SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1wve'

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_B_NCAB700_0
(EXOTOXIN A)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 6 HIS A 291
GLY A 382
ALA A 287
GLU A 286
 None
 0.94A 1dmaB-1wveA:
undetectable		 1dmaB-1wveA:
19.16
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.
1G50_B_ESTB1600_1
(ESTROGEN RECEPTOR)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 12 LEU A 284
LEU A 442
GLY A 421
HIS A 418
LEU A 417
 None
 1.10A 1g50B-1wveA:
undetectable		 1g50B-1wveA:
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.
1G50_C_ESTC2600_1
(ESTROGEN RECEPTOR)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 11 LEU A 284
LEU A 442
GLY A 421
HIS A 418
LEU A 417
 None
 1.09A 1g50C-1wveA:
undetectable		 1g50C-1wveA:
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.
1LIN_A_TFPA155_1
(CALMODULIN)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 7 GLN A 409
MET A 435
PHE A 252
ALA A 426
 None
 1.31A 1linA-1wveA:
undetectable		 1linA-1wveA:
13.88
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.
1XDK_B_9CRB600_2
(RETINOIC ACID
RECEPTOR, BETA)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		3 / 3 LEU A 462
PHE A 479
ARG A 453
 None
 0.76A 1xdkB-1wveA:
undetectable		 1xdkB-1wveA:
20.98
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.
2GVC_B_MMZB501_1
(MONOOXYGENASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		3 / 3 ASN A 164
TYR A 172
SER A 156
 FAD  A 599 (-3.6A)
FAD  A 599 (-4.3A)
None
 0.49A 2gvcB-1wveA:
undetectable		 2gvcB-1wveA:
21.58
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.
2GVC_E_MMZE501_1
(MONOOXYGENASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		3 / 3 ASN A 164
TYR A 172
SER A 156
 FAD  A 599 (-3.6A)
FAD  A 599 (-4.3A)
None
 0.52A 2gvcE-1wveA:
undetectable		 2gvcE-1wveA:
21.58
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.
2IZQ_A_DVAA8_0
(GRAMICIDIN D)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		3 / 3 VAL A 336
TRP A 338
VAL A 341
 None
 0.94A 2izqA-1wveA:
undetectable
2izqB-1wveA:
undetectable		 2izqA-1wveA:
5.02
2izqB-1wveA:
5.02
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.
3F8W_C_ADNC302_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 12 SER A 153
HIS A 178
ALA A 159
GLY A  90
GLY A 163
 FAD  A 599 (-2.9A)
None
FAD  A 599 (-3.1A)
FAD  A 599 (-3.2A)
FAD  A 599 (-3.2A)
 1.06A 3f8wC-1wveA:
undetectable		 3f8wC-1wveA:
20.15
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.
3FAL_C_REAC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 10 GLN A  23
PHE A  25
LEU A  28
ALA A  27
ILE A 507
 None
 1.03A 3falC-1wveA:
undetectable		 3falC-1wveA:
17.78
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.
3TWP_D_SALD404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 5 ALA A  99
PRO A 100
TYR A  44
ALA A  61
 None
 1.42A 3twpD-1wveA:
undetectable		 3twpD-1wveA:
21.11
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.
4AGA_A_ACTA1131_0
(LYSOZYME C)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		3 / 3 ASN A 506
ASP A 516
ASN A 518
 None
 0.62A 4agaA-1wveA:
undetectable		 4agaA-1wveA:
12.43
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.
4LTW_A_486A303_1
(ANCESTRAL STEROID
RECEPTOR 2)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 9 LEU A 238
ALA A 126
GLN A 136
TYR A 140
LEU A 146
 None
 1.22A 4ltwA-1wveA:
undetectable		 4ltwA-1wveA:
17.39
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.
5DXE_A_ESTA1000_1
(ESTROGEN RECEPTOR)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 8 LEU A 284
LEU A 442
HIS A 418
LEU A 417
 None
 1.04A 5dxeA-1wveA:
undetectable		 5dxeA-1wveA:
18.30
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.
5FLC_C_RAPC999_1
(SERINE/THREONINE-PRO
TEIN KINASE MTOR
FKBP)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 8 SER A 156
PHE A 134
GLY A 135
THR A 165
 None
 0.99A 5flcB-1wveA:
1.8		 5flcB-1wveA:
17.45
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.
5FLC_G_RAPG999_1
(SERINE/THREONINE-PRO
TEIN KINASE MTOR
FKBP)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 8 SER A 156
PHE A 134
GLY A 135
THR A 165
 None
 0.99A 5flcF-1wveA:
0.8		 5flcF-1wveA:
17.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FXF_A_BEZA601_0
(EUGENOL OXIDASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		7 / 9 TYR A  95
VAL A 170
TYR A 172
ILE A 429
VAL A 438
TYR A 473
ARG A 474
 ACY  A1701 (-4.6A)
FAD  A 599 (-4.1A)
FAD  A 599 (-4.3A)
None
ACY  A1701 (-4.6A)
ACY  A1701 (-4.8A)
FAD  A 599 ( 3.1A)
 0.45A 5fxfA-1wveA:
53.0		 5fxfA-1wveA:
40.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FXF_B_BEZB601_0
(EUGENOL OXIDASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		7 / 10 TYR A  95
VAL A 170
TYR A 172
ILE A 429
VAL A 438
TYR A 473
ARG A 474
 ACY  A1701 (-4.6A)
FAD  A 599 (-4.1A)
FAD  A 599 (-4.3A)
None
ACY  A1701 (-4.6A)
ACY  A1701 (-4.8A)
FAD  A 599 ( 3.1A)
 0.43A 5fxfB-1wveA:
53.2		 5fxfB-1wveA:
40.45
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.
5HW4_A_SAMA801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 12 GLY A 469
ALA A 471
TYR A 487
LEU A 462
VAL A 483
 None
 1.20A 5hw4A-1wveA:
undetectable		 5hw4A-1wveA:
18.82
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.
5HW4_B_SAMB801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 11 GLY A 469
ALA A 471
TYR A 487
LEU A 462
VAL A 483
 None
 1.20A 5hw4B-1wveA:
undetectable		 5hw4B-1wveA:
18.82
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.
5HW4_C_SAMC801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 12 GLY A 469
ALA A 471
TYR A 487
LEU A 462
VAL A 483
 None
 1.19A 5hw4C-1wveA:
undetectable		 5hw4C-1wveA:
18.82
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.
5VOO_E_C2FE3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		5 / 12 GLU A  79
VAL A  62
LEU A 108
GLY A  72
ILE A  76
 None
 1.19A 5vooE-1wveA:
undetectable		 5vooE-1wveA:
20.46
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.
6CBZ_A_ESTA601_1
(ESTROGEN RECEPTOR)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 8 LEU A 284
LEU A 442
HIS A 418
LEU A 417
 None
 1.04A 6cbzA-1wveA:
undetectable		 6cbzA-1wveA:
10.06
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.
6CJK_C_ACTC301_0
(IMMUNOGLOBULIN FAB
LIGHT CHAIN)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		4 / 4 VAL A 101
GLY A 511
ASP A 516
ASP A 481
 None
 1.30A 6cjkC-1wveA:
undetectable		 6cjkC-1wveA:
17.33
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.
6EXI_B_ADNB503_0
(ADENOSYLHOMOCYSTEINA
SE)		 1wve 4-CRESOL
DEHYDROGENASE
[HYDROXYLATING]
FLAVOPROTEIN SUBUNIT
(Pseudomonas
putida) 		3 / 3 LEU A  35
GLN A  40
LYS A 112
 None
 0.75A 6exiA-1wveA:
undetectable		 6exiA-1wveA:
9.60