SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3r2i'

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.
1S1X_A_NVPA999_1
(REVERSE
TRANSCRIPTASE)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		4 / 8 LEU A 231
TYR A 183
GLY A 185
LEU A 176
 None
 1.03A 1s1xA-3r2iA:
2.3		 1s1xA-3r2iA:
19.20
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.
2DTT_C_H4BC1002_1
(HYPOTHETICAL PROTEIN
PH0634)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		4 / 6 TYR A  94
ASP A  90
THR A 123
GLU A 162
 None
 1.44A 2dttB-3r2iA:
undetectable
2dttC-3r2iA:
undetectable		 2dttB-3r2iA:
18.88
2dttC-3r2iA:
18.88
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.
2J2P_B_SC2B1290_1
(FICOLIN-2)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		4 / 8 LEU A 231
SER A 187
LEU A 182
ASP A 188
 None
 0.87A 2j2pA-3r2iA:
undetectable
2j2pB-3r2iA:
undetectable		 2j2pA-3r2iA:
21.82
2j2pB-3r2iA:
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.
3F78_A_ICFA1_1
(INTEGRIN ALPHA-L)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		5 / 9 ILE A 224
LYS A 160
GLU A 167
LEU A 168
LYS A 171
 None
 1.19A 3f78A-3r2iA:
undetectable		 3f78A-3r2iA:
22.13
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.
3QL3_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		5 / 12 ILE A 224
LEU A 165
ILE A 192
ARG A 173
ILE A 227
 None
 1.02A 3ql3A-3r2iA:
undetectable		 3ql3A-3r2iA:
20.95
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.
4J4V_D_SVRD301_1
(NUCLEOCAPSID PROTEIN)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		5 / 11 ARG A 214
VAL A 163
PRO A 137
PHE A 156
ILE A 227
 None
 1.09A 4j4vD-3r2iA:
undetectable
4j4vE-3r2iA:
undetectable		 4j4vD-3r2iA:
22.03
4j4vE-3r2iA:
22.03
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.
5IL1_A_SAMA601_0
(METTL3)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		5 / 12 ASP A 169
ILE A 172
ARG A 173
LEU A 206
ASN A 226
 None
 0.89A 5il1A-3r2iA:
undetectable		 5il1A-3r2iA:
21.59
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.
5K7U_A_SAMA601_0
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		5 / 12 ASP A 169
ILE A 172
ARG A 173
LEU A 206
ASN A 226
 None
 0.81A 5k7uA-3r2iA:
undetectable		 5k7uA-3r2iA:
22.35
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.
6FGC_A_ACTA811_0
(GEPHYRIN)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		3 / 3 LEU A 176
LEU A 206
ARG A 173
 None
 0.67A 6fgcA-3r2iA:
undetectable		 6fgcA-3r2iA:
19.27
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.
6FGD_A_ACTA810_0
(GEPHYRIN)		 3r2i EXOTOXIN 5
(Staphylococcus
aureus) 		3 / 3 LEU A 176
LEU A 206
ARG A 173
 None
 0.64A 6fgdA-3r2iA:
undetectable		 6fgdA-3r2iA:
19.27