SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2OP'


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.
1DZ6_A_CAMA502_0
(CYTOCHROME P450-CAM)
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli)
4 / 5 TYR A 552
LEU A 513
VAL A 402
ASP A 370
2OP  A2002 (-4.7A)
FAD  A2001 (-4.2A)
FAD  A2001 (-4.4A)
FAD  A2001 ( 3.7A)
1.30A 1dz6A-4o8aA:
undetectable
1dz6A-4o8aA:
20.20
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.
1ONI_B_BEZB503_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli)
4 / 6 ARG A 555
ALA A 436
TYR A 552
GLU A 559
2OP  A2002 (-3.6A)
FAD  A2001 ( 3.5A)
2OP  A2002 (-4.7A)
FAD  A2001 (-2.7A)
1.22A 1oniB-4o8aA:
undetectable
1oniC-4o8aA:
undetectable
1oniB-4o8aA:
14.08
1oniC-4o8aA:
14.08
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.
1ONI_F_BEZF511_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli)
4 / 5 TYR A 552
GLU A 559
ARG A 555
ALA A 436
2OP  A2002 (-4.7A)
FAD  A2001 (-2.7A)
2OP  A2002 (-3.6A)
FAD  A2001 ( 3.5A)
1.22A 1oniE-4o8aA:
0.2
1oniF-4o8aA:
undetectable
1oniE-4o8aA:
14.08
1oniF-4o8aA:
14.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TJ2_A_ACTA2002_0
(BIFUNCTIONAL PUTA
PROTEIN)
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli)
5 / 5 LYS A 329
ALA A 436
TYR A 552
ARG A 555
ARG A 556
2OP  A2002 (-2.7A)
FAD  A2001 ( 3.5A)
2OP  A2002 (-4.7A)
2OP  A2002 (-3.6A)
2OP  A2002 ( 2.8A)
0.11A 1tj2A-4o8aA:
68.9
1tj2A-4o8aA:
100.00
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.
2A3A_B_TEPB2434_1
(CHITINASE)
5gzy (R)-2-HALOACID
DEHALOGENASE

(Pseudomonas
putida)
3 / 3 TRP A  67
THR A  53
TYR A 134
None
None
2OP  A 401 ( 4.6A)
1.23A 2a3aB-5gzyA:
undetectable
2a3aB-5gzyA:
23.91
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.
2RK8_B_PPFB3969_1
(PHOSPHOENOLPYRUVATE
CARBOXYKINASE,
CYTOSOLIC [GTP])
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli)
4 / 7 LYS A 329
SER A 283
ASP A 285
ARG A 431
2OP  A2002 (-2.7A)
None
None
FAD  A2001 (-4.0A)
1.50A 2rk8B-4o8aA:
undetectable
2rk8B-4o8aA:
21.36
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)
5gzy (R)-2-HALOACID
DEHALOGENASE

(Pseudomonas
putida)
5 / 12 ILE A  21
VAL A 277
ILE A 278
ILE A  52
VAL A  56
None
None
None
2OP  A 401 (-4.0A)
None
1.07A 3kpdC-5gzyA:
undetectable
3kpdC-5gzyA:
15.95
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.
4G19_A_ACTA304_0
(GLUTATHIONE
TRANSFERASE GTE1)
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli)
4 / 5 ILE A 328
LEU A 330
LYS A 329
ASN A 368
None
None
2OP  A2002 (-2.7A)
None
1.10A 4g19A-4o8aA:
undetectable
4g19A-4o8aA:
17.77