SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'DHE'


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.
1Q23_B_FUAB703_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1hzv NITRITE REDUCTASE
(Pseudomonas
aeruginosa) 		3 / 3 VAL A 348
ALA A 341
HIS A 327
 None
None
DHE  A 602 (-4.3A)
 0.76A 1q23C-1hzvA:
0.0		 1q23C-1hzvA:
16.70
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.
1Q23_K_FUAK712_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1hzv NITRITE REDUCTASE
(Pseudomonas
aeruginosa) 		3 / 3 VAL A 348
ALA A 341
HIS A 327
 None
None
DHE  A 602 (-4.3A)
 0.69A 1q23L-1hzvA:
0.0		 1q23L-1hzvA:
16.70
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.
1RJD_A_SAMA801_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)		 1hzv NITRITE REDUCTASE
(Pseudomonas
aeruginosa) 		5 / 12 ILE A 286
ASP A 328
ALA A 341
GLY A 373
GLY A 371
 None
NO  A 603 (-3.9A)
None
None
DHE  A 602 ( 3.9A)
 1.08A 1rjdA-1hzvA:
undetectable		 1rjdA-1hzvA:
19.53
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.
1ZLQ_B_EDTB1511_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		4 / 8 TYR A 263
ARG A 243
ARG A 299
THR A  77
 DHE  A 602 (-4.4A)
DHE  A 602 (-3.9A)
None
None
 1.44A 1zlqB-1gq1A:
undetectable		 1zlqB-1gq1A:
24.63
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.
2Q72_A_IXXA802_1
(TRANSPORTER)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		4 / 6 ILE A 179
SER A 170
ARG A 203
ILE A 245
 None
None
DHE  A 602 (-3.5A)
None
 1.05A 2q72A-1gq1A:
0.0		 2q72A-1gq1A:
22.46
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.
3CL9_A_MTXA602_2
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))		 1hzv NITRITE REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 4 VAL A 296
ARG A 225
ILE A 202
THR A 266
 None
DHE  A 602 (-3.5A)
None
None
 1.24A 3cl9A-1hzvA:
undetectable		 3cl9A-1hzvA:
22.20
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.
3V3O_D_T1CD401_1
(TETX2 PROTEIN)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		5 / 10 ASP A 565
HIS A 307
GLN A 507
ASN A 558
GLY A 508
 None
None
DHE  A 602 (-4.1A)
None
None
 1.47A 3v3oD-1gq1A:
0.0		 3v3oD-1gq1A:
22.78
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.
4I13_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		3 / 3 ASP A 175
ARG A 243
THR A 552
 None
DHE  A 602 (-3.9A)
None
 0.74A 4i13A-1gq1A:
undetectable		 4i13A-1gq1A:
14.44
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.
4LAJ_B_ACAB512_1
(HIV-1 YU2 GP120
ENVELOPE
GLYCOPROTEIN)		 1hzv NITRITE REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 6 ARG A 372
GLY A 329
ASP A 541
HIS A 289
 DHE  A 602 (-3.6A)
None
None
None
 1.17A 4lajA-1hzvA:
undetectable
4lajB-1hzvA:
undetectable		 4lajA-1hzvA:
21.56
4lajB-1hzvA:
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.
4LAJ_B_ACAB512_1
(HIV-1 YU2 GP120
ENVELOPE
GLYCOPROTEIN)		 1hzv NITRITE REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 6 ARG A 372
GLY A 371
ASP A 541
HIS A 289
 DHE  A 602 (-3.6A)
DHE  A 602 ( 3.9A)
None
None
 1.19A 4lajA-1hzvA:
undetectable
4lajB-1hzvA:
undetectable		 4lajA-1hzvA:
21.56
4lajB-1hzvA:
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.
4P3R_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		3 / 3 ASP A 175
ARG A 243
THR A 552
 None
DHE  A 602 (-3.9A)
None
 0.72A 4p3rA-1gq1A:
undetectable		 4p3rA-1gq1A:
14.44
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.
5L8D_A_EDTA609_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		4 / 8 TYR A 263
ARG A 243
ARG A 299
THR A  77
 DHE  A 602 (-4.4A)
DHE  A 602 (-3.9A)
None
None
 1.44A 5l8dA-1gq1A:
undetectable		 5l8dA-1gq1A:
24.63
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.
5MWU_A_EDTA609_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		4 / 8 TYR A 263
ARG A 243
ARG A 299
THR A  77
 DHE  A 602 (-4.4A)
DHE  A 602 (-3.9A)
None
None
 1.44A 5mwuA-1gq1A:
undetectable		 5mwuA-1gq1A:
24.63