SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2jc6'

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.
1J3J_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 10 ILE A 279
ALA A 284
PHE A 255
ILE A 125
THR A 283
 None
 1.27A 1j3jA-2jc6A:
undetectable		 1j3jA-2jc6A:
22.22
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.
1NSI_A_H4BA600_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.12A 1nsiA-2jc6A:
undetectable
1nsiB-2jc6A:
undetectable		 1nsiA-2jc6A:
19.73
1nsiB-2jc6A:
19.73
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.
1NSI_B_H4BB601_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.11A 1nsiA-2jc6A:
undetectable
1nsiB-2jc6A:
undetectable		 1nsiA-2jc6A:
19.73
1nsiB-2jc6A:
19.73
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.
1NSI_C_H4BC602_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.09A 1nsiC-2jc6A:
undetectable
1nsiD-2jc6A:
undetectable		 1nsiC-2jc6A:
19.73
1nsiD-2jc6A:
19.73
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.
1NSI_D_H4BD603_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.11A 1nsiC-2jc6A:
undetectable
1nsiD-2jc6A:
undetectable		 1nsiC-2jc6A:
19.73
1nsiD-2jc6A:
19.73
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.
1RE7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 12 ILE A 279
ALA A 284
PHE A 255
ILE A 125
THR A 283
 None
 1.19A 1re7B-2jc6A:
undetectable		 1re7B-2jc6A:
18.29
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.
1TW4_A_CHDA130_1
(FATTY ACID-BINDING
PROTEIN)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		3 / 3 TYR A 116
ARG A 126
GLN A 127
 None
 0.98A 1tw4A-2jc6A:
undetectable		 1tw4A-2jc6A:
19.30
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.
1XKK_A_FMMA91_2
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		6 / 9 LEU A  29
VAL A  37
LYS A  52
LEU A  84
LEU A  96
LEU A 100
 QPP  A1314 (-3.7A)
QPP  A1314 ( 4.6A)
None
None
None
QPP  A1314 (-4.5A)
 0.61A 1xkkA-2jc6A:
20.4		 1xkkA-2jc6A:
26.21
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.
2BLA_A_CP6A302_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 11 ILE A 279
ALA A 284
PHE A 255
ILE A 125
THR A 283
 None
 1.21A 2blaA-2jc6A:
undetectable		 2blaA-2jc6A:
20.59
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.
2FUM_D_MIXD3539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		6 / 12 LEU A  29
GLY A  30
GLY A  32
VAL A  37
ALA A  50
MET A  98
 QPP  A1314 (-3.7A)
QPP  A1314 ( 3.7A)
None
QPP  A1314 ( 4.6A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.1A)
 0.50A 2fumD-2jc6A:
23.1		 2fumD-2jc6A:
27.61
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.
2NSI_A_H4BA600_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.11A 2nsiA-2jc6A:
undetectable
2nsiB-2jc6A:
undetectable		 2nsiA-2jc6A:
19.73
2nsiB-2jc6A:
19.73
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.
2NSI_B_H4BB601_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.11A 2nsiA-2jc6A:
undetectable
2nsiB-2jc6A:
undetectable		 2nsiA-2jc6A:
19.73
2nsiB-2jc6A:
19.73
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.
2NSI_C_H4BC602_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.11A 2nsiC-2jc6A:
undetectable
2nsiD-2jc6A:
undetectable		 2nsiC-2jc6A:
19.73
2nsiD-2jc6A:
19.73
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.
2NSI_D_H4BD603_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.12A 2nsiC-2jc6A:
undetectable
2nsiD-2jc6A:
undetectable		 2nsiC-2jc6A:
19.73
2nsiD-2jc6A:
19.73
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.
2X45_C_HSMC1161_1
(ALLERGEN ARG R 1)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 5 VAL A 192
TYR A 198
ASP A 203
SER A 206
 None
 1.33A 2x45C-2jc6A:
undetectable		 2x45C-2jc6A:
17.88
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.
3CS9_D_NILD600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 LEU A  29
VAL A  37
LYS A  52
LEU A 151
 QPP  A1314 (-3.7A)
QPP  A1314 ( 4.6A)
None
None
 0.75A 3cs9D-2jc6A:
15.7		 3cs9D-2jc6A:
26.49
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.
3E7G_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.12A 3e7gA-2jc6A:
undetectable
3e7gB-2jc6A:
undetectable		 3e7gA-2jc6A:
20.59
3e7gB-2jc6A:
20.59
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.
3E7G_B_H4BB1902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.12A 3e7gA-2jc6A:
undetectable
3e7gB-2jc6A:
undetectable		 3e7gA-2jc6A:
20.59
3e7gB-2jc6A:
20.59
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.
3E7G_C_H4BC2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.12A 3e7gC-2jc6A:
undetectable
3e7gD-2jc6A:
undetectable		 3e7gC-2jc6A:
20.59
3e7gD-2jc6A:
20.59
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.
3E7G_D_H4BD3902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.13A 3e7gC-2jc6A:
undetectable
3e7gD-2jc6A:
undetectable		 3e7gC-2jc6A:
20.59
3e7gD-2jc6A:
20.59
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.
3EJ8_A_H4BA1902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.16A 3ej8A-2jc6A:
0.0
3ej8B-2jc6A:
0.0		 3ej8A-2jc6A:
20.59
3ej8B-2jc6A:
20.59
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.
3EJ8_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.13A 3ej8A-2jc6A:
0.0
3ej8B-2jc6A:
0.0		 3ej8A-2jc6A:
20.59
3ej8B-2jc6A:
20.59
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.
3EJ8_C_H4BC3902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.10A 3ej8C-2jc6A:
0.0
3ej8D-2jc6A:
0.0		 3ej8C-2jc6A:
20.59
3ej8D-2jc6A:
20.59
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.
3EJ8_D_H4BD4902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.13A 3ej8C-2jc6A:
0.0
3ej8D-2jc6A:
0.0		 3ej8C-2jc6A:
20.59
3ej8D-2jc6A:
20.59
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.
3GP0_A_NILA1_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 11)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 LYS A  52
LEU A  96
LEU A 100
ILE A  81
 None
None
QPP  A1314 (-4.5A)
None
 0.91A 3gp0A-2jc6A:
20.2		 3gp0A-2jc6A:
28.72
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.
3GP0_A_NILA1_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 11)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 LYS A  52
LEU A  96
LEU A 100
ILE A 163
 None
None
QPP  A1314 (-4.5A)
None
 0.60A 3gp0A-2jc6A:
20.2		 3gp0A-2jc6A:
28.72
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.
3IA4_A_MTXA164_2
(DIHYDROFOLATE
REDUCTASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 4 ILE A 279
PHE A 255
ILE A 125
THR A 283
 None
 1.07A 3ia4A-2jc6A:
undetectable		 3ia4A-2jc6A:
17.61
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.
3QGT_B_CP6B609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 10 ILE A 279
ALA A 284
PHE A 255
ILE A 125
THR A 283
 None
 1.26A 3qgtB-2jc6A:
undetectable		 3qgtB-2jc6A:
19.26
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.
4ASD_A_BAXA1500_2
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 ILE A  76
VAL A  82
LEU A 151
ILE A 163
 None
 0.76A 4asdA-2jc6A:
20.4		 4asdA-2jc6A:
25.31
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.
4CX7_A_H4BA600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.13A 4cx7A-2jc6A:
undetectable
4cx7B-2jc6A:
undetectable		 4cx7A-2jc6A:
19.73
4cx7B-2jc6A:
19.73
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.
4CX7_B_H4BB600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.10A 4cx7A-2jc6A:
undetectable
4cx7B-2jc6A:
undetectable		 4cx7A-2jc6A:
19.73
4cx7B-2jc6A:
19.73
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.
4CX7_C_H4BC600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.08A 4cx7C-2jc6A:
undetectable
4cx7D-2jc6A:
undetectable		 4cx7C-2jc6A:
19.73
4cx7D-2jc6A:
19.73
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.
4CX7_D_H4BD600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.11A 4cx7C-2jc6A:
undetectable
4cx7D-2jc6A:
undetectable		 4cx7C-2jc6A:
19.73
4cx7D-2jc6A:
19.73
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.
4G8Z_X_TOPX301_1
(DIHYDROFOLATE
REDUCTASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 10 ILE A 279
ALA A 284
PHE A 255
ILE A 125
THR A 283
 None
 1.24A 4g8zX-2jc6A:
undetectable		 4g8zX-2jc6A:
20.06
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.
4KM0_A_CP6A201_1
(DIHYDROFOLATE
REDUCTASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 10 ILE A 279
ALA A 284
PHE A 255
ILE A 125
THR A 283
 None
 1.21A 4km0A-2jc6A:
undetectable		 4km0A-2jc6A:
17.26
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.
4L9I_B_8PRB601_1
(RHODOPSIN KINASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 8 GLY A  32
VAL A  37
ALA A  50
LYS A  52
MET A  98
 None
QPP  A1314 ( 4.6A)
QPP  A1314 ( 3.7A)
None
QPP  A1314 ( 4.1A)
 0.31A 4l9iB-2jc6A:
17.2		 4l9iB-2jc6A:
25.10
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.
4NOS_B_H4BB1011_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.13A 4nosA-2jc6A:
undetectable
4nosB-2jc6A:
undetectable		 4nosA-2jc6A:
20.32
4nosB-2jc6A:
20.32
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.
4NOS_C_H4BC2011_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 ARG A 257
ILE A 248
TRP A 245
PHE A 240
 None
 1.15A 4nosC-2jc6A:
undetectable
4nosD-2jc6A:
undetectable		 4nosC-2jc6A:
20.32
4nosD-2jc6A:
20.32
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.
4NOS_D_H4BD3011_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 TRP A 245
PHE A 240
ARG A 257
ILE A 248
 None
 1.16A 4nosC-2jc6A:
undetectable
4nosD-2jc6A:
undetectable		 4nosC-2jc6A:
20.32
4nosD-2jc6A:
20.32
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.
4O1Z_A_MXMA807_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		6 / 12 ILE A 161
LEU A 129
GLY A 208
ALA A 211
LEU A 150
LEU A 106
 None
 1.09A 4o1zA-2jc6A:
undetectable		 4o1zA-2jc6A:
19.35
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.
4O1Z_A_MXMA807_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		6 / 12 ILE A 161
VAL A 128
LEU A 129
GLY A 208
ALA A 211
LEU A 106
 None
 1.43A 4o1zA-2jc6A:
undetectable		 4o1zA-2jc6A:
19.35
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.
4RZ7_A_1E8A901_1
(CGMP-DEPENDENT
PROTEIN KINASE,
PUTATIVE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 10 ALA A  50
LYS A  52
LEU A 100
VAL A 101
LEU A 151
 QPP  A1314 ( 3.7A)
None
QPP  A1314 (-4.5A)
QPP  A1314 (-4.0A)
None
 0.66A 4rz7A-2jc6A:
23.7		 4rz7A-2jc6A:
16.15
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.
4TYJ_A_0LIA801_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 4)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 6 LEU A  29
VAL A  37
LYS A  52
ILE A  81
ILE A 163
 QPP  A1314 (-3.7A)
QPP  A1314 ( 4.6A)
None
None
None
 0.69A 4tyjA-2jc6A:
20.6		 4tyjA-2jc6A:
25.75
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.
4V01_B_0LIB1770_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		6 / 9 LEU A  29
VAL A  37
LYS A  52
ILE A  76
ARG A 143
ILE A 163
 QPP  A1314 (-3.7A)
QPP  A1314 ( 4.6A)
None
None
None
None
 0.94A 4v01B-2jc6A:
21.4		 4v01B-2jc6A:
26.58
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.
4WBO_B_ANWB601_0
(RHODOPSIN KINASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 LEU A  29
ALA A  50
LEU A 151
SER A 164
 QPP  A1314 (-3.7A)
QPP  A1314 ( 3.7A)
None
None
 0.66A 4wboB-2jc6A:
21.4		 4wboB-2jc6A:
23.89
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.
4WBO_B_ANWB601_0
(RHODOPSIN KINASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 LEU A  29
ALA A  50
MET A  98
SER A 164
 QPP  A1314 (-3.7A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.1A)
None
 0.38A 4wboB-2jc6A:
21.4		 4wboB-2jc6A:
23.89
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.
4WBO_C_ANWC601_0
(RHODOPSIN KINASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 6 LEU A  29
ALA A  50
MET A  98
LEU A 151
 QPP  A1314 (-3.7A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.1A)
None
 0.75A 4wboC-2jc6A:
21.0		 4wboC-2jc6A:
23.89
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.
4ZAU_A_YY3A1101_1
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 8 LEU A  29
GLY A  30
VAL A  37
ALA A  50
LEU A 100
 QPP  A1314 (-3.7A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.6A)
QPP  A1314 ( 3.7A)
QPP  A1314 (-4.5A)
 0.39A 4zauA-2jc6A:
20.9		 4zauA-2jc6A:
27.25
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.
5HI2_A_BAXA801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 8 VAL A  37
ILE A  81
ILE A 140
ILE A 163
 QPP  A1314 ( 4.6A)
None
None
None
 0.61A 5hi2A-2jc6A:
22.9		 5hi2A-2jc6A:
27.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5IZJ_G_AZ1G2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAR-DAR)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 GLY A  30
GLY A  32
VAL A  37
LYS A  52
 QPP  A1314 ( 3.7A)
None
QPP  A1314 ( 4.6A)
None
 0.20A 5izjA-2jc6A:
17.7		 5izjA-2jc6A:
31.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5J5X_B_AZ1B2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAL-DAR-DAR-
DAR-DAR)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 7 GLY A  30
GLY A  32
VAL A  37
LYS A  52
 QPP  A1314 ( 3.7A)
None
QPP  A1314 ( 4.6A)
None
 0.30A 5j5xA-2jc6A:
22.9		 5j5xA-2jc6A:
31.77
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.
5LW1_E_ADNE401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 10 GLY A  30
VAL A  37
ALA A  50
MET A  98
LEU A 100
 QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.6A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.1A)
QPP  A1314 (-4.5A)
 0.67A 5lw1E-2jc6A:
19.3		 5lw1E-2jc6A:
13.17
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.
5LW1_H_ADNH401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		5 / 9 GLY A  30
VAL A  37
ALA A  50
MET A  98
LEU A 100
 QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.6A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.1A)
QPP  A1314 (-4.5A)
 0.70A 5lw1H-2jc6A:
19.7		 5lw1H-2jc6A:
13.17
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.
5VC3_A_DB8A601_2
(WEE1-LIKE PROTEIN
KINASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		4 / 4 VAL A  37
LYS A  52
VAL A  82
ASN A 149
 QPP  A1314 ( 4.6A)
None
None
None
 0.91A 5vc3A-2jc6A:
21.2		 5vc3A-2jc6A:
23.70
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.
5YU9_A_1E8A1101_1
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		6 / 12 LEU A  29
GLY A  30
VAL A  37
ALA A  50
LYS A  52
LEU A  96
 QPP  A1314 (-3.7A)
QPP  A1314 ( 3.7A)
QPP  A1314 ( 4.6A)
QPP  A1314 ( 3.7A)
None
None
 0.57A 5yu9A-2jc6A:
20.3		 5yu9A-2jc6A:
14.07
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.
6DH0_A_017A101_2
(PROTEASE)		 2jc6 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1D
(Homo
sapiens) 		3 / 3 LEU A  48
ASP A  86
ILE A  19
 None
 0.57A 6dh0B-2jc6A:
undetectable		 6dh0B-2jc6A:
13.11