SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1xdq'

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.
1SG9_A_SAMA301_0
(HEMK PROTEIN)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 12 ILE A 196
GLY A 190
ILE A 206
THR A 177
VAL A 180
 None
 1.15A 1sg9A-1xdqA:
undetectable		 1sg9A-1xdqA:
23.10
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.
2YGN_A_PCFA1179_0
(WNT INHIBITORY
FACTOR 1)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 12 ILE A 212
LEU A 214
ILE A  72
PHE A 135
VAL A 197
 None
 1.12A 2ygnA-1xdqA:
undetectable		 2ygnA-1xdqA:
18.79
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.
3JAY_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 12 GLY A 232
ALA A 235
PRO A 228
ALA A 227
TYR A 160
 None
None
None
None
MTE  A 301 (-3.6A)
 0.81A 3jayA-1xdqA:
undetectable		 3jayA-1xdqA:
13.26
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.
3NXU_A_RITA600_2
(CYTOCHROME P450 3A4)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		4 / 7 ARG A 194
ILE A 206
LEU A  70
THR A  65
 MTE  A 301 (-2.8A)
None
None
None
 0.95A 3nxuA-1xdqA:
undetectable		 3nxuA-1xdqA:
22.06
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.
3QG2_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 10 ILE A 206
PHE A 135
SER A  73
ILE A  72
THR A 221
 None
 1.45A 3qg2A-1xdqA:
undetectable		 3qg2A-1xdqA:
18.60
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.
3UM5_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 10 ILE A 206
SER A  73
ILE A  72
ILE A 209
THR A 221
 None
 1.23A 3um5B-1xdqA:
undetectable		 3um5B-1xdqA:
18.44
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.
4DTZ_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 6 PHE A  46
ALA A  60
ALA A 191
LEU A  63
THR A  65
 MTE  A 301 (-4.7A)
None
None
None
None
 1.25A 4dtzA-1xdqA:
undetectable		 4dtzA-1xdqA:
20.25
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.
4DTZ_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 6 PHE A  46
ALA A  60
ALA A 191
PRO A 192
LEU A  63
 MTE  A 301 (-4.7A)
None
None
None
None
 1.11A 4dtzA-1xdqA:
undetectable		 4dtzA-1xdqA:
20.25
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.
4P68_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		5 / 11 ILE A 206
SER A  73
ILE A  72
ILE A 209
THR A 221
 None
 1.14A 4p68A-1xdqA:
undetectable		 4p68A-1xdqA:
18.67
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_1
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		3 / 3 ASP A  38
ASN A  44
GLN A 188
 None
MTE  A 301 (-4.0A)
None
 0.83A 5k7uA-1xdqA:
undetectable		 5k7uA-1xdqA:
20.79
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.
5VC0_A_RITA602_2
(CYTOCHROME P450 3A4)		 1xdq BACTERIAL SULFITE
OXIDASE
(Escherichia
coli) 		4 / 7 ARG A 194
ILE A 206
LEU A  70
THR A  65
 MTE  A 301 (-2.8A)
None
None
None
 0.91A 5vc0A-1xdqA:
undetectable		 5vc0A-1xdqA:
22.18