SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1hq0'

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.
1HTT_C_HISC450_0
(HISTIDYL-TRNA
SYNTHETASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 THR A 867
LEU A 924
GLY A 896
GLY A 883
ALA A 840
 None
 1.30A 1httC-1hq0A:
undetectable		 1httC-1hq0A:
22.52
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.
1HTT_D_HISD450_0
(HISTIDYL-TRNA
SYNTHETASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 THR A 867
LEU A 924
GLY A 896
GLY A 883
ALA A 840
 None
 1.29A 1httD-1hq0A:
undetectable		 1httD-1hq0A:
22.52
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.
1RQP_A_SAMA500_0
(5'-FLUORO-5'-DEOXYAD
ENOSINE SYNTHASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 10 LEU A 936
SER A 958
THR A 977
PHE A1010
SER A 992
 None
 1.44A 1rqpA-1hq0A:
0.0		 1rqpA-1hq0A:
22.02
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.
1RQP_B_SAMB500_0
(5'-FLUORO-5'-DEOXYAD
ENOSINE SYNTHASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 10 LEU A 936
SER A 958
THR A 977
PHE A1010
SER A 992
 None
 1.43A 1rqpB-1hq0A:
0.0		 1rqpB-1hq0A:
22.02
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.
1RQP_C_SAMC500_1
(5'-FLUORO-5'-DEOXYAD
ENOSINE SYNTHASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 10 LEU A 936
SER A 958
THR A 977
PHE A1010
SER A 992
 None
 1.41A 1rqpC-1hq0A:
0.0		 1rqpC-1hq0A:
22.02
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.
2I30_A_SALA1100_1
(SERUM ALBUMIN)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		4 / 6 PHE A 729
TYR A 755
ARG A 981
GLY A 853
 None
 1.23A 2i30A-1hq0A:
0.0		 2i30A-1hq0A:
18.56
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.
3A51_B_VDYB6178_1
(VITAMIN D
HYDROXYLASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 PRO A 855
THR A 828
LEU A 732
ILE A 746
THR A 974
 None
 1.39A 3a51B-1hq0A:
0.0		 3a51B-1hq0A:
19.47
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.
4AX8_A_SAMA1474_0
(WBDD)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 GLY A 842
ILE A 843
SER A 834
VAL A 833
ILE A 831
 None
None
PO4  A 302 ( 4.5A)
None
None
 0.94A 4ax8A-1hq0A:
undetectable		 4ax8A-1hq0A:
19.28
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.
4AX8_A_SAMA1474_0
(WBDD)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 GLY A 842
ILE A 843
SER A 834
VAL A 833
ILE A 858
 None
None
PO4  A 302 ( 4.5A)
None
None
 0.94A 4ax8A-1hq0A:
undetectable		 4ax8A-1hq0A:
19.28
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.
4AZT_A_SAMA1472_0
(METHYLTRANSFERASE
WBDD)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 GLY A 842
ALA A 840
ILE A 843
VAL A 833
ILE A 858
 None
 1.11A 4aztA-1hq0A:
undetectable		 4aztA-1hq0A:
19.28
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.
4AZV_A_SAMA1474_0
(WBDD)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 GLY A 842
ILE A 843
SER A 834
VAL A 833
ILE A 831
 None
None
PO4  A 302 ( 4.5A)
None
None
 0.94A 4azvA-1hq0A:
undetectable		 4azvA-1hq0A:
19.28
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.
4AZV_A_SAMA1474_0
(WBDD)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 GLY A 842
ILE A 843
SER A 834
VAL A 833
ILE A 858
 None
None
PO4  A 302 ( 4.5A)
None
None
 0.93A 4azvA-1hq0A:
undetectable		 4azvA-1hq0A:
19.28
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.
4IKK_A_SUZA201_1
(TRANSTHYRETIN)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		4 / 8 SER A 975
THR A 977
SER A 990
SER A 992
 None
 0.70A 4ikkA-1hq0A:
undetectable
4ikkB-1hq0A:
undetectable		 4ikkA-1hq0A:
21.14
4ikkB-1hq0A:
21.14
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.
4OR0_A_NPSA602_1
(SERUM ALBUMIN)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 9 PHE A 758
ALA A 760
ALA A 761
LEU A 904
VAL A 833
 None
 1.34A 4or0A-1hq0A:
undetectable		 4or0A-1hq0A:
18.91
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.
4XDT_A_ACTA406_0
(FAD:PROTEIN FMN
TRANSFERASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		4 / 5 SER A1011
LYS A1012
ARG A 989
LEU A 991
 None
 1.33A 4xdtA-1hq0A:
0.0		 4xdtA-1hq0A:
19.21
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.
4XR4_B_AG2B511_1
(HOMOSPERMIDINE
SYNTHASE)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		3 / 3 VAL A 856
PHE A 758
ARG A 777
 None
 0.65A 4xr4B-1hq0A:
undetectable		 4xr4B-1hq0A:
20.33
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.
5V0V_A_8QPA613_1
(SERUM ALBUMIN)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		4 / 8 VAL A 833
PHE A 787
THR A 802
GLY A 842
 None
 0.94A 5v0vA-1hq0A:
0.0		 5v0vA-1hq0A:
19.09
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.
6A7P_B_9SCB601_0
(SERUM ALBUMIN)		 1hq0 CYTOTOXIC
NECROTIZING FACTOR 1
(Escherichia
coli) 		5 / 12 ILE A 773
VAL A 870
VAL A 903
ALA A 761
LEU A 847
 None
 1.45A 6a7pB-1hq0A:
undetectable		 6a7pB-1hq0A:
18.56