SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1ef9'

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.
1MX1_D_THAD4_1
(LIVER
CARBOXYLESTERASE I)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		6 / 12 GLY A 109
GLY A 110
LEU A  28
LEU A  85
ILE A 115
PHE A  62
 2CP  A 270 ( 3.8A)
2CP  A 270 (-3.4A)
None
None
None
None
 1.30A 1mx1D-1ef9A:
undetectable		 1mx1D-1ef9A:
18.76
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.
1OIP_A_VIVA1278_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 12 VAL A 107
LEU A  36
VAL A   6
ILE A  17
ILE A  92
 None
 1.03A 1oipA-1ef9A:
4.6		 1oipA-1ef9A:
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.
1YA4_A_CTXA1_1
(CES1 PROTEIN)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		6 / 12 GLY A 109
GLY A 110
LEU A  28
SER A  29
LEU A  85
LEU A  71
 2CP  A 270 ( 3.8A)
2CP  A 270 (-3.4A)
None
None
None
None
 1.35A 1ya4A-1ef9A:
undetectable		 1ya4A-1ef9A:
18.66
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.
1YA4_B_CTXB2_1
(CES1 PROTEIN)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 12 GLY A 109
GLY A 110
LEU A  28
SER A  29
LEU A  85
 2CP  A 270 ( 3.8A)
2CP  A 270 (-3.4A)
None
None
None
 1.10A 1ya4B-1ef9A:
undetectable		 1ya4B-1ef9A:
18.66
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.
1YA4_B_CTXB2_1
(CES1 PROTEIN)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 12 GLY A 110
LEU A  28
SER A  29
LEU A  85
LEU A  71
 2CP  A 270 (-3.4A)
None
None
None
None
 1.17A 1ya4B-1ef9A:
undetectable		 1ya4B-1ef9A:
18.66
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.
1YA4_C_CTXC3_1
(CES1 PROTEIN)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		6 / 12 GLY A 109
GLY A 110
LEU A  28
SER A  29
LEU A  85
LEU A  71
 2CP  A 270 ( 3.8A)
2CP  A 270 (-3.4A)
None
None
None
None
 1.44A 1ya4C-1ef9A:
undetectable		 1ya4C-1ef9A:
18.66
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.
3BA0_A_HAEA477_1
(MACROPHAGE
METALLOELASTASE)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		3 / 3 HIS A 196
GLU A 200
HIS A 197
 None
 0.78A 3ba0A-1ef9A:
undetectable		 3ba0A-1ef9A:
20.05
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.
3FL9_C_TOPC200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 11 ALA A 111
VAL A 103
ILE A 177
LEU A 178
PHE A 129
 None
 1.21A 3fl9C-1ef9A:
undetectable		 3fl9C-1ef9A:
19.78
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.
3FL9_D_TOPD200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 9 ALA A 111
VAL A 103
ILE A 177
LEU A 178
PHE A 129
 None
 1.27A 3fl9D-1ef9A:
undetectable		 3fl9D-1ef9A:
19.78
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.
3FL9_F_TOPF200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 10 ALA A 111
VAL A 103
ILE A 177
LEU A 178
PHE A 129
 None
 1.21A 3fl9F-1ef9A:
undetectable		 3fl9F-1ef9A:
19.78
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.
3FL9_H_TOPH200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 9 ALA A 111
VAL A 103
ILE A 177
LEU A 178
PHE A 129
 None
 1.26A 3fl9H-1ef9A:
undetectable		 3fl9H-1ef9A:
19.78
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.
3PO7_A_ZONA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		4 / 8 LEU A  79
TYR A 140
TYR A 238
TYR A 243
 None
 1.23A 3po7A-1ef9A:
undetectable		 3po7A-1ef9A:
19.85
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.
3RUK_D_AERD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 11 PHE A  32
ILE A  88
GLY A 110
ALA A 111
VAL A 103
 None
None
2CP  A 270 (-3.4A)
None
None
 1.21A 3rukD-1ef9A:
undetectable		 3rukD-1ef9A:
18.15
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.
3UQ6_A_ADNA401_2
(ADENOSINE KINASE,
PUTATIVE)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		4 / 5 LEU A 160
ALA A 172
MET A 116
PHE A 129
 None
 1.23A 3uq6A-1ef9A:
undetectable		 3uq6A-1ef9A:
22.99
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.
4MM4_B_8PRB603_1
(TRANSPORTER)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 12 ALA A 124
VAL A 184
PHE A  62
SER A  59
GLY A 105
 None
 1.15A 4mm4B-1ef9A:
undetectable		 4mm4B-1ef9A:
20.00
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.
4QVY_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 10 ALA A 169
THR A 168
ALA A 172
VAL A 181
GLY A 105
 None
 0.94A 4qvyK-1ef9A:
undetectable
4qvyL-1ef9A:
undetectable		 4qvyK-1ef9A:
20.22
4qvyL-1ef9A:
22.18
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.
4QVY_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 10 ALA A 169
THR A 168
ALA A 172
VAL A 181
GLY A 105
 None
 0.93A 4qvyY-1ef9A:
undetectable
4qvyZ-1ef9A:
undetectable		 4qvyY-1ef9A:
20.22
4qvyZ-1ef9A:
22.18
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.
4Z69_I_DIFI1006_1
(SERUM ALBUMIN)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 10 LYS A   1
PHE A  95
LEU A  53
ILE A  99
ALA A  15
 None
 1.31A 4z69I-1ef9A:
undetectable		 4z69I-1ef9A:
16.55
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.
5HW8_G_FK5G201_2
(FK506-BINDING
PROTEIN 1)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 11 VAL A  16
ILE A  17
ILE A  92
ILE A  88
PHE A  19
 None
 1.11A 5hw8G-1ef9A:
undetectable		 5hw8G-1ef9A:
18.01
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.
5LG3_B_Z80B401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 9 ILE A  51
PHE A  95
VAL A   8
THR A  10
GLU A  47
 None
 1.46A 5lg3B-1ef9A:
undetectable		 5lg3B-1ef9A:
23.35
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.
5LG3_F_Z80F401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 1ef9 METHYLMALONYL COA
DECARBOXYLASE
(Escherichia
coli) 		5 / 10 ILE A  17
ILE A  51
PHE A  95
VAL A   8
GLU A  47
 None
 1.30A 5lg3F-1ef9A:
0.0		 5lg3F-1ef9A:
23.35