPMA999_1
(TYROSYL-DNA
PHOSPHODIESTERASE 1)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
3 / 3 TRP A 365
VAL A 366
PRO A 367
None
1.00A 1rg1A-3tqgA:
undetectable
1rg1A-3tqgA:
22.01
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.
1XLX_A_CIOA101_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
5 / 12 TYR A 315
LEU A 307
ASN A 222
THR A 326
ILE A 328
None
1.47A 1xlxA-3tqgA:
undetectable
1xlxA-3tqgA:
23.17
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.
4FUB_A_ACTA311_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
3 / 3 TYR A 180
ARG A 333
HIS A 183
None
1.02A 4fubA-3tqgA:
undetectable
4fubA-3tqgA:
18.54
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.
4J7U_D_YTZD802_1
(SEPIAPTERIN
REDUCTASE)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
4 / 8 SER A 290
LEU A 286
PHE A 317
TYR A 310
None
1.17A 4j7uD-3tqgA:
undetectable
4j7uD-3tqgA:
21.57
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.
4R21_A_STRA601_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
4 / 6 ALA A 119
GLY A 336
SER A 196
ILE A 202
None
0.80A 4r21A-3tqgA:
undetectable
4r21A-3tqgA:
22.67
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.
4Z69_A_DIFA1006_1
(SERUM ALBUMIN)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
4 / 7 ILE A 293
LEU A 228
GLY A 241
LYS A 243
None
1.01A 4z69A-3tqgA:
undetectable
4z69A-3tqgA:
18.62
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_B_08JB602_1
(CYTOCHROME P450 3A4)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
4 / 8 ALA A 205
ILE A 118
ALA A 119
LEU A 122
None
0.80A 5te8B-3tqgA:
undetectable
5te8B-3tqgA:
23.00
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.
5ZJI_B_PQNB842_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
5 / 10 TRP A 337
ILE A 210
ILE A  18
ALA A 339
ALA A 119
None
1.29A 5zjiB-3tqgA:
undetectable
5zjiB-3tqgA:
14.62
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.
6DK1_B_GM4B301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
5 / 11 ALA A 274
TYR A 180
ASP A 264
ALA A 314
LEU A 318
None
1.32A 6dk1B-3tqgA:
undetectable
6dk1B-3tqgA:
19.25
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.
6HXI_B_ACTB706_0
(SUCCINYL-COA LIGASE
(ADP-FORMING)
SUBUNIT ALPHA)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
4 / 5 HIS A 183
ARG A 266
PHE A 329
ARG A 333
None
0.41A 6hxiB-3tqgA:
15.6
6hxiB-3tqgA:
21.18
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.
6HXI_D_ACTD703_0
(SUCCINYL-COA LIGASE
(ADP-FORMING)
SUBUNIT ALPHA)
3tqg 2-METHYLCITRATE
SYNTHASE

(Coxiella
burnetii)
5 / 5 HIS A 183
ARG A 266
ASP A 308
PHE A 329
ARG A 333
None
0.49A 6hxiD-3tqgA:
17.3
6hxiD-3tqgA:
21.18