SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2XS'


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.
1DMA_A_NCAA700_0
(EXOTOXIN A)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 7 HIS A1184
GLY A1185
TYR A1213
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
2XS  A1402 ( 3.9A)
None
 0.61A 1dmaA-4oa7A:
6.0		 1dmaA-4oa7A:
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.
1DMA_B_NCAB700_0
(EXOTOXIN A)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		6 / 6 HIS A1184
GLY A1185
TYR A1213
ALA A1215
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
2XS  A1402 ( 3.9A)
None
 0.67A 1dmaB-4oa7A:
5.3		 1dmaB-4oa7A:
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.
1FAP_A_RAPA108_1
(FK506-BINDING
PROTEIN)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 12 TYR A1203
GLU A1291
ILE A1212
ILE A1189
ILE A1192
 2XS  A1402 (-3.1A)
None
2XS  A1402 ( 4.3A)
None
2XS  A1402 ( 4.7A)
 1.02A 1fapA-4oa7A:
undetectable		 1fapA-4oa7A:
19.81
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.
1FKL_A_RAPA108_1
(FK506 BINDING
PROTEIN)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 12 TYR A1203
GLU A1291
ILE A1212
ILE A1189
ILE A1192
 2XS  A1402 (-3.1A)
None
2XS  A1402 ( 4.3A)
None
2XS  A1402 ( 4.7A)
 0.94A 1fklA-4oa7A:
undetectable		 1fklA-4oa7A:
20.29
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.
2XAT_A_CLMA301_0
(XENOBIOTIC
ACETYLTRANSFERASE)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		3 / 3 GLY A1185
TYR A1224
SER A1221
 None
2XS  A1402 ( 3.9A)
None
 0.65A 2xatA-4oa7A:
undetectable		 2xatA-4oa7A:
20.66
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.
2ZM9_A_ACAA502_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 8 ALA A1138
TYR A1224
HIS A1132
GLY A1230
 None
2XS  A1402 ( 3.9A)
None
None
 0.85A 2zm9A-4oa7A:
undetectable		 2zm9A-4oa7A:
18.42
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.
3KO0_B_TFPB201_1
(PROTEIN S100-A4)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 8 GLY A1211
ILE A1192
PHE A1251
PHE A1214
 None
2XS  A1402 ( 4.7A)
None
None
 1.03A 3ko0B-4oa7A:
undetectable
3ko0J-4oa7A:
undetectable		 3ko0B-4oa7A:
19.81
3ko0J-4oa7A:
19.81
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.
3KO0_K_TFPK201_1
(PROTEIN S100-A4)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 8 GLY A1211
ILE A1192
PHE A1251
PHE A1214
 None
2XS  A1402 ( 4.7A)
None
None
 0.97A 3ko0K-4oa7A:
undetectable
3ko0S-4oa7A:
undetectable		 3ko0K-4oa7A:
19.81
3ko0S-4oa7A:
19.81
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.
3U9F_A_CLMA221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 4 PHE A1197
ALA A1300
CYH A1252
HIS A1184
 None
None
None
2XS  A1402 (-4.2A)
 1.46A 3u9fB-4oa7A:
0.0		 3u9fB-4oa7A:
21.07
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.
3U9F_P_CLMP221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 4 PHE A1197
ALA A1300
CYH A1252
HIS A1184
 None
None
None
2XS  A1402 (-4.2A)
 1.46A 3u9fR-4oa7A:
0.0		 3u9fR-4oa7A:
21.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3U9H_A_NCAA1163_0
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 8 HIS A1184
GLY A1185
TYR A1213
ALA A1215
LYS A1220
SER A1221
TYR A1224
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
None
2XS  A1402 ( 3.9A)
 0.95A 3u9hA-4oa7A:
33.1		 3u9hA-4oa7A:
79.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3U9H_B_NCAB1164_0
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 8 HIS A1184
GLY A1185
TYR A1213
ALA A1215
LYS A1220
SER A1221
TYR A1224
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
None
2XS  A1402 ( 3.9A)
 0.96A 3u9hB-4oa7A:
33.0		 3u9hB-4oa7A:
79.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3U9H_B_NCAB1164_0
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 8 HIS A1184
GLY A1185
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 ( 3.9A)
None
 0.88A 3u9hB-4oa7A:
33.0		 3u9hB-4oa7A:
79.41
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.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 6 HIS A1184
GLY A1185
TYR A1213
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
2XS  A1402 ( 3.9A)
None
 0.83A 4ae1A-4oa7A:
6.3		 4ae1A-4oa7A:
undetectable
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.
4AE1_B_NCAB1536_0
(DIPHTHERIA TOXIN)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 5 HIS A1184
GLY A1185
TYR A1213
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
 0.81A 4ae1B-4oa7A:
4.8		 4ae1B-4oa7A:
15.81
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.
4AE1_B_NCAB1536_0
(DIPHTHERIA TOXIN)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		4 / 5 HIS A1184
GLY A1185
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 ( 3.9A)
None
 0.80A 4ae1B-4oa7A:
4.8		 4ae1B-4oa7A:
15.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BJC_A_RPBA2162_1
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		6 / 8 HIS A1184
GLY A1185
ALA A1215
LYS A1220
SER A1221
TYR A1224
 2XS  A1402 (-4.2A)
None
None
None
None
2XS  A1402 ( 3.9A)
 0.88A 4bjcA-4oa7A:
32.4		 4bjcA-4oa7A:
79.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BJC_A_RPBA2162_1
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		6 / 8 HIS A1184
GLY A1185
TYR A1213
ALA A1215
SER A1221
TYR A1224
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
2XS  A1402 ( 3.9A)
 0.60A 4bjcA-4oa7A:
32.4		 4bjcA-4oa7A:
79.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HYF_A_NCAA1201_0
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 7 HIS A1184
GLY A1185
TYR A1213
ALA A1215
SER A1221
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
2XS  A1402 ( 3.9A)
None
 0.50A 4hyfA-4oa7A:
34.0		 4hyfA-4oa7A:
79.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HYF_B_NCAB1201_0
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		8 / 8 HIS A1184
GLY A1185
TYR A1213
ALA A1215
LYS A1220
SER A1221
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
None
2XS  A1402 ( 3.9A)
None
 0.77A 4hyfB-4oa7A:
33.9		 4hyfB-4oa7A:
79.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HYF_C_NCAC1201_0
(TANKYRASE-2)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		8 / 8 HIS A1184
GLY A1185
TYR A1213
ALA A1215
LYS A1220
SER A1221
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
None
2XS  A1402 ( 3.9A)
None
 0.52A 4hyfC-4oa7A:
33.7		 4hyfC-4oa7A:
79.41
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.
4RV6_A_RPBA1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 11 HIS A1184
GLY A1185
TYR A1213
ALA A1215
LYS A1220
SER A1221
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
None
None
 0.65A 4rv6A-4oa7A:
19.7		 4rv6A-4oa7A:
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.
4RV6_A_RPBA1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 11 HIS A1184
GLY A1185
TYR A1213
ALA A1215
SER A1221
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
2XS  A1402 ( 3.9A)
None
 0.78A 4rv6A-4oa7A:
19.7		 4rv6A-4oa7A:
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.
4RV6_B_RPBB1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 11 HIS A1184
GLY A1185
TYR A1213
ALA A1215
LYS A1220
SER A1221
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
None
None
 0.65A 4rv6B-4oa7A:
19.6		 4rv6B-4oa7A:
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.
4RV6_B_RPBB1103_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		7 / 11 HIS A1184
GLY A1185
TYR A1213
ALA A1215
SER A1221
TYR A1224
GLU A1291
 2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
None
None
2XS  A1402 ( 3.9A)
None
 0.77A 4rv6B-4oa7A:
19.6		 4rv6B-4oa7A:
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.
4WCX_C_SAMC503_0
(BIOTIN AND THIAMIN
SYNTHESIS ASSOCIATED)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 12 TYR A1213
GLY A1211
GLU A1199
LEU A1256
ALA A1215
 2XS  A1402 (-4.2A)
None
None
None
None
 1.09A 4wcxC-4oa7A:
undetectable		 4wcxC-4oa7A:
16.19
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.
5HA9_B_TP0B406_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 9 HIS A1184
ILE A1192
TYR A1213
SER A1221
TYR A1224
 2XS  A1402 (-4.2A)
2XS  A1402 ( 4.7A)
2XS  A1402 (-4.2A)
None
2XS  A1402 ( 3.9A)
 0.96A 5ha9B-4oa7A:
17.8		 5ha9B-4oa7A:
22.28
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.
5HA9_B_TP0B406_1
(POLY [ADP-RIBOSE]
POLYMERASE 1)		 4oa7 TANKYRASE-1
(Homo
sapiens) 		5 / 9 SER A1186
ILE A1192
TYR A1213
SER A1221
TYR A1224
 2XS  A1402 (-3.6A)
2XS  A1402 ( 4.7A)
2XS  A1402 (-4.2A)
None
2XS  A1402 ( 3.9A)
 0.92A 5ha9B-4oa7A:
17.8		 5ha9B-4oa7A:
22.28