SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4b5x'

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.
2ADM_A_SAMA500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		5 / 11 ALA A 231
PRO A 173
ILE A  16
ALA A 219
ASP A  37
 None
 1.34A 2admA-4b5xA:
undetectable		 2admA-4b5xA:
21.57
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.
2X2N_A_X2NA1480_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		5 / 12 PHE A 229
PRO A 173
ALA A 174
ALA A 208
MET A  94
 None
 1.23A 2x2nA-4b5xA:
undetectable		 2x2nA-4b5xA:
17.75
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.
2X2N_B_X2NB1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		5 / 12 PHE A 229
PRO A 173
ALA A 174
ALA A 208
MET A  94
 None
 1.24A 2x2nB-4b5xA:
undetectable		 2x2nB-4b5xA:
17.75
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.
2XRL_A_DXTA1211_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		5 / 12 SER A  23
THR A  52
VAL A  53
GLN A  56
LEU A  57
 PO4  A1253 (-4.3A)
None
None
None
None
 0.48A 2xrlA-4b5xA:
undetectable		 2xrlA-4b5xA:
22.76
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.
3IX9_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		5 / 12 ILE A  41
ALA A  28
GLN A  66
ARG A 127
VAL A  53
 None
 1.17A 3ix9B-4b5xA:
undetectable		 3ix9B-4b5xA:
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.
3KO0_L_TFPL201_1
(PROTEIN S100-A4)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		4 / 7 GLY A  86
PHE A 170
PHE A 229
PHE A   5
 None
 1.15A 3ko0L-4b5xA:
undetectable
3ko0N-4b5xA:
undetectable		 3ko0L-4b5xA:
15.27
3ko0N-4b5xA:
15.27
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.
3KO0_T_TFPT201_1
(PROTEIN S100-A4)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		4 / 7 PHE A   5
GLY A  86
PHE A 170
PHE A 229
 None
 1.12A 3ko0R-4b5xA:
undetectable
3ko0T-4b5xA:
undetectable		 3ko0R-4b5xA:
15.27
3ko0T-4b5xA:
15.27
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.
3SUD_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		5 / 12 GLY A 206
ILE A 171
GLY A 168
ALA A 208
ALA A 227
 None
 1.13A 3sudB-4b5xA:
undetectable		 3sudB-4b5xA:
24.11
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.
4JLT_A_8PRA505_1
(CYTOCHROME P450 2B4)		 4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE
(Escherichia
coli) 		4 / 8 ALA A 107
VAL A  92
PRO A  93
VAL A  69
 None
 0.68A 4jltA-4b5xA:
undetectable		 4jltA-4b5xA:
20.25