SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2a00'

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.
1EIZ_A_SAMA301_0
(FTSJ)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 ALA A 407
GLY A 436
GLY A 410
GLY A 409
LEU A 440
None
0.96A 1eizA-2a00A:
undetectable
1eizA-2a00A:
21.16
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.
1EJ0_A_SAMA301_0
(FTSJ)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 ALA A 407
GLY A 436
GLY A 410
GLY A 409
LEU A 440
None
0.94A 1ej0A-2a00A:
undetectable
1ej0A-2a00A:
21.16
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.
1HSH_C_MK1C402_2
(HIV-II PROTEASE)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
4 / 8 GLY A 385
ILE A 393
ILE A 443
ILE A 352
None
0.66A 1hshD-2a00A:
undetectable
1hshD-2a00A:
19.87
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.
2IDW_B_017B401_2
(PROTEASE)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 9 LEU A 431
ALA A 337
ASP A 335
ILE A 354
ILE A 443
ANP  A1001 (-4.0A)
None
None
None
None
0.95A 2idwB-2a00A:
undetectable
2idwB-2a00A:
18.99
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.
2XCT_G_CPFG1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
3 / 3 ARG A 382
GLY A 396
SER A 351
ANP  A1001 (-2.8A)
ANP  A1001 (-3.5A)
None
0.60A 2xctB-2a00A:
undetectable
2xctB-2a00A:
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.
3BJW_F_SVRF502_3
(PHOSPHOLIPASE A2)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 VAL A 439
LEU A 440
GLY A 441
ILE A 323
PRO A 430
None
1.14A 3bjwF-2a00A:
undetectable
3bjwF-2a00A:
16.55
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.
3DOU_A_SAMA1_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 ALA A 407
GLY A 436
GLY A 410
GLY A 409
LEU A 440
None
0.94A 3douA-2a00A:
undetectable
3douA-2a00A:
20.67
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.
3K4V_B_ROCB201_1
(HIV-1 PROTEASE)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 LEU A 431
ALA A 337
ASP A 335
ILE A 354
ILE A 443
ANP  A1001 (-4.0A)
None
None
None
None
0.86A 3k4vA-2a00A:
undetectable
3k4vA-2a00A:
20.78
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.
3NDT_A_ROCA101_1
(PROTEASE)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 LEU A 431
ALA A 337
ASP A 335
ILE A 354
ILE A 443
ANP  A1001 (-4.0A)
None
None
None
None
0.87A 3ndtA-2a00A:
undetectable
3ndtA-2a00A:
20.78
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.
3TL9_A_ROCA401_1
(PROTEASE)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 LEU A 431
ALA A 337
ASP A 335
ILE A 354
ILE A 443
ANP  A1001 (-4.0A)
None
None
None
None
0.87A 3tl9A-2a00A:
undetectable
3tl9A-2a00A:
21.83
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.
3UA1_A_08YA600_1
(CYTOCHROME P450 3A4)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
5 / 12 ARG A 394
ILE A 401
THR A 332
THR A 346
ALA A 343
None
None
None
ANP  A1001 ( 4.5A)
None
1.29A 3ua1A-2a00A:
undetectable
3ua1A-2a00A:
14.73
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.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)
2a00 POTASSIUM-TRANSPORTI
NG ATPASE B CHAIN

(Escherichia
coli)
3 / 3 ILE A 393
ASP A 335
ARG A 438
None
0.73A 4pstA-2a00A:
undetectable
4pstA-2a00A:
19.05