SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ecm'

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.
1HWI_C_115C4_1
(HMG-COA REDUCTASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		4 / 7 VAL A 178
SER A 176
ASN A  99
LYS A  -4
 None
 1.33A 1hwiC-4ecmA:
undetectable		 1hwiC-4ecmA:
20.72
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.
1HWI_D_115D3_2
(HMG-COA REDUCTASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		4 / 7 VAL A 178
SER A 176
ASN A  99
LYS A  -4
 None
 1.33A 1hwiD-4ecmA:
undetectable		 1hwiD-4ecmA:
20.72
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.
1JIP_A_KTNA801_1
(CYTOCHROME P450
107A1)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		5 / 12 ALA A 129
TYR A 174
GLY A 170
LEU A 203
LEU A 208
 None
None
DAU  A 301 ( 4.4A)
None
None
 1.17A 1jipA-4ecmA:
undetectable		 1jipA-4ecmA:
21.50
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.
1MXD_A_ACRA733_1
(ALPHA AMYLASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		4 / 6 THR A 218
ASN A 109
LEU A 106
ASP A 108
 None
DAU  A 301 (-3.3A)
DAU  A 301 (-3.8A)
DAU  A 301 (-3.5A)
 1.28A 1mxdA-4ecmA:
undetectable		 1mxdA-4ecmA:
21.56
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.
1P5Z_B_AR3B304_1
(DEOXYCYTIDINE KINASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		5 / 12 ILE A 105
VAL A 119
LEU A 173
ASP A 113
PHE A 111
 None
 1.46A 1p5zB-4ecmA:
undetectable		 1p5zB-4ecmA:
21.55
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.
3BF1_A_PAUA248_0
(TYPE III
PANTOTHENATE KINASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		5 / 11 ASN A 230
GLY A 221
ILE A  17
LEU A  26
THR A  18
 None
 1.40A 3bf1A-4ecmA:
undetectable
3bf1B-4ecmA:
undetectable		 3bf1A-4ecmA:
22.71
3bf1B-4ecmA:
22.71
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.
3BF1_C_PAUC248_0
(TYPE III
PANTOTHENATE KINASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		5 / 11 ASN A 230
GLY A 221
ILE A  17
LEU A  26
THR A  18
 None
 1.38A 3bf1C-4ecmA:
undetectable
3bf1D-4ecmA:
undetectable		 3bf1C-4ecmA:
22.71
3bf1D-4ecmA:
22.71
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.
3BF1_E_PAUE248_0
(TYPE III
PANTOTHENATE KINASE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		5 / 11 ASN A 230
GLY A 221
ILE A  17
LEU A  26
THR A  18
 None
 1.36A 3bf1E-4ecmA:
undetectable
3bf1F-4ecmA:
undetectable		 3bf1E-4ecmA:
22.71
3bf1F-4ecmA:
22.71
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.
3KP6_B_SALB3003_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		4 / 6 ILE A 105
VAL A 103
LEU A 173
LEU A 132
 None
 0.81A 3kp6A-4ecmA:
undetectable
3kp6B-4ecmA:
undetectable		 3kp6A-4ecmA:
21.88
3kp6B-4ecmA:
21.88
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.
3LSL_A_PZIA802_0
(GLUTAMATE RECEPTOR 2)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		3 / 3 ASP A 197
ASN A 200
SER A 188
 None
 0.95A 3lslA-4ecmA:
1.1
3lslD-4ecmA:
undetectable		 3lslA-4ecmA:
22.82
3lslD-4ecmA:
22.82
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.
3LSL_D_PZID802_0
(GLUTAMATE RECEPTOR 2)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		3 / 3 SER A 188
ASP A 197
ASN A 200
 None
 0.91A 3lslA-4ecmA:
1.1
3lslD-4ecmA:
undetectable		 3lslA-4ecmA:
22.82
3lslD-4ecmA:
22.82
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.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		3 / 3 GLY A 128
ASP A 175
ASN A  99
 None
 0.45A 5jglA-4ecmA:
2.3		 5jglA-4ecmA:
23.49
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.
6BQG_A_ERMA1201_1
(5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		5 / 12 VAL A  79
GLY A 107
ALA A  37
GLU A  56
VAL A  62
 None
DAU  A 301 ( 4.0A)
None
None
None
 1.18A 6bqgA-4ecmA:
undetectable		 6bqgA-4ecmA:
17.72
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.
6DWN_B_AQ4B602_1
(CYTOCHROME P450 1A1)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		4 / 7 ASN A  99
GLY A 128
ALA A 129
VAL A 104
 None
 0.83A 6dwnB-4ecmA:
undetectable		 6dwnB-4ecmA:
15.61
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.
6NM4_A_SAMA402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9)		 4ecm GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E
(Bacillus
anthracis) 		4 / 7 ALA A   7
GLY A   8
GLY A 221
ASN A  22
 None
DAU  A 301 ( 3.3A)
None
None
 0.69A 6nm4A-4ecmA:
undetectable		 6nm4A-4ecmA:
20.83