SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'TMP'


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.
1GMK_D_DVAD8_0
(GRAMICIDIN A)		 4xr9 CALS8
(Micromonospora
echinospora) 		3 / 3 TRP A 223
VAL A 229
TRP A 224
 None
TMP  A 503 (-4.4A)
None
 1.42A 1gmkC-4xr9A:
undetectable
1gmkD-4xr9A:
undetectable		 1gmkC-4xr9A:
5.36
1gmkD-4xr9A:
5.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI2_A_GA2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		10 / 11 HIS A  58
GLU A  83
ILE A 100
TYR A 101
GLN A 125
MET A 128
ARG A 163
TYR A 172
ARG A 176
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.5A)
 0.68A 1ki2A-1vtkA:
47.4		 1ki2A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI2_A_GA2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 11 HIS A  58
ILE A  97
TYR A 101
MET A  85
ARG A 163
 TMP  A 500 (-3.8A)
TMP  A 500 ( 4.5A)
TMP  A 500 (-4.5A)
None
TMP  A 500 (-3.3A)
 1.45A 1ki2A-1vtkA:
47.4		 1ki2A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI2_A_GA2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		10 / 11 HIS A  58
ILE A 100
TYR A 101
GLN A 125
MET A 128
ARG A 163
TYR A 172
ARG A 176
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.60A 1ki2A-1vtkA:
47.4		 1ki2A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI2_B_GA2B2_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		12 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A 100
TYR A 101
GLN A 125
MET A 128
ARG A 163
TYR A 172
ARG A 176
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.69A 1ki2B-1vtkA:
48.2		 1ki2B-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI2_B_GA2B2_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 HIS A  58
ILE A  97
TYR A 101
MET A  85
ARG A 163
 TMP  A 500 (-3.8A)
TMP  A 500 ( 4.5A)
TMP  A 500 (-4.5A)
None
TMP  A 500 (-3.3A)
 1.41A 1ki2B-1vtkA:
48.2		 1ki2B-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI3_A_PE2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		10 / 12 GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
MET A 128
TYR A 172
ARG A 176
ARG A 222
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.79A 1ki3A-1vtkA:
47.5		 1ki3A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI3_A_PE2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 HIS A  58
GLN A 125
TYR A 172
ARG A 176
ARG A 220
 TMP  A 500 (-3.8A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.4A)
 1.41A 1ki3A-1vtkA:
47.5		 1ki3A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI3_A_PE2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		10 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
MET A 128
TYR A 172
ARG A 176
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.5A)
 0.67A 1ki3A-1vtkA:
47.5		 1ki3A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI3_A_PE2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		10 / 12 HIS A  58
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
TYR A 172
ARG A 176
GLU A 225
 TMP  A 500 (-3.8A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.5A)
 0.73A 1ki3A-1vtkA:
47.5		 1ki3A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI3_A_PE2A1_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		10 / 12 TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
TYR A 172
ARG A 176
ARG A 222
GLU A 225
 None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.80A 1ki3A-1vtkA:
47.5		 1ki3A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI3_B_PE2B2_1
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		12 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
MET A 121
GLN A 125
MET A 128
TYR A 172
ARG A 176
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
None
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.5A)
 0.55A 1ki3B-1vtkA:
47.7		 1ki3B-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI7_A_ID2A1_0
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		11 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
ALA A 168
TYR A 172
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.5A)
TMP  A 500 (-3.7A)
TMP  A 500 (-3.5A)
 0.38A 1ki7A-1vtkA:
47.4		 1ki7A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI7_A_ID2A1_0
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		6 / 12 HIS A  58
ILE A  97
TYR A 101
ALA A 167
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 ( 4.5A)
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.2A)
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.94A 1ki7A-1vtkA:
47.4		 1ki7A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI7_A_ID2A1_0
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		11 / 12 HIS A  58
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
ALA A 168
TYR A 172
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.5A)
TMP  A 500 (-3.7A)
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.37A 1ki7A-1vtkA:
47.4		 1ki7A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1KI7_B_ID2B2_0
(THYMIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		12 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
GLN A 125
MET A 128
ARG A 163
ALA A 168
TYR A 172
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
TMP  A 500 (-3.7A)
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.56A 1ki7B-1vtkA:
48.6		 1ki7B-1vtkA:
100.00
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.
1MAA_A_DMEA998_1
(ACETYLCHOLINESTERASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 ASP A  55
GLY A  59
GLU A 225
TYR A 172
TYR A 239
 None
ADP  A 400 (-3.2A)
TMP  A 500 (-3.5A)
TMP  A 500 (-3.7A)
None
 1.24A 1maaA-1vtkA:
undetectable		 1maaA-1vtkA:
22.40
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.
1P5Z_B_AR3B304_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.5A)
 1.14A 1p5zB-1vtkA:
16.5		 1p5zB-1vtkA:
20.68
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.
1TUV_A_VK3A4558_1
(PROTEIN YGIN)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		4 / 7 TYR A 101
GLU A 225
LEU A 232
TYR A 172
 TMP  A 500 (-4.5A)
TMP  A 500 (-3.5A)
None
TMP  A 500 (-3.7A)
 1.10A 1tuvA-1vtkA:
undetectable		 1tuvA-1vtkA:
15.96
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.
1YA4_C_CTXC1383_1
(CES1 PROTEIN)		 4xr9 CALS8
(Micromonospora
echinospora) 		4 / 5 TRP A 282
PRO A 281
LEU A 277
GLY A 273
 None
None
TMP  A 503 (-4.6A)
TMP  A 503 (-3.7A)
 1.32A 1ya4C-4xr9A:
undetectable		 1ya4C-4xr9A:
22.45
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.
2A7Q_A_CFBA328_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.5A)
 1.13A 2a7qA-1vtkA:
16.6		 2a7qA-1vtkA:
20.68
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.
2A7Q_A_CFBA328_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TYR A 101
GLN A 125
ARG A 163
GLU A 225
 TMP  A 500 (-2.7A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.20A 2a7qA-1vtkA:
16.6		 2a7qA-1vtkA:
20.68
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.
2AVD_B_SAMB601_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 4xr9 CALS8
(Micromonospora
echinospora) 		5 / 12 MET A 431
GLY A 336
ALA A 372
ALA A 338
ARG A 430
 None
None
None
None
TMP  A 503 (-3.2A)
 1.37A 2avdB-4xr9A:
4.7		 2avdB-4xr9A:
21.35
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.
2JJ8_A_AZZA1211_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 10 GLU A  83
TRP A  88
GLN A 125
ARG A 163
ALA A 168
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.04A 2jj8A-1vtkA:
13.5		 2jj8A-1vtkA:
22.32
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.
2JJ8_B_AZZB1211_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		6 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
ARG A 163
ALA A 168
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.07A 2jj8B-1vtkA:
13.9		 2jj8B-1vtkA:
22.32
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.
2JJ8_C_AZZC1211_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
GLN A 125
ARG A 163
ALA A 168
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.03A 2jj8C-1vtkA:
13.3		 2jj8C-1vtkA:
22.32
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.
2JJ8_D_AZZD1211_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 10 GLU A  83
TRP A  88
GLN A 125
ARG A 163
ALA A 168
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.03A 2jj8D-1vtkA:
14.0		 2jj8D-1vtkA:
22.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2KI5_A_AC2A1_1
(PROTEIN (THYMIDINE
KINASE))		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 HIS A  58
GLN A 125
TYR A 172
ARG A 176
ARG A 220
 TMP  A 500 (-3.8A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.4A)
 1.44A 2ki5A-1vtkA:
47.2		 2ki5A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2KI5_A_AC2A1_1
(PROTEIN (THYMIDINE
KINASE))		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		11 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
MET A 128
TYR A 172
ARG A 176
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.78A 2ki5A-1vtkA:
47.2		 2ki5A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2KI5_A_AC2A1_1
(PROTEIN (THYMIDINE
KINASE))		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		11 / 12 HIS A  58
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
TYR A 172
ARG A 176
ARG A 222
GLU A 225
 TMP  A 500 (-3.8A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
TMP  A 500 (-3.5A)
 0.63A 2ki5A-1vtkA:
47.2		 2ki5A-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2KI5_B_AC2B2_1
(PROTEIN (THYMIDINE
KINASE))		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		11 / 12 HIS A  58
GLU A  83
TRP A  88
ILE A  97
ILE A 100
TYR A 101
MET A 128
ARG A 163
TYR A 172
ARG A 176
ARG A 222
 TMP  A 500 (-3.8A)
TMP  A 500 (-2.7A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
 0.73A 2ki5B-1vtkA:
48.2		 2ki5B-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2KI5_B_AC2B2_1
(PROTEIN (THYMIDINE
KINASE))		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 HIS A  58
ILE A  97
TYR A 101
MET A  85
ARG A 163
 TMP  A 500 (-3.8A)
TMP  A 500 ( 4.5A)
TMP  A 500 (-4.5A)
None
TMP  A 500 (-3.3A)
 1.43A 2ki5B-1vtkA:
48.2		 2ki5B-1vtkA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2KI5_B_AC2B2_1
(PROTEIN (THYMIDINE
KINASE))		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		11 / 12 HIS A  58
TRP A  88
ILE A  97
ILE A 100
TYR A 101
GLN A 125
MET A 128
ARG A 163
TYR A 172
ARG A 176
ARG A 222
 TMP  A 500 (-3.8A)
None
TMP  A 500 ( 4.5A)
TMP  A 500 ( 4.1A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.6A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.7A)
None
TMP  A 500 (-3.2A)
 0.54A 2ki5B-1vtkA:
48.2		 2ki5B-1vtkA:
100.00
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.
2UXO_B_TACB1211_1
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 3lv8 THYMIDYLATE KINASE
(Vibrio
cholerae) 		5 / 11 LEU A  70
LEU A  63
LEU A 121
ILE A 157
ILE A 113
 None
None
None
TMP  A 214 (-3.3A)
None
 1.21A 2uxoB-3lv8A:
undetectable		 2uxoB-3lv8A:
20.99
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.
2VPP_A_GEOA1210_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
ARG A 163
ALA A 168
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.09A 2vppA-1vtkA:
14.9		 2vppA-1vtkA:
22.32
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.
2VPP_A_GEOA1210_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 TRP A  88
TYR A 101
GLN A 125
ARG A 163
ALA A 168
 None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 0.98A 2vppA-1vtkA:
14.9		 2vppA-1vtkA:
22.32
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.
2VPP_B_GEOB1207_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
ARG A 163
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
 0.98A 2vppB-1vtkA:
14.3		 2vppB-1vtkA:
22.32
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.
2VPP_B_GEOB1207_1
(DEOXYNUCLEOSIDE
KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TYR A 101
GLN A 125
ARG A 163
ALA A 168
 TMP  A 500 (-2.7A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 0.95A 2vppB-1vtkA:
14.3		 2vppB-1vtkA:
22.32
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.
2ZI9_A_CL9A401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.5A)
 1.11A 2zi9A-1vtkA:
15.3		 2zi9A-1vtkA:
20.16
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.
2ZI9_A_CL9A401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TYR A 101
GLN A 125
ARG A 163
GLU A 225
 TMP  A 500 (-2.7A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.19A 2zi9A-1vtkA:
15.3		 2zi9A-1vtkA:
20.16
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.
2ZI9_B_CL9B401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
GLN A 125
ARG A 220
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-3.0A)
TMP  A 500 (-3.4A)
TMP  A 500 (-3.5A)
 1.27A 2zi9B-1vtkA:
16.5		 2zi9B-1vtkA:
20.16
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.
2ZI9_B_CL9B401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.5A)
 1.02A 2zi9B-1vtkA:
16.5		 2zi9B-1vtkA:
20.16
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.
2ZIA_A_CL9A401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.5A)
 0.95A 2ziaA-1vtkA:
17.2		 2ziaA-1vtkA:
20.16
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.
2ZIA_A_CL9A401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TYR A 101
GLN A 125
ARG A 163
GLU A 225
 TMP  A 500 (-2.7A)
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.3A)
TMP  A 500 (-3.5A)
 1.01A 2ziaA-1vtkA:
17.2		 2ziaA-1vtkA:
20.16
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.
2ZIA_B_CL9B401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
GLN A 125
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 (-3.5A)
 1.00A 2ziaB-1vtkA:
16.7		 2ziaB-1vtkA:
20.16
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.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)		 5uiv BIFUNCTIONAL
THYMIDYLATE/URIDYLAT
E KINASE
(Candida
albicans) 		5 / 12 LEU A  51
GLU A 159
ARG A  39
SER A  96
TYR A 100
 TMP  A 301 (-4.5A)
TMP  A 301 ( 4.5A)
TMP  A 301 (-3.9A)
TMP  A 301 ( 4.7A)
TMP  A 301 (-3.6A)
 1.42A 3apwB-5uivA:
undetectable		 3apwB-5uivA:
21.61
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.
3HP1_A_LLTA401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 GLU A  83
TRP A  88
TYR A 101
ALA A 167
GLU A 225
 TMP  A 500 (-2.7A)
None
TMP  A 500 (-4.5A)
TMP  A 500 ( 4.2A)
TMP  A 500 (-3.5A)
 1.05A 3hp1A-1vtkA:
16.7		 3hp1A-1vtkA:
19.57
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.
3HP1_A_LLTA401_1
(DEOXYCYTIDINE KINASE)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 TRP A  88
TYR A 101
GLN A 125
ALA A 167
GLU A 225
 None
TMP  A 500 (-4.5A)
TMP  A 500 (-3.0A)
TMP  A 500 ( 4.2A)
TMP  A 500 (-3.5A)
 1.22A 3hp1A-1vtkA:
16.7		 3hp1A-1vtkA:
19.57
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.
3KPD_B_SAMB1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 5uiv BIFUNCTIONAL
THYMIDYLATE/URIDYLAT
E KINASE
(Candida
albicans) 		3 / 3 ASN A  53
ASN A  48
GLU A 159
 None
None
TMP  A 301 ( 4.5A)
 0.69A 3kpdC-5uivA:
undetectable		 3kpdC-5uivA:
20.00
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.
3KPD_C_SAMC1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 5uiv BIFUNCTIONAL
THYMIDYLATE/URIDYLAT
E KINASE
(Candida
albicans) 		3 / 3 ASN A  53
ASN A  48
GLU A 159
 None
None
TMP  A 301 ( 4.5A)
 0.82A 3kpdB-5uivA:
undetectable		 3kpdB-5uivA:
20.00
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.
3QL6_A_NIMA614_1
(LACTOPEROXIDASE)		 5uiv BIFUNCTIONAL
THYMIDYLATE/URIDYLAT
E KINASE
(Candida
albicans) 		4 / 7 GLU A 159
ARG A 160
PHE A  67
PRO A  37
 TMP  A 301 ( 4.5A)
None
TMP  A 301 (-3.1A)
TMP  A 301 ( 4.4A)
 1.32A 3ql6A-5uivA:
undetectable		 3ql6A-5uivA:
20.91
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.
3TBG_C_RTZC1_1
(CYTOCHROME P450 2D6)		 3lv8 THYMIDYLATE KINASE
(Vibrio
cholerae) 		5 / 12 GLY A  10
LEU A  11
GLU A  12
SER A 102
PHE A 165
 None
None
TYD  A 215 (-2.8A)
TMP  A 214 ( 4.2A)
None
 1.29A 3tbgC-3lv8A:
undetectable		 3tbgC-3lv8A:
19.62
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.
4NKV_B_AERB601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2ido DNA POLYMERASE III
EPSILON SUBUNIT
(Escherichia
coli) 		4 / 5 ARG A 159
ASP A  12
GLU A 173
VAL A  38
 TMP  A2001 ( 4.6A)
MN  A1001 (-2.6A)
None
None
 1.39A 4nkvB-2idoA:
undetectable		 4nkvB-2idoA:
16.84
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.
5KMF_A_6U9A1301_1
(ION TRANSPORT
PROTEIN)		 2ido DNA POLYMERASE III
EPSILON SUBUNIT
(Escherichia
coli) 		4 / 6 GLY A  64
GLU A  61
PHE A  63
ILE A  31
 None
TMP  A2001 (-4.0A)
None
None
 0.96A 5kmfA-2idoA:
undetectable
5kmfC-2idoA:
undetectable		 5kmfA-2idoA:
19.59
5kmfC-2idoA:
19.59
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.
5VLM_F_CVIF301_1
(REGULATORY PROTEIN
TETR)		 3lv8 THYMIDYLATE KINASE
(Vibrio
cholerae) 		4 / 8 ILE A 157
ARG A 156
VAL A  72
ASP A  65
 TMP  A 214 (-3.3A)
None
TYD  A 215 (-4.1A)
CL  A 222 ( 4.7A)
 1.10A 5vlmF-3lv8A:
1.4		 5vlmF-3lv8A:
21.58
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.
5ZW4_A_SAMA302_0
(PUTATIVE
O-METHYLTRANSFERASE
YRRM)		 1vtk THYMIDINE KINASE
(Human
alphaherpesvirus
1) 		5 / 12 PRO A 195
GLY A 129
ALA A 133
ALA A 168
ALA A 167
 None
None
None
TMP  A 500 (-3.5A)
TMP  A 500 ( 4.2A)
 0.82A 5zw4A-1vtkA:
undetectable		 5zw4A-1vtkA:
22.09