SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'ICT'


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.
2AJY_H_BEZH306_0
(ANTIBODY 7A1 FAB')		 1xkd ISOCITRATE
DEHYDROGENASE
(Aeropyrum
pernix) 		4 / 4 ASN A 307
ALA A 305
ARG A 159
TYR A 312
 None
None
ICT  A1002 (-2.7A)
None
 1.35A 2ajyH-1xkdA:
0.0		 2ajyH-1xkdA:
18.99
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_F_SC2F1289_1
(FICOLIN-2)		 1lwd ISOCITRATE
DEHYDROGENASE
(Sus
scrofa) 		4 / 6 ARG A 101
ASP A 279
SER A 278
SER A 293
 ICT  A 701 ( 3.0A)
MN  A 501 (-4.0A)
None
None
 0.98A 2j2pD-1lwdA:
undetectable
2j2pF-1lwdA:
0.0		 2j2pD-1lwdA:
19.66
2j2pF-1lwdA:
19.66
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.
2YFB_A_ACTA501_0
(METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER)		 1xkd ISOCITRATE
DEHYDROGENASE
(Aeropyrum
pernix) 		4 / 7 ASP A 315
VAL A 138
ARG A 136
ILE A 157
 CA  A1006 (-2.9A)
None
ICT  A1002 (-3.0A)
None
 1.01A 2yfbA-1xkdA:
0.0		 2yfbA-1xkdA:
21.38
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.
2YFB_B_ACTB501_0
(METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER)		 1xkd ISOCITRATE
DEHYDROGENASE
(Aeropyrum
pernix) 		4 / 6 ASP A 315
VAL A 138
ARG A 136
ILE A 157
 CA  A1006 (-2.9A)
None
ICT  A1002 (-3.0A)
None
 1.05A 2yfbB-1xkdA:
undetectable		 2yfbB-1xkdA:
21.38
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.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)		 1lwd ISOCITRATE
DEHYDROGENASE
(Sus
scrofa) 		3 / 3 SER A 278
GLU A 306
ASP A 275
 None
ICT  A 701 ( 4.2A)
MN  A 501 (-2.8A)
 0.61A 2zthA-1lwdA:
2.6		 2zthA-1lwdA:
22.87
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.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)		 4aov ISOCITRATE
DEHYDROGENASE [NADP]
(Desulfotalea
psychrophila) 		3 / 3 SER A 275
GLU A 302
ASP A 272
 None
ICT  A1404 ( 4.3A)
MG  A1405 ( 2.8A)
 0.68A 2zthA-4aovA:
2.3		 2zthA-4aovA:
20.49
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.
3BWM_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 1lwd ISOCITRATE
DEHYDROGENASE
(Sus
scrofa) 		3 / 3 SER A 278
GLU A 306
ASP A 275
 None
ICT  A 701 ( 4.2A)
MN  A 501 (-2.8A)
 0.66A 3bwmA-1lwdA:
2.2		 3bwmA-1lwdA:
20.90
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.
3BWM_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 4aov ISOCITRATE
DEHYDROGENASE [NADP]
(Desulfotalea
psychrophila) 		3 / 3 SER A 275
GLU A 302
ASP A 272
 None
ICT  A1404 ( 4.3A)
MG  A1405 ( 2.8A)
 0.75A 3bwmA-4aovA:
undetectable		 3bwmA-4aovA:
20.30
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.
3BWY_A_SAMA301_1
(COMT PROTEIN)		 1lwd ISOCITRATE
DEHYDROGENASE
(Sus
scrofa) 		3 / 3 SER A 278
GLU A 306
ASP A 275
 None
ICT  A 701 ( 4.2A)
MN  A 501 (-2.8A)
 0.64A 3bwyA-1lwdA:
2.7		 3bwyA-1lwdA:
20.65
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.
3BWY_A_SAMA301_1
(COMT PROTEIN)		 4aov ISOCITRATE
DEHYDROGENASE [NADP]
(Desulfotalea
psychrophila) 		3 / 3 SER A 275
GLU A 302
ASP A 272
 None
ICT  A1404 ( 4.3A)
MG  A1405 ( 2.8A)
 0.70A 3bwyA-4aovA:
undetectable		 3bwyA-4aovA:
20.30
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.
3ZOA_A_ACRA1587_2
(TREHALOSE
SYNTHASE/AMYLASE
TRES)		 2csg PUTATIVE CYTOPLASMIC
PROTEIN
(Salmonella
enterica) 		3 / 3 ARG A 187
PHE A 391
PRO A 388
 ICT  A 501 (-3.6A)
ICT  A 501 (-4.5A)
None
 0.87A 3zoaB-2csgA:
undetectable		 3zoaB-2csgA:
21.97
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.
4A9J_B_TYLB1187_1
(BROMODOMAIN
CONTAINING 2)		 1w8g HYPOTHETICAL UPF0001
PROTEIN YGGS
(Escherichia
coli) 		4 / 5 VAL A 152
LEU A 155
LEU A 158
ILE A 108
 None
None
None
ICT  A1230 ( 4.2A)
 0.89A 4a9jB-1w8gA:
undetectable		 4a9jB-1w8gA:
18.78
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.
4A9J_C_TYLC1184_1
(BROMODOMAIN
CONTAINING 2)		 1w8g HYPOTHETICAL UPF0001
PROTEIN YGGS
(Escherichia
coli) 		4 / 5 VAL A 152
LEU A 155
LEU A 158
ILE A 108
 None
None
None
ICT  A1230 ( 4.2A)
 0.79A 4a9jC-1w8gA:
undetectable		 4a9jC-1w8gA:
18.78
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.
4LZR_A_LOCA201_1
(BROMODOMAIN-CONTAINI
NG PROTEIN 4)		 1w8g HYPOTHETICAL UPF0001
PROTEIN YGGS
(Escherichia
coli) 		4 / 8 VAL A 152
LEU A 155
LEU A 158
ILE A 108
 None
None
None
ICT  A1230 ( 4.2A)
 0.81A 4lzrA-1w8gA:
undetectable		 4lzrA-1w8gA:
16.96
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.
4NED_A_PFNA709_1
(LACTOTRANSFERRIN)		 1lwd ISOCITRATE
DEHYDROGENASE
(Sus
scrofa) 		4 / 6 ASP A 279
ASP A 275
SER A  95
ALA A 308
 MN  A 501 (-4.0A)
MN  A 501 (-2.8A)
ICT  A 701 ( 2.4A)
ICT  A 701 ( 4.2A)
 1.23A 4nedA-1lwdA:
undetectable		 4nedA-1lwdA:
21.89
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.
4XUD_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 1lwd ISOCITRATE
DEHYDROGENASE
(Sus
scrofa) 		3 / 3 SER A 278
GLU A 306
ASP A 275
 None
ICT  A 701 ( 4.2A)
MN  A 501 (-2.8A)
 0.66A 4xudA-1lwdA:
2.2		 4xudA-1lwdA:
20.38
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.
4XUD_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 4aov ISOCITRATE
DEHYDROGENASE [NADP]
(Desulfotalea
psychrophila) 		3 / 3 SER A 275
GLU A 302
ASP A 272
 None
ICT  A1404 ( 4.3A)
MG  A1405 ( 2.8A)
 0.75A 4xudA-4aovA:
undetectable		 4xudA-4aovA:
20.15
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.
5A7M_A_ACTA1923_0
(BETA-XYLOSIDASE)		 2csg PUTATIVE CYTOPLASMIC
PROTEIN
(Salmonella
enterica) 		3 / 3 ASP A 186
ARG A 187
TYR A 361
 ICT  A 501 (-2.6A)
ICT  A 501 (-3.6A)
SIN  A 502 (-4.2A)
 0.58A 5a7mA-2csgA:
undetectable		 5a7mA-2csgA:
19.82
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.
5A7M_B_ACTB1924_0
(BETA-XYLOSIDASE)		 2csg PUTATIVE CYTOPLASMIC
PROTEIN
(Salmonella
enterica) 		3 / 3 ASP A 186
ARG A 187
TYR A 361
 ICT  A 501 (-2.6A)
ICT  A 501 (-3.6A)
SIN  A 502 (-4.2A)
 0.61A 5a7mB-2csgA:
undetectable		 5a7mB-2csgA:
19.82