SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4jug'

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.
1EQU_A_EQIA329_0
(PROTEIN (ESTRADIOL
17
BETA-DEHYDROGENASE
1))		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		5 / 10 SER A 111
VAL A 112
LEU A 260
GLY A 263
GLU A 116
 None
 1.25A 1equA-4jugA:
undetectable		 1equA-4jugA:
21.82
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.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 7 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.93A 1gtiB-4jugA:
undetectable		 1gtiB-4jugA:
20.06
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)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 7 ARG A 212
VAL A 202
SER A 203
ASN A 210
 None
 1.28A 1hwiC-4jugA:
undetectable		 1hwiC-4jugA:
21.21
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)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 7 ARG A 212
VAL A 202
SER A 203
ASN A 210
 None
 1.28A 1hwiD-4jugA:
undetectable		 1hwiD-4jugA:
21.21
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.
2OXT_D_SAMD300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 4 SER A 125
TRP A 127
ASP A 241
ILE A 243
 None
 1.28A 2oxtD-4jugA:
undetectable		 2oxtD-4jugA:
21.19
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.
4BBO_C_ACTC1113_0
(BLR5658 PROTEIN)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 4 ASN A  60
ALA A  62
GLY A  63
THR A  93
 None
 1.36A 4bboC-4jugA:
undetectable		 4bboC-4jugA:
15.43
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.
4BBO_C_ACTC1113_0
(BLR5658 PROTEIN)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 4 ASN A  60
ALA A  62
GLY A  92
THR A  93
 None
 0.85A 4bboC-4jugA:
undetectable		 4bboC-4jugA:
15.43
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.
4EQ4_A_SALA601_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 7 LEU A 194
TYR A 195
ILE A 252
GLY A 134
 None
 0.96A 4eq4A-4jugA:
undetectable		 4eq4A-4jugA:
20.69
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.
4L39_A_SALA602_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 6 LEU A 194
TYR A 195
ILE A 252
GLY A 134
 None
 0.96A 4l39A-4jugA:
undetectable		 4l39A-4jugA:
20.69
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.
5ESG_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4jug HEMAGGLUTININ
(Influenza
A
virus) 		4 / 4 LEU A 177
TYR A 148
PRO A 254
ILE A 120
 None
 1.31A 5esgA-4jugA:
undetectable		 5esgA-4jugA:
21.20