SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'CMX'


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.
2F6D_A_ACRA996_1
(GLUCOAMYLASE GLU1)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 7 HIS A 272
ASN A 369
ASP A 320
GLY A 273
 CMX  A5001 ( 3.7A)
CMX  A5001 (-3.3A)
None
CMX  A5001 ( 3.9A)
 1.00A 2f6dA-2h12A:
undetectable		 2f6dA-2h12A:
19.96
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.
4IQQ_A_D16A402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 7 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.78A 4iqqA-2h12A:
undetectable		 4iqqA-2h12A:
22.98
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.
4IQQ_B_D16B402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 7 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.79A 4iqqB-2h12A:
undetectable		 4iqqB-2h12A:
22.98
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.
4IQQ_C_D16C402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 7 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.83A 4iqqC-2h12A:
undetectable		 4iqqC-2h12A:
22.98
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.
4IQQ_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 8 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.80A 4iqqD-2h12A:
undetectable		 4iqqD-2h12A:
22.98
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.
5IWU_A_ERYA404_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		5 / 12 ILE A  81
HIS A  76
THR A 243
ALA A  88
PHE A 392
 None
None
None
None
CMX  A5001 (-4.9A)
 1.39A 5iwuA-2h12A:
undetectable		 5iwuA-2h12A:
21.06
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.
5NOO_A_D16A402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 7 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.79A 5nooA-2h12A:
undetectable		 5nooA-2h12A:
22.98
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.
5NOO_B_D16B402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 7 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.81A 5nooB-2h12A:
undetectable		 5nooB-2h12A:
22.98
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.
5NOO_C_D16C402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 6 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.82A 5nooC-2h12A:
undetectable		 5nooC-2h12A:
22.98
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.
5NOO_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 8 TYR A 367
ASP A 371
GLY A 310
PHE A 311
 None
CMX  A5001 (-2.8A)
CMX  A5001 (-3.4A)
None
 0.82A 5nooD-2h12A:
undetectable		 5nooD-2h12A:
22.98
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.
5UUN_B_ACTB307_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		3 / 3 LEU A 351
ALA A 348
LEU A 308
 None
None
CMX  A5001 (-4.9A)
 0.45A 5uunB-2h12A:
undetectable		 5uunB-2h12A:
23.11
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.
6GBN_B_ADNB501_1
(-)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		5 / 12 LEU A 356
GLU A 352
LEU A 308
GLY A 312
PHE A 319
 None
None
CMX  A5001 (-4.9A)
CMX  A5001 (-3.3A)
None
 1.13A 6gbnB-2h12A:
undetectable		 6gbnB-2h12A:
23.81
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)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		4 / 5 HIS A 237
ARG A 322
PHE A 392
ARG A 396
 OAA  A5007 (-3.9A)
OAA  A5007 (-2.9A)
CMX  A5001 (-4.9A)
OAA  A5007 (-2.9A)
 0.79A 6hxiB-2h12A:
14.5		 6hxiB-2h12A:
21.48
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.
6HXI_D_ACTD703_0
(SUCCINYL-COA LIGASE
(ADP-FORMING)
SUBUNIT ALPHA)		 2h12 CITRATE SYNTHASE
(Acetobacter
aceti) 		5 / 5 HIS A 237
ARG A 322
ASP A 371
PHE A 392
ARG A 396
 OAA  A5007 (-3.9A)
OAA  A5007 (-2.9A)
CMX  A5001 (-2.8A)
CMX  A5001 (-4.9A)
OAA  A5007 (-2.9A)
 0.77A 6hxiD-2h12A:
16.1		 6hxiD-2h12A:
21.48