SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wjs'

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.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 12 GLY A 267
ASN A 266
SER A 278
GLY A 264
GLN A 293
 None
 1.24A 1ffyA-3wjsA:
undetectable		 1ffyA-3wjsA:
18.55
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.
1H4O_A_BEZA1162_0
(PEROXIREDOXIN 5)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 10 PRO A 288
GLY A  11
LEU A 258
PHE A 285
GLY A 222
 None
 1.29A 1h4oA-3wjsA:
undetectable
1h4oB-3wjsA:
undetectable		 1h4oA-3wjsA:
22.22
1h4oB-3wjsA:
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.
1RK3_A_VDXA500_2
(VITAMIN D3 RECEPTOR)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 4 LEU A 205
ILE A 216
ARG A 220
TYR A 154
 None
None
PGE  A 401 (-3.7A)
None
 1.48A 1rk3A-3wjsA:
undetectable		 1rk3A-3wjsA:
19.89
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.
1RTS_B_D16B409_1
(THYMIDYLATE SYNTHASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 7 ARG A 224
ASP A 219
GLY A  11
PHE A  10
 None
 0.89A 1rtsB-3wjsA:
undetectable		 1rtsB-3wjsA:
22.42
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.
2D55_C_DVAC8_0
(ACTINOMYCIN D)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		3 / 3 PRO A 245
THR A 241
PRO A 239
 None
 0.83A 2d55C-3wjsA:
undetectable		 2d55C-3wjsA:
6.72
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.
2O4N_A_TPVA300_1
(PROTEASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 12 ALA A 218
ASP A 219
GLY A 222
ILE A 171
LEU A 249
 None
 0.89A 2o4nA-3wjsA:
undetectable		 2o4nA-3wjsA:
14.37
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.
2XFH_A_CL6A1413_1
(ERYTHROMYCIN B/D
C-12 HYDROXYLASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 6 HIS A 189
ALA A 120
ALA A 141
PHE A 182
 None
 1.08A 2xfhA-3wjsA:
undetectable		 2xfhA-3wjsA:
23.54
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.
2YGN_A_PCFA1179_1
(WNT INHIBITORY
FACTOR 1)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 5 ILE A 312
PHE A  10
VAL A 212
PHE A 285
 None
 1.19A 2ygnA-3wjsA:
undetectable		 2ygnA-3wjsA:
18.51
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.
3K13_C_THHC643_1
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		3 / 3 ASN A 292
ASP A 230
ARG A  28
 None
HG  A 403 ( 4.8A)
None
 0.81A 3k13C-3wjsA:
9.7		 3k13C-3wjsA:
22.14
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.
3MG0_Y_BO2Y1403_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		6 / 12 THR A 221
ALA A 158
ALA A 157
ALA A 218
GLY A 217
ALA A 215
 None
 1.43A 3mg0Y-3wjsA:
undetectable
3mg0Z-3wjsA:
undetectable		 3mg0Y-3wjsA:
21.49
3mg0Z-3wjsA:
21.13
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.
3MG0_Y_BO2Y1403_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		6 / 12 THR A 221
ALA A 158
ALA A 161
ALA A 218
GLY A 217
ALA A 215
 None
 1.44A 3mg0Y-3wjsA:
undetectable
3mg0Z-3wjsA:
undetectable		 3mg0Y-3wjsA:
21.49
3mg0Z-3wjsA:
21.13
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.
3TTP_A_017A201_1
(HIV-1 PROTEASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 10 ALA A 218
ASP A 219
GLY A 222
ILE A 171
LEU A 249
 None
 0.92A 3ttpA-3wjsA:
undetectable		 3ttpA-3wjsA:
13.60
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.
3TTP_A_017A201_2
(HIV-1 PROTEASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 10 ALA A 218
ASP A 219
GLY A 222
ILE A 171
LEU A 249
 None
 0.90A 3ttpB-3wjsA:
undetectable		 3ttpB-3wjsA:
13.60
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.
3U7S_A_017A202_2
(POL POLYPROTEIN)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 9 ALA A 218
ASP A 219
GLY A 222
ILE A 171
LEU A 249
 None
 0.90A 3u7sB-3wjsA:
undetectable		 3u7sB-3wjsA:
13.80
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.
3WEM_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 12 ASP A 294
ALA A 313
ASP A 230
ARG A 261
HIS A 172
 None
None
HG  A 403 ( 4.8A)
None
None
 1.22A 3wemA-3wjsA:
8.9		 3wemA-3wjsA:
16.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_A_ACTA1358_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 9 ILE A  53
GLN A 170
ARG A 224
VAL A 290
ASN A 292
 None
 0.60A 4a3uA-3wjsA:
44.8		 4a3uA-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_A_NCAA1359_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 7 THR A  25
TRP A  66
TRP A 100
HIS A 172
ASN A 175
 None
None
None
None
HG  A 403 (-4.7A)
 0.94A 4a3uA-3wjsA:
44.8		 4a3uA-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_A_NCAA1359_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 7 THR A  25
TRP A  66
TRP A 100
HIS A 172
TYR A 177
 None
 0.58A 4a3uA-3wjsA:
44.8		 4a3uA-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_B_ACTB1358_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 7 ILE A  53
GLN A 170
ARG A 224
VAL A 290
 None
 0.54A 4a3uB-3wjsA:
44.9		 4a3uB-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_B_ACTB1358_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 7 PRO A  12
ARG A 220
GLY A 168
VAL A  96
 None
PGE  A 401 (-3.7A)
None
None
 0.83A 4a3uB-3wjsA:
44.9		 4a3uB-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_B_NCAB1359_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 7 THR A  25
TRP A  66
TRP A 100
HIS A 172
ASN A 175
 None
None
None
None
HG  A 403 (-4.7A)
 0.94A 4a3uB-3wjsA:
44.9		 4a3uB-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A3U_B_NCAB1359_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 7 THR A  25
TRP A  66
TRP A 100
HIS A 172
TYR A 177
 None
 0.57A 4a3uB-3wjsA:
44.9		 4a3uB-3wjsA:
69.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4AWU_A_4CHA502_0
(OXIDOREDUCTASE,
FMN-BINDING)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 7 THR A  25
TRP A 100
HIS A 172
ASN A 175
TYR A 177
 None
None
None
HG  A 403 (-4.7A)
None
 0.82A 4awuA-3wjsA:
43.6		 4awuA-3wjsA:
43.85
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.
4CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 11 GLN A  77
ALA A  33
LEU A  64
PHE A 166
VAL A 169
 None
 1.34A 4claA-3wjsA:
undetectable		 4claA-3wjsA:
19.67
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.
4X1Y_B_LOCB502_1
(TUBULIN BETA CHAIN)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 12 LEU A 249
LEU A 258
ALA A 247
ALA A 173
ILE A 179
 None
 1.16A 4x1yB-3wjsA:
undetectable		 4x1yB-3wjsA:
22.83
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.
5UUN_A_ACTA303_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		3 / 3 GLU A  41
TYR A  42
ARG A  46
 None
 0.83A 5uunA-3wjsA:
undetectable		 5uunA-3wjsA:
22.58
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.
5UUN_B_ACTB306_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 4 LEU A 178
GLY A 103
SER A 117
SER A 118
 None
 1.24A 5uunB-3wjsA:
undetectable		 5uunB-3wjsA:
22.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V4V_A_NCAA402_0
(NADPH DEHYDROGENASE
3)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 8 THR A  25
TRP A 100
HIS A 172
ASN A 175
 None
None
None
HG  A 403 (-4.7A)
 0.97A 5v4vA-3wjsA:
38.3		 5v4vA-3wjsA:
37.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V4V_A_NCAA402_0
(NADPH DEHYDROGENASE
3)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 8 THR A  25
TRP A 100
HIS A 172
TYR A 177
 None
 0.37A 5v4vA-3wjsA:
38.3		 5v4vA-3wjsA:
37.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V4V_B_NCAB402_0
(NADPH DEHYDROGENASE
3)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 8 THR A  25
TRP A 100
HIS A 172
ASN A 175
 None
None
None
HG  A 403 (-4.7A)
 0.97A 5v4vB-3wjsA:
38.4		 5v4vB-3wjsA:
37.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5V4V_B_NCAB402_0
(NADPH DEHYDROGENASE
3)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 8 THR A  25
TRP A 100
HIS A 172
TYR A 177
 None
 0.36A 5v4vB-3wjsA:
38.4		 5v4vB-3wjsA:
37.14
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.
5YCN_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		5 / 12 LEU A 205
ILE A 171
GLY A 222
ILE A 213
LEU A  51
 None
 1.04A 5ycnA-3wjsA:
undetectable		 5ycnA-3wjsA:
21.73
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.
6A4I_A_TRPA403_0
(TRYPTOPHAN
2,3-DIOXYGENASE)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		4 / 8 ARG A 261
PRO A 227
ILE A 235
PRO A 275
 None
 1.12A 6a4iA-3wjsA:
undetectable		 6a4iA-3wjsA:
21.25
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.
6AUU_A_ACTA804_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3wjs NADH OXIDASE
(Gluconobacter
oxydans) 		3 / 3 GLN A 170
TRP A 257
VAL A 255
 None
 0.87A 6auuA-3wjsA:
0.6		 6auuA-3wjsA:
22.56