SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ir4'

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.
1DVT_A_FLPA125_1
(TRANSTHYRETIN)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 8 ALA A 141
LEU A 143
LEU A 210
LEU A 184
 None
 0.94A 1dvtA-3ir4A:
undetectable
1dvtB-3ir4A:
undetectable		 1dvtA-3ir4A:
18.69
1dvtB-3ir4A:
18.69
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.
2OIQ_A_STIA1001_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 5 LEU A  28
VAL A 185
LEU A 182
MET A  17
 None
 1.05A 2oiqA-3ir4A:
undetectable		 2oiqA-3ir4A:
22.62
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.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 6 PHE A  11
PRO A  49
GLU A  61
SER A  62
 GSH  A 216 (-3.8A)
GSH  A 216 (-4.3A)
GSH  A 216 (-3.2A)
GSH  A 216 (-2.6A)
 0.24A 3vlnA-3ir4A:
15.0		 3vlnA-3ir4A:
24.90
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.
3W9T_C_W9TC1001_1
(HEMOLYTIC LECTIN
CEL-III)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 5 VAL A 159
GLY A 166
TYR A 197
ASP A 172
 None
 1.50A 3w9tC-3ir4A:
undetectable		 3w9tC-3ir4A:
18.20
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.
3W9T_D_W9TD502_1
(HEMOLYTIC LECTIN
CEL-III)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 5 VAL A 159
GLY A 166
TYR A 197
ASP A 172
 None
 1.49A 3w9tD-3ir4A:
undetectable		 3w9tD-3ir4A:
18.20
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.
3W9T_E_W9TE504_1
(HEMOLYTIC LECTIN
CEL-III)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 5 VAL A 159
GLY A 166
TYR A 197
ASP A 172
 None
 1.50A 3w9tE-3ir4A:
undetectable		 3w9tE-3ir4A:
18.20
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.
4NTX_A_AMRA509_1
(ACID-SENSING ION
CHANNEL 1
BASIC PHOSPHOLIPASE
A2 HOMOLOG TX-BETA)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 6 ASP A   7
GLU A 112
ASN A 181
ARG A 180
 None
 1.32A 4ntxA-3ir4A:
undetectable
4ntxC-3ir4A:
undetectable		 4ntxA-3ir4A:
20.96
4ntxC-3ir4A:
18.81
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.
4O5F_A_PAUA301_0
(TYPE III
PANTOTHENATE KINASE)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		5 / 12 ASN A  94
VAL A  93
LEU A 153
ILE A  86
LEU A 175
 CL  A 217 ( 4.5A)
None
None
None
None
 1.29A 4o5fA-3ir4A:
undetectable
4o5fB-3ir4A:
undetectable		 4o5fA-3ir4A:
20.71
4o5fB-3ir4A:
20.71
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.
4OKB_A_198A1002_2
(ANDROGEN RECEPTOR)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 6 LEU A  90
ASN A  94
LEU A 179
VAL A 185
 None
CL  A 217 ( 4.5A)
None
None
 1.18A 4okbA-3ir4A:
undetectable		 4okbA-3ir4A:
21.09
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.
4XTA_B_DIFB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3ir4 GLUTAREDOXIN 2
(Salmonella
enterica) 		4 / 8 ILE A   5
LEU A 210
LEU A 209
ILE A 207
 None
 0.79A 4xtaB-3ir4A:
undetectable		 4xtaB-3ir4A:
25.18