SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'PAC'


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.
2BDM_A_TMIA501_1
(CYTOCHROME P450 2B4)		 3ixl ARYLMALONATE
DECARBOXYLASE
(Bordetella
bronchiseptica) 		4 / 7 SER A  71
MET A  11
GLY A 189
ILE A 197
 None
None
PAC  A5000 (-3.7A)
None
 0.80A 2bdmA-3ixlA:
undetectable		 2bdmA-3ixlA:
22.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IXL_A_PACA5000_0
(ARYLMALONATE
DECARBOXYLASE)		 3ixl ARYLMALONATE
DECARBOXYLASE
(Bordetella
bronchiseptica) 		10 / 10 PRO A  14
CYH A  74
THR A  75
SER A  76
MET A 104
TYR A 126
VAL A 156
SER A 188
GLY A 189
GLY A 190
 PAC  A5000 (-4.2A)
PAC  A5000 (-3.5A)
PAC  A5000 (-3.8A)
PAC  A5000 (-2.6A)
PAC  A5000 ( 3.8A)
PAC  A5000 (-4.4A)
PAC  A5000 ( 4.1A)
PAC  A5000 (-3.7A)
PAC  A5000 (-3.7A)
PAC  A5000 (-3.4A)
 0.01A 3ixlA-3ixlA:
48.7		 3ixlA-3ixlA:
100.00
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.
3LM8_B_VIBB223_1
(THIAMINE
PYROPHOSPHOKINASE)		 3ixl ARYLMALONATE
DECARBOXYLASE
(Bordetella
bronchiseptica) 		4 / 7 LEU A  40
LEU A  77
CYH A  74
THR A  90
 None
None
PAC  A5000 (-3.5A)
None
 1.04A 3lm8B-3ixlA:
undetectable
3lm8D-3ixlA:
4.0		 3lm8B-3ixlA:
21.65
3lm8D-3ixlA:
21.65
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.
4OJ4_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3ixl ARYLMALONATE
DECARBOXYLASE
(Bordetella
bronchiseptica) 		5 / 8 SER A  76
LEU A  40
LEU A  38
VAL A  51
ILE A  52
 PAC  A5000 (-2.6A)
None
None
None
None
 1.20A 4oj4A-3ixlA:
undetectable		 4oj4A-3ixlA:
20.67
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.
4XTA_B_DIFB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3ixl ARYLMALONATE
DECARBOXYLASE
(Bordetella
bronchiseptica) 		4 / 8 SER A  76
LEU A  40
LEU A  38
ILE A  52
 PAC  A5000 (-2.6A)
None
None
None
 0.95A 4xtaB-3ixlA:
undetectable		 4xtaB-3ixlA:
21.52