SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4AG'


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.
2VAV_F_CSCF1383_2
(ACETYL-COA--DEACETYL
CEPHALOSPORIN C
ACETYLTRANSFERASE)		 2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III
(Thermus
thermophilus) 		3 / 3 LEU A 440
MET A 445
MET A 366
 None
None
4AG  A1200 (-3.3A)
 0.85A 2vavF-2yevA:
undetectable		 2vavF-2yevA:
19.44
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_B_ACHB301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III
CYTOCHROME C OXIDASE
SUBUNIT 2
(Thermus
thermophilus;
Thermus
thermophilus) 		4 / 8 TYR A 442
THR A 363
TYR B  43
MET A 369
 4AG  A1200 (-3.5A)
None
None
HAS  A1016 ( 4.8A)
 1.44A 3wipB-2yevA:
undetectable
3wipC-2yevA:
undetectable		 3wipB-2yevA:
13.22
3wipC-2yevA:
13.22
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_C_ACHC301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III
CYTOCHROME C OXIDASE
SUBUNIT 2
(Thermus
thermophilus;
Thermus
thermophilus) 		4 / 8 TYR A 442
THR A 363
TYR B  43
MET A 369
 4AG  A1200 (-3.5A)
None
None
HAS  A1016 ( 4.8A)
 1.45A 3wipC-2yevA:
undetectable
3wipD-2yevA:
undetectable		 3wipC-2yevA:
13.22
3wipD-2yevA:
13.22
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_E_ACHE301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III
CYTOCHROME C OXIDASE
SUBUNIT 2
(Thermus
thermophilus;
Thermus
thermophilus) 		4 / 8 MET A 369
TYR A 442
THR A 363
TYR B  43
 HAS  A1016 ( 4.8A)
4AG  A1200 (-3.5A)
None
None
 1.49A 3wipA-2yevA:
undetectable
3wipE-2yevA:
undetectable		 3wipA-2yevA:
13.22
3wipE-2yevA:
13.22
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.
4EJJ_D_NCTD501_1
(CYTOCHROME P450 2A6)		 2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III
(Thermus
thermophilus) 		4 / 7 ASN A 356
GLY A 360
THR A 363
LEU A 435
 None
None
None
4AG  A1200 ( 4.2A)
 0.68A 4ejjD-2yevA:
undetectable		 4ejjD-2yevA:
20.61