SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4qr8'

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.
1DHI_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.92A 1dhiA-4qr8A:
undetectable		 1dhiA-4qr8A:
18.00
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.
1DHJ_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.91A 1dhjA-4qr8A:
undetectable		 1dhjA-4qr8A:
17.77
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.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.95A 1draA-4qr8A:
undetectable		 1draA-4qr8A:
18.00
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.
1DRB_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.92A 1drbA-4qr8A:
undetectable		 1drbA-4qr8A:
18.00
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.
1FML_A_RTLA401_0
(RETINOL DEHYDRATASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 TYR A 214
TYR A 229
HIS A 181
LEU A 245
ILE A 197
 None
 1.26A 1fmlA-4qr8A:
undetectable		 1fmlA-4qr8A:
21.49
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.
1UW6_P_NCTP1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 8 TYR A 157
CYH A 371
LEU A 381
MET A 379
 None
 1.47A 1uw6P-4qr8A:
undetectable
1uw6Q-4qr8A:
undetectable		 1uw6P-4qr8A:
16.52
1uw6Q-4qr8A:
16.52
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.
2DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.93A 2drcA-4qr8A:
undetectable		 2drcA-4qr8A:
17.42
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.
2DRC_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.92A 2drcB-4qr8A:
undetectable		 2drcB-4qr8A:
17.42
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.
2JFA_A_RALA600_2
(ESTROGEN RECEPTOR)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 5 LEU A 155
ASP A  21
LEU A  70
HIS A  11
 None
 1.21A 2jfaA-4qr8A:
undetectable		 2jfaA-4qr8A:
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.
2QXS_A_RALA600_2
(ESTROGEN RECEPTOR)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 5 LEU A 155
ASP A  21
LEU A  70
HIS A  11
 None
 1.28A 2qxsA-4qr8A:
undetectable		 2qxsA-4qr8A:
20.85
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.
3BRF_A_SORA2_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		3 / 3 LYS A  57
LYS A  51
VAL A  52
 None
 1.03A 3brfA-4qr8A:
undetectable		 3brfA-4qr8A:
22.97
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.
3CR5_X_PNTX94_0
(PROTEIN S100-B)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		3 / 3 PHE A  82
CYH A  68
PHE A  56
 None
 1.01A 3cr5X-4qr8A:
undetectable		 3cr5X-4qr8A:
12.09
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.
3DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.92A 3drcA-4qr8A:
undetectable		 3drcA-4qr8A:
18.00
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.
3E22_B_LOCB700_2
(TUBULIN BETA-2B
CHAIN)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 11 LEU A 244
LEU A 220
ALA A 219
ASN A 198
ALA A 184
 None
 1.27A 3e22B-4qr8A:
undetectable		 3e22B-4qr8A:
21.56
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.
3E22_D_LOCD700_2
(TUBULIN BETA-2B
CHAIN)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 11 LEU A 244
LEU A 220
ALA A 219
ASN A 198
ALA A 184
 None
 1.28A 3e22D-4qr8A:
undetectable		 3e22D-4qr8A:
21.56
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.
3R55_A_PZAA598_0
(LACTOPEROXIDASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		3 / 3 GLU A 280
PHE A 301
GLN A 281
 None
 1.00A 3r55A-4qr8A:
0.0		 3r55A-4qr8A:
23.00
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.
3RLB_A_VIBA191_1
(THIT)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 10 GLU A 384
TYR A 214
HIS A 339
GLY A 342
VAL A 380
 MG  A 501 (-2.5A)
None
MG  A 501 (-3.5A)
None
None
 1.33A 3rlbA-4qr8A:
0.1		 3rlbA-4qr8A:
20.28
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.
3RLB_B_VIBB187_1
(THIT)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 GLU A 384
TYR A 214
HIS A 339
GLY A 342
VAL A 380
 MG  A 501 (-2.5A)
None
MG  A 501 (-3.5A)
None
None
 1.32A 3rlbB-4qr8A:
undetectable		 3rlbB-4qr8A:
20.28
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.
3VYW_D_SAMD401_1
(MNMC2)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 5 ASP A 246
ASP A 347
ASN A 425
GLU A 423
 MG  A 502 (-2.1A)
None
None
MG  A 502 ( 2.6A)
 1.37A 3vywD-4qr8A:
undetectable		 3vywD-4qr8A:
22.30
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.
4DFR_B_MTXB162_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.96A 4dfrB-4qr8A:
undetectable		 4dfrB-4qr8A:
17.38
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.
4DTZ_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 6 ALA A 322
ALA A 306
LEU A 328
THR A 329
 None
 1.00A 4dtzA-4qr8A:
undetectable		 4dtzA-4qr8A:
22.75
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.
4K0B_B_SAMB504_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 8 ASN A 435
ASP A 279
LEU A 282
ILE A 422
 None
 1.07A 4k0bA-4qr8A:
undetectable		 4k0bA-4qr8A:
22.15
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.
4KM2_A_TOPA202_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ILE A 411
PHE A 389
VAL A 277
LEU A 273
ILE A 314
 None
 0.96A 4km2A-4qr8A:
undetectable		 4km2A-4qr8A:
17.87
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.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ILE A 411
PHE A 389
VAL A 277
LEU A 273
ILE A 314
 None
 0.83A 4km2B-4qr8A:
undetectable		 4km2B-4qr8A:
17.87
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.
4L7I_B_SAMB501_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 8 ASN A 435
ASP A 279
LEU A 282
ILE A 422
 None
 1.08A 4l7iA-4qr8A:
undetectable		 4l7iA-4qr8A:
22.15
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.
4LBG_A_ADNA402_1
(PROBABLE SUGAR
KINASE PROTEIN)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 10 THR A 205
GLU A 250
ALA A 173
VAL A 345
ALA A 247
 None
 1.07A 4lbgA-4qr8A:
undetectable		 4lbgA-4qr8A:
23.66
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.
4M11_C_MXMC606_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		3 / 3 LEU A 244
ARG A 260
MET A 436
 None
 0.87A 4m11C-4qr8A:
undetectable		 4m11C-4qr8A:
22.62
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.
5EAJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.93A 5eajA-4qr8A:
undetectable		 5eajA-4qr8A:
18.00
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.
5UJX_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		5 / 12 ALA A 225
LEU A 394
ILE A 314
LEU A 309
ILE A 387
 None
 0.93A 5ujxA-4qr8A:
undetectable		 5ujxA-4qr8A:
18.00
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.
5WM2_A_ACTA605_0
(SALICYLATE-AMP
LIGASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		3 / 3 THR A 163
THR A  14
ARG A  18
 None
 0.85A 5wm2A-4qr8A:
undetectable		 5wm2A-4qr8A:
21.78
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.
5X23_A_LSNA504_1
(CYTOCHROME P450 2C9)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 8 PHE A 389
ILE A 411
PHE A 332
THR A 316
 None
 1.15A 5x23A-4qr8A:
undetectable		 5x23A-4qr8A:
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.
6A5Y_D_9CRD501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		3 / 3 ASN A 179
VAL A 212
HIS A 207
 None
 0.85A 6a5yD-4qr8A:
undetectable		 6a5yD-4qr8A:
13.32
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.
6AG0_C_ACRC605_0
(ALPHA-AMYLASE)		 4qr8 XAA-PRO DIPEPTIDASE
(Escherichia
coli) 		4 / 8 ASP A  44
ASP A  45
HIS A  46
PRO A  47
 None
 1.00A 6ag0C-4qr8A:
undetectable		 6ag0C-4qr8A:
10.43