SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2jaq'

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.
1KI2_A_GA2A1_1
(THYMIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 11 TYR A  43
GLN A  54
MET A  57
ARG A  78
GLU A 150
None
DCP  A1202 (-2.9A)
DCP  A1202 ( 4.2A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.5A)
1.01A 1ki2A-2jaqA:
15.7
1ki2A-2jaqA:
21.28
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.
1KI2_B_GA2B2_1
(THYMIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 12 TYR A  43
GLN A  54
MET A  57
ARG A  78
GLU A 150
None
DCP  A1202 (-2.9A)
DCP  A1202 ( 4.2A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.5A)
1.01A 1ki2B-2jaqA:
16.4
1ki2B-2jaqA:
21.28
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.
1KQW_A_RTLA135_0
(CELLULAR
RETINOL-BINDING
PROTEIN)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 12 PHE A 179
ILE A 201
LEU A 198
LEU A 131
ILE A 129
None
1.29A 1kqwA-2jaqA:
undetectable
1kqwA-2jaqA:
20.18
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.
1M8E_B_H4BB903_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
0.92A 1m8eB-2jaqA:
undetectable
1m8eB-2jaqA:
18.66
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.
1P5Z_B_AR3B304_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  78
ASP A  83
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.54A 1p5zB-2jaqA:
22.4
1p5zB-2jaqA:
27.04
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.
1P62_B_GEOB302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 11 VAL A  33
TYR A  43
GLN A  54
ARG A  78
ASP A  83
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.67A 1p62B-2jaqA:
22.0
1p62B-2jaqA:
27.04
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.
1QOM_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
1.02A 1qomA-2jaqA:
undetectable
1qomA-2jaqA:
18.76
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.
2A7Q_A_CFBA328_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
8 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  61
ARG A  78
PHE A  86
GLU A 150
TYR A 157
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
None
0.84A 2a7qA-2jaqA:
22.6
2a7qA-2jaqA:
27.04
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.
2BU8_A_TF4A1379_1
(PYRUVATE
DEHYDROGENASE KINASE
ISOENZYME 2)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
4 / 8 LEU A 131
ILE A 194
ILE A   5
ILE A  20
None
0.82A 2bu8A-2jaqA:
undetectable
2bu8A-2jaqA:
21.39
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.
2NO0_A_GEOA302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  78
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.57A 2no0A-2jaqA:
22.5
2no0A-2jaqA:
25.17
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.
2NO0_B_GEOB302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  78
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.63A 2no0B-2jaqA:
23.5
2no0B-2jaqA:
25.17
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.
2NO6_A_ETVA302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 12 GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
TYR A  43
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
None
1.50A 2no6A-2jaqA:
22.2
2no6A-2jaqA:
25.17
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.
2NO6_A_ETVA302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 12 TYR A  43
GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
TYR A 157
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
None
0.66A 2no6A-2jaqA:
22.2
2no6A-2jaqA:
25.17
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.
2NO6_B_ETVB302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 11 TYR A  43
GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
0.55A 2no6B-2jaqA:
23.2
2no6B-2jaqA:
25.17
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.
2NOA_A_3TCA302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 12 TYR A  43
GLN A  54
ARG A  61
ARG A  78
PHE A  86
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
0.51A 2noaA-2jaqA:
21.8
2noaA-2jaqA:
25.17
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.
2NOA_B_3TCB302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 11 TYR A  43
GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
0.54A 2noaB-2jaqA:
23.2
2noaB-2jaqA:
25.17
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.
2NOA_B_3TCB302_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 11 TYR A 157
GLN A  54
ARG A  61
ARG A  78
ASP A  83
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
1.50A 2noaB-2jaqA:
23.2
2noaB-2jaqA:
25.17
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.
2NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
1.00A 2nodB-2jaqA:
undetectable
2nodB-2jaqA:
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.
2VPP_A_GEOA1210_1
(DEOXYNUCLEOSIDE
KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  78
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.76A 2vppA-2jaqA:
20.9
2vppA-2jaqA:
27.69
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)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  78
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.75A 2vppB-2jaqA:
20.0
2vppB-2jaqA:
27.69
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)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 12 GLN A  54
ARG A  61
ARG A  78
ARG A 145
TYR A 157
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-2.8A)
None
1.33A 2zi9A-2jaqA:
21.9
2zi9A-2jaqA:
24.91
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.
2ZI9_A_CL9A401_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 12 TYR A  43
GLN A  54
ARG A  61
ARG A  78
ARG A 147
GLU A 150
TYR A 157
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.5A)
None
0.77A 2zi9A-2jaqA:
21.9
2zi9A-2jaqA:
24.91
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.
2ZI9_B_CL9B401_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 12 TYR A  43
GLN A  54
ARG A  61
PHE A  86
ARG A 145
GLU A 150
TYR A 157
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-3.6A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.5A)
None
0.64A 2zi9B-2jaqA:
22.7
2zi9B-2jaqA:
24.91
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.
2ZIA_A_CL9A401_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 12 TYR A  42
ARG A  61
ARG A  78
PHE A  86
TYR A 157
DCP  A1202 (-4.2A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
None
1.31A 2ziaA-2jaqA:
23.6
2ziaA-2jaqA:
25.26
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.
2ZIA_A_CL9A401_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 12 TYR A  43
GLN A  54
ARG A  61
ARG A  78
PHE A  86
GLU A 150
TYR A 157
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
None
0.67A 2ziaA-2jaqA:
23.6
2ziaA-2jaqA:
25.26
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.
2ZIA_B_CL9B401_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  61
PHE A  86
GLU A 150
TYR A 157
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
None
0.81A 2ziaB-2jaqA:
23.5
2ziaB-2jaqA:
25.26
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.
3E68_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
0.96A 3e68A-2jaqA:
undetectable
3e68A-2jaqA:
18.71
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.
3E6T_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
0.94A 3e6tB-2jaqA:
undetectable
3e6tB-2jaqA:
18.71
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.
3E7I_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
0.97A 3e7iB-2jaqA:
undetectable
3e7iB-2jaqA:
18.71
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)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 12 VAL A  33
TYR A  43
GLN A  54
ARG A  78
PHE A  86
GLU A 150
DCP  A1202 (-4.6A)
None
DCP  A1202 (-2.9A)
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.5A)
0.75A 3hp1A-2jaqA:
22.9
3hp1A-2jaqA:
24.83
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.
3MJR_A_AC2A301_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
7 / 9 GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
TYR A 157
LEU A 161
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
None
None
0.88A 3mjrA-2jaqA:
21.0
3mjrA-2jaqA:
25.26
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.
3MJR_B_AC2B401_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 9 GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
0.66A 3mjrB-2jaqA:
21.1
3mjrB-2jaqA:
25.26
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.
3MJR_D_AC2D601_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 8 GLN A  54
ARG A  61
ARG A  78
ASP A  83
PHE A  86
DCP  A1202 (-2.9A)
None
DCP  A1202 (-2.8A)
DCP  A1202 (-3.6A)
DCP  A1202 (-3.6A)
0.85A 3mjrD-2jaqA:
20.0
3mjrD-2jaqA:
25.26
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.
3MJR_D_AC2D601_1
(DEOXYCYTIDINE KINASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
4 / 8 TYR A  43
GLN A  54
ARG A  61
ASP A  83
None
DCP  A1202 (-2.9A)
None
DCP  A1202 (-3.6A)
0.86A 3mjrD-2jaqA:
20.0
3mjrD-2jaqA:
25.26
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.
3NW2_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
0.94A 3nw2A-2jaqA:
undetectable
3nw2A-2jaqA:
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.
3NW2_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 ARG A 145
ILE A 139
TRP A 158
DCP  A1202 (-2.8A)
None
None
1.02A 3nw2B-2jaqA:
undetectable
3nw2B-2jaqA:
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.
3OCT_A_1N1A663_2
(TYROSINE-PROTEIN
KINASE BTK)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
4 / 5 ILE A  74
MET A 195
ASN A 196
PHE A  76
None
1.36A 3octA-2jaqA:
undetectable
3octA-2jaqA:
20.45
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.
4R87_H_SPMH202_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
4 / 6 ASN A  36
MET A  57
GLU A  31
GLU A  34
None
DCP  A1202 ( 4.2A)
None
None
1.35A 4r87H-2jaqA:
undetectable
4r87H-2jaqA:
22.12
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.
4Y0Q_A_PX9A201_1
(BETA-LACTOGLOBULIN)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
3 / 3 LYS A  73
ILE A   3
ILE A 127
None
0.60A 4y0qA-2jaqA:
undetectable
4y0qA-2jaqA:
22.27
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.
4Y0R_A_PX9A201_0
(BETA-LACTOGLOBULIN)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 12 VAL A 181
ILE A   5
LEU A 131
ILE A  16
ILE A  20
None
0.93A 4y0rA-2jaqA:
undetectable
4y0rA-2jaqA:
22.27
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.
5NUM_A_Z80A201_1
(BETA-LACTOGLOBULIN)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
6 / 8 VAL A 181
ILE A   5
LEU A 131
ILE A  16
ILE A  20
SER A 200
None
1.39A 5numA-2jaqA:
undetectable
5numA-2jaqA:
17.82
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.
5NUN_A_Z80A201_1
(BETA-LACTOGLOBULIN)
2jaq DEOXYGUANOSINE
KINASE

(Mycoplasma
mycoides)
5 / 9 VAL A 181
ILE A   5
LEU A 131
ILE A  16
ILE A  20
None
0.98A 5nunA-2jaqA:
undetectable
5nunA-2jaqA:
17.82