SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4O0'


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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_A_5D5A930_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
10 / 12 LEU A  79
ASP A 172
THR A 210
PHE A 211
LEU A 214
PRO A 259
ILE A 262
PHE A 275
TRP A 276
ARG A 285
None
ZN  A 904 ( 2.2A)
ZN  A 904 ( 2.6A)
NKN  A 909 ( 4.7A)
4O0  A 908 ( 4.4A)
4O0  A 908 ( 4.9A)
None
4O0  A 908 (-3.7A)
None
None
0.64A 5dlvA-4zg7A:
59.4
5dlvA-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_A_5D5A930_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
6 / 6 SER A  82
TYR A  83
LYS A 249
PHE A 250
TRP A 255
TRP A 261
4O0  A 908 ( 2.9A)
None
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.3A)
4O0  A 908 (-4.4A)
0.53A 5dlvA-4zg7A:
59.4
5dlvA-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_B_5D5B927_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
11 / 12 LEU A  79
ASP A 172
THR A 210
PHE A 211
LEU A 214
PRO A 259
TRP A 261
ILE A 262
PHE A 275
TRP A 276
ARG A 285
None
ZN  A 904 ( 2.2A)
ZN  A 904 ( 2.6A)
NKN  A 909 ( 4.7A)
4O0  A 908 ( 4.4A)
4O0  A 908 ( 4.9A)
4O0  A 908 (-4.4A)
None
4O0  A 908 (-3.7A)
None
None
0.59A 5dlvB-4zg7A:
59.4
5dlvB-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_B_5D5B927_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
6 / 12 LEU A  79
PRO A 259
TRP A 261
ILE A 262
TRP A 276
VAL A 279
None
4O0  A 908 ( 4.9A)
4O0  A 908 (-4.4A)
None
None
GOL  A 910 (-4.1A)
1.10A 5dlvB-4zg7A:
59.4
5dlvB-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_B_5D5B927_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
4 / 7 LYS A 249
HIS A 252
TRP A 255
TYR A 307
4O0  A 908 (-4.0A)
4O0  A 908 (-3.7A)
4O0  A 908 (-3.3A)
NKN  A 909 (-3.6A)
1.27A 5dlvB-4zg7A:
59.4
5dlvB-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_B_5D5B927_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
5 / 7 SER A  82
TYR A  83
LYS A 249
PHE A 250
TRP A 255
4O0  A 908 ( 2.9A)
None
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.3A)
0.60A 5dlvB-4zg7A:
59.4
5dlvB-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLV_B_5D5B927_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
5 / 7 TYR A  83
LYS A 249
PHE A 250
HIS A 252
TRP A 255
None
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.7A)
4O0  A 908 (-3.3A)
0.81A 5dlvB-4zg7A:
59.4
5dlvB-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLW_A_5D5A905_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
10 / 12 LEU A  79
SER A  82
PHE A 211
ARG A 247
LYS A 249
PHE A 250
TRP A 255
TRP A 261
PHE A 275
VAL A 278
None
4O0  A 908 ( 2.9A)
NKN  A 909 ( 4.7A)
None
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.3A)
4O0  A 908 (-4.4A)
4O0  A 908 (-3.7A)
4O0  A 908 ( 3.5A)
0.56A 5dlwA-4zg7A:
59.6
5dlwA-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLW_A_5D5A905_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
8 / 12 PHE A 211
ARG A 247
LYS A 249
PHE A 250
HIS A 252
TRP A 255
TRP A 261
PHE A 275
NKN  A 909 ( 4.7A)
None
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.7A)
4O0  A 908 (-3.3A)
4O0  A 908 (-4.4A)
4O0  A 908 (-3.7A)
0.73A 5dlwA-4zg7A:
59.6
5dlwA-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLW_A_5D5A905_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
6 / 12 PHE A 211
LYS A 249
PHE A 250
HIS A 252
TRP A 255
TYR A 307
NKN  A 909 ( 4.7A)
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.7A)
4O0  A 908 (-3.3A)
NKN  A 909 (-3.6A)
1.22A 5dlwA-4zg7A:
59.6
5dlwA-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLW_A_5D5A905_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
6 / 12 PHE A 211
LYS A 249
PHE A 250
TRP A 255
VAL A 278
TYR A 307
NKN  A 909 ( 4.7A)
4O0  A 908 (-4.0A)
4O0  A 908 (-4.5A)
4O0  A 908 (-3.3A)
4O0  A 908 ( 3.5A)
NKN  A 909 (-3.6A)
1.50A 5dlwA-4zg7A:
59.6
5dlwA-4zg7A:
92.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5DLW_A_5D5A905_0
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
5 / 12 SER A 277
PHE A 211
HIS A 252
TRP A 255
TRP A 261
GOL  A 910 ( 4.4A)
NKN  A 909 ( 4.7A)
4O0  A 908 (-3.7A)
4O0  A 908 (-3.3A)
4O0  A 908 (-4.4A)
1.45A 5dlwA-4zg7A:
59.6
5dlwA-4zg7A:
92.72
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.
6CNK_B_NCTB402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)
4zg7 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2

(Homo
sapiens)
4 / 7 TYR A 215
CYH A 514
TYR A 510
TRP A 261
4O0  A 908 (-4.3A)
None
None
4O0  A 908 (-4.4A)
1.50A 6cnkB-4zg7A:
undetectable
6cnkC-4zg7A:
undetectable
6cnkB-4zg7A:
6.95
6cnkC-4zg7A:
8.16