SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3a5r'

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.
1A4L_B_DCFB853_2
(ADENOSINE DEAMINASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 HIS A 296
SER A 184
LEU A  98
GLY A 209
 None
 1.00A 1a4lB-3a5rA:
undetectable		 1a4lB-3a5rA:
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.
1AX9_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 GLY A 156
GLU A 185
SER A 331
PHE A 258
 HC4  A 400 (-3.6A)
None
HC4  A 400 ( 4.4A)
HC4  A 400 ( 3.9A)
 0.99A 1ax9A-3a5rA:
undetectable		 1ax9A-3a5rA:
21.88
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.
1DSS_G_CCSG149_0
(D-GLYCERALDEHYDE-3-P
HOSPHATE-DEHYDROGENA
SE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 7 ASN A  22
CYH A  23
TYR A  62
ASN A  19
 None
 0.80A 1dssG-3a5rA:
undetectable		 1dssG-3a5rA:
24.45
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.
1DSS_R_CCSR149_0
(D-GLYCERALDEHYDE-3-P
HOSPHATE-DEHYDROGENA
SE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 ASN A  22
CYH A  23
TYR A  62
ASN A  19
 None
 0.81A 1dssR-3a5rA:
undetectable		 1dssR-3a5rA:
24.45
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.
1E6W_C_ESTC302_1
(SHORT CHAIN
3-HYDROXYACYL-COA
DEHYDROGENASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 4 ALA A 159
GLN A 237
TYR A 158
LEU A 166
 None
 1.43A 1e6wC-3a5rA:
0.6		 1e6wC-3a5rA:
20.97
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.
1JIN_A_KTNA801_1
(CYTOCHROME P450
107A1)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 11 VAL A 163
LEU A 166
ALA A 167
ALA A 171
THR A 138
 None
 0.91A 1jinA-3a5rA:
undetectable		 1jinA-3a5rA:
23.49
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.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 7 GLY A 156
GLU A 185
SER A 331
PHE A 258
 HC4  A 400 (-3.6A)
None
HC4  A 400 ( 4.4A)
HC4  A 400 ( 3.9A)
 0.98A 2ackA-3a5rA:
undetectable		 2ackA-3a5rA:
21.88
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.
2E1Q_A_SALA2006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 6 ARG A 178
VAL A  12
LEU A 232
ALA A 171
 None
 1.02A 2e1qA-3a5rA:
undetectable		 2e1qA-3a5rA:
15.30
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.
2E1Q_C_SALC4006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 6 ARG A 178
VAL A  12
LEU A 232
ALA A 171
 None
 1.01A 2e1qC-3a5rA:
undetectable		 2e1qC-3a5rA:
15.30
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.
2JKJ_D_CLMD1142_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 PRO A 265
PRO A 300
ILE A 207
GLY A 298
 None
None
HC4  A 400 ( 4.5A)
None
 1.13A 2jkjD-3a5rA:
undetectable		 2jkjD-3a5rA:
16.07
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.
2JKJ_F_CLMF1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 PRO A 265
PRO A 300
ILE A 207
GLY A 298
 None
None
HC4  A 400 ( 4.5A)
None
 1.14A 2jkjF-3a5rA:
undetectable		 2jkjF-3a5rA:
16.07
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.
2VH3_B_DAHB2_1
(RANASMURFIN)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 ALA A 333
SER A 184
GLY A  99
ALA A 214
 None
 0.91A 2vh3B-3a5rA:
undetectable		 2vh3B-3a5rA:
14.52
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.
2ZIF_B_SAMB298_1
(PUTATIVE
MODIFICATION
METHYLASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		3 / 3 ASP A 220
THR A 353
GLU A 231
 None
 0.74A 2zifB-3a5rA:
undetectable		 2zifB-3a5rA:
19.70
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.
3AG1_W_CHDW1059_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 6 ILE A 121
ARG A 178
THR A  11
LEU A 232
 None
 0.98A 3ag1N-3a5rA:
undetectable
3ag1W-3a5rA:
undetectable		 3ag1N-3a5rA:
21.33
3ag1W-3a5rA:
11.46
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.
3AX7_A_SALA1336_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 ARG A 178
VAL A  12
LEU A 232
ALA A 171
 None
 1.02A 3ax7A-3a5rA:
undetectable		 3ax7A-3a5rA:
15.82
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.
3AX9_A_SALA1341_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 LEU A 377
PHE A 292
THR A 353
VAL A 380
 None
 1.00A 3ax9A-3a5rA:
undetectable		 3ax9A-3a5rA:
15.82
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.
3B6R_B_CRNB603_1
(CREATINE KINASE
B-TYPE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 6 THR A 162
VAL A 163
GLU A 185
CYH A 183
 None
 1.15A 3b6rB-3a5rA:
undetectable		 3b6rB-3a5rA:
22.07
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.
3DMT_C_CCSC166_0
(GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 ASN A  22
CYH A  23
TYR A  62
ASN A  19
 None
 0.86A 3dmtC-3a5rA:
undetectable		 3dmtC-3a5rA:
23.06
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.
3EKP_C_478C200_2
(PROTEASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		6 / 10 GLY A 365
VAL A 264
ILE A 247
GLY A 369
ILE A 239
ILE A 268
 None
 1.42A 3ekpD-3a5rA:
undetectable		 3ekpD-3a5rA:
16.22
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.
3FHX_B_PXLB313_1
(PYRIDOXAL KINASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 VAL A 335
VAL A 362
PHE A 364
HIS A 296
 None
 1.02A 3fhxB-3a5rA:
undetectable		 3fhxB-3a5rA:
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.
3FPJ_B_SAMB301_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 ILE A 272
VAL A 306
ILE A 302
LEU A 267
VAL A 372
 None
 1.10A 3fpjB-3a5rA:
undetectable		 3fpjB-3a5rA:
23.35
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.
3N58_C_ADNC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 LEU A 208
GLN A  91
THR A 187
HIS A 296
 HC4  A 400 ( 4.7A)
None
None
None
 1.18A 3n58C-3a5rA:
undetectable		 3n58C-3a5rA:
23.19
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.
3S3V_A_TOPA193_1
(DIHYDROFOLATE
REDUCTASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 ASP A 304
LEU A 303
ILE A 268
PRO A 265
 None
 1.10A 3s3vA-3a5rA:
undetectable		 3s3vA-3a5rA:
18.35
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.
3TKW_B_017B401_2
(PROTEASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		6 / 12 GLY A 365
VAL A 264
ILE A 247
GLY A 369
ILE A 239
ILE A 268
 None
 1.41A 3tkwB-3a5rA:
undetectable		 3tkwB-3a5rA:
16.47
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.
3TL9_A_ROCA401_3
(PROTEASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		6 / 12 GLY A 365
VAL A 264
ILE A 247
GLY A 369
ILE A 239
ILE A 268
 None
 1.35A 3tl9B-3a5rA:
undetectable		 3tl9B-3a5rA:
16.47
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.
3TM4_A_SAMA401_1
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 SER A 379
THR A 353
GLU A 231
ASP A 220
 None
 0.84A 3tm4A-3a5rA:
undetectable		 3tm4A-3a5rA:
25.24
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.
3TM4_B_SAMB401_1
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 5 SER A 379
THR A 353
GLU A 231
ASP A 220
 None
 0.81A 3tm4B-3a5rA:
2.7		 3tm4B-3a5rA:
25.24
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.
4A6D_A_SAMA1350_0
(HYDROXYINDOLE
O-METHYLTRANSFERASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 GLY A 365
ILE A 294
VAL A 335
ALA A 236
ARG A 165
 None
 1.16A 4a6dA-3a5rA:
undetectable		 4a6dA-3a5rA:
21.50
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.
4A6E_A_SAMA1349_0
(HYDROXYINDOLE
O-METHYLTRANSFERASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 GLY A 365
ILE A 294
VAL A 335
ALA A 236
ARG A 165
 None
 1.15A 4a6eA-3a5rA:
undetectable		 4a6eA-3a5rA:
21.50
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.
4EIL_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 11 VAL A 215
ASP A 340
LEU A 377
VAL A  12
THR A  17
 None
 1.45A 4eilA-3a5rA:
undetectable		 4eilA-3a5rA:
21.84
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.
4EIL_C_FOLC703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 11 VAL A 215
ASP A 340
LEU A 377
VAL A  12
THR A  17
 None
 1.45A 4eilC-3a5rA:
undetectable		 4eilC-3a5rA:
21.84
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.
4KKY_X_CAMX503_0
(CAMPHOR
5-MONOOXYGENASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 6 PHE A 366
LEU A 303
VAL A 306
VAL A 362
 None
 1.17A 4kkyX-3a5rA:
undetectable		 4kkyX-3a5rA:
22.08
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.
5HFJ_H_SAMH301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 ALA A 213
GLY A 161
THR A 235
SER A 332
TYR A 158
 None
 1.26A 5hfjH-3a5rA:
undetectable		 5hfjH-3a5rA:
20.53
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.
5NJV_D_SAMD301_0
(NS5)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 GLY A 156
GLY A 365
GLU A 373
VAL A 306
ILE A 268
 HC4  A 400 (-3.6A)
None
None
None
None
 1.02A 5njvD-3a5rA:
undetectable		 5njvD-3a5rA:
21.99
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.
5VOP_B_C2FB3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 GLY A 365
LEU A 260
GLY A 299
ASN A 329
ILE A 302
 None
HC4  A 400 ( 4.4A)
None
HC4  A 400 (-4.0A)
None
 1.13A 5vopB-3a5rA:
undetectable		 5vopB-3a5rA:
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.
5W8A_A_SAMA300_0
(AUTOINDUCER SYNTHASE)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 TRP A 293
THR A 320
LEU A 317
PHE A 366
THR A 374
 None
 1.29A 5w8aA-3a5rA:
undetectable		 5w8aA-3a5rA:
20.88
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.
6BZO_C_FI8C1201_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		5 / 12 ILE A 239
THR A 238
GLN A 237
THR A 162
VAL A 163
 None
 0.96A 6bzoC-3a5rA:
undetectable		 6bzoC-3a5rA:
16.95
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.
6C06_D_FI8D1404_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 ILE A 239
THR A 238
THR A 162
ARG A 165
 None
 0.85A 6c06C-3a5rA:
0.0		 6c06C-3a5rA:
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.
6CP4_A_CAMA422_0
(CYTOCHROME P450CAM)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 TYR A 153
VAL A  95
ASP A 134
VAL A 182
 None
 1.07A 6cp4A-3a5rA:
undetectable		 6cp4A-3a5rA:
21.44
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.
6FBV_D_FI8D1904_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 8 ILE A 239
GLN A 237
THR A 162
VAL A 163
 None
 0.89A 6fbvC-3a5rA:
0.2		 6fbvC-3a5rA:
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.
6GNE_A_ACRA602_2
(-)		 3a5r BENZALACETONE
SYNTHASE
(Rheum
palmatum) 		4 / 6 TYR A  24
ASN A  19
TYR A  62
GLU A 101
 None
 1.43A 6gneA-3a5rA:
undetectable		 6gneA-3a5rA:
22.20