SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3re3'

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.
1EI6_C_PPFC413_1
(PHOSPHONOACETATE
HYDROLASE)		 3re3 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Francisella
tularensis) 		4 / 8 PHE A  14
THR A  15
ASP A  39
HIS A  12
 None
 0.83A 1ei6C-3re3A:
undetectable		 1ei6C-3re3A:
17.65
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.
1EI6_D_PPFD412_1
(PHOSPHONOACETATE
HYDROLASE)		 3re3 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Francisella
tularensis) 		4 / 8 PHE A  14
THR A  15
ASP A  39
HIS A  12
 None
 0.75A 1ei6D-3re3A:
undetectable		 1ei6D-3re3A:
17.65
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.
2BR4_B_SAMB301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3re3 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Francisella
tularensis) 		5 / 12 GLY A   8
CYH A 155
ASP A  49
ALA A  50
ALA A  54
 None
 1.26A 2br4B-3re3A:
undetectable		 2br4B-3re3A:
21.98
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.
2BXM_A_IMNA2002_1
(SERUM ALBUMIN)		 3re3 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Francisella
tularensis) 		5 / 11 ARG A 159
ILE A  51
LEU A  47
ARG A   4
GLY A   6
 None
None
None
NA  A 165 (-4.4A)
None
 1.38A 2bxmA-3re3A:
undetectable		 2bxmA-3re3A:
12.16
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.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 3re3 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE
(Francisella
tularensis) 		4 / 7 PHE A  14
THR A  15
ASP A  39
HIS A  12
 None
 0.84A 3t01A-3re3A:
undetectable		 3t01A-3re3A:
18.61