SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'DAN'


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.
1A4G_A_ZMRA466_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.87A 1a4gA-1ms8A:
23.8
1a4gA-1ms8A:
19.30
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.
1A4G_B_ZMRB466_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.98A 1a4gB-1ms8A:
23.5
1a4gB-1ms8A:
19.30
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.
1JU6_A_LYAA317_1
(THYMIDYLATE SYNTHASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 11 ILE A 131
ASP A  96
LEU A 176
GLY A 177
PHE A 175
None
DAN  A 700 (-3.3A)
None
None
None
1.29A 1ju6A-1ms8A:
0.0
1ju6A-1ms8A:
18.21
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.
1JU6_C_LYAC315_1
(THYMIDYLATE SYNTHASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 10 ILE A 131
ASP A  96
LEU A 176
GLY A 177
PHE A 175
None
DAN  A 700 (-3.3A)
None
None
None
1.29A 1ju6C-1ms8A:
0.0
1ju6C-1ms8A:
18.21
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.
2CML_A_ZMRA1477_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.94A 2cmlA-1ms8A:
3.7
2cmlA-1ms8A:
18.73
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.
2CML_B_ZMRB2477_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.95A 2cmlB-1ms8A:
20.2
2cmlB-1ms8A:
18.73
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.
2CML_C_ZMRC3477_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.71A 2cmlC-1ms8A:
4.7
2cmlC-1ms8A:
18.73
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.
2CML_D_ZMRD4477_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.67A 2cmlD-1ms8A:
20.5
2cmlD-1ms8A:
18.73
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.
2CML_D_ZMRD4477_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.03A 2cmlD-1ms8A:
20.5
2cmlD-1ms8A:
18.73
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.
2F0Z_A_ZMRA381_1
(SIALIDASE 2)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.77A 2f0zA-1ms8A:
37.2
2f0zA-1ms8A:
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.
2F10_A_BCZA382_0
(SIALIDASE 2)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ARG A  53
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.85A 2f10A-1ms8A:
36.6
2f10A-1ms8A:
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.
2Y7K_B_SALB1305_1
(LYSR-TYPE REGULATORY
PROTEIN)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 5 SER A 229
ARG A 245
PRO A 283
GLY A 284
DAN  A 700 ( 4.3A)
DAN  A 700 (-2.8A)
None
None
1.33A 2y7kB-1ms8A:
undetectable
2y7kB-1ms8A:
16.51
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.
2Y7P_A_SALA1001_1
(LYSR-TYPE REGULATORY
PROTEIN)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 6 SER A 229
ARG A 245
PRO A 283
GLY A 284
DAN  A 700 ( 4.3A)
DAN  A 700 (-2.8A)
None
None
1.49A 2y7pA-1ms8A:
0.0
2y7pA-1ms8A:
16.51
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.
2YA7_A_ZMRA1776_1
(NEURAMINIDASE A)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  51
ASP A  96
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.97A 2ya7A-1ms8A:
40.0
2ya7A-1ms8A:
24.70
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.
2YA7_B_ZMRB1776_1
(NEURAMINIDASE A)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  51
ASP A  96
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.97A 2ya7B-1ms8A:
39.9
2ya7B-1ms8A:
24.70
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.
2YA7_C_ZMRC1776_1
(NEURAMINIDASE A)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  51
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
None
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.81A 2ya7C-1ms8A:
36.1
2ya7C-1ms8A:
24.70
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.
2YA7_C_ZMRC1776_1
(NEURAMINIDASE A)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  51
ASP A  96
ARG A 245
ARG A 314
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
0.86A 2ya7C-1ms8A:
36.1
2ya7C-1ms8A:
24.70
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.
2YA7_D_ZMRD1776_1
(NEURAMINIDASE A)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  51
ASP A  96
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.98A 2ya7D-1ms8A:
39.5
2ya7D-1ms8A:
24.70
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.
3B7E_A_ZMRA1001_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.97A 3b7eA-1ms8A:
20.2
3b7eA-1ms8A:
20.88
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.
3B7E_B_ZMRB1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.96A 3b7eB-1ms8A:
20.4
3b7eB-1ms8A:
20.88
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.
3EIG_A_MTXA200_2
(DIHYDROFOLATE
REDUCTASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 5 ASP A  96
ARG A  35
ILE A  63
VAL A  66
DAN  A 700 (-3.3A)
DAN  A 700 (-3.0A)
None
None
1.17A 3eigA-1ms8A:
undetectable
3eigA-1ms8A:
13.41
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.
3K37_B_BCZB468_0
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
0.82A 3k37B-1ms8A:
23.3
3k37B-1ms8A:
20.03
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.
3K39_B_BCZB1001_0
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.64A 3k39B-1ms8A:
23.4
3k39B-1ms8A:
20.03
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.
3SAN_A_ZMRA901_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.01A 3sanA-1ms8A:
20.6
3sanA-1ms8A:
19.67
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.
3SAN_B_ZMRB901_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.01A 3sanB-1ms8A:
12.0
3sanB-1ms8A:
19.67
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.
3TI5_A_ZMRA1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.93A 3ti5A-1ms8A:
11.1
3ti5A-1ms8A:
20.58
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.
3TI5_B_ZMRB1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.93A 3ti5B-1ms8A:
7.2
3ti5B-1ms8A:
20.58
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.
3TIC_A_ZMRA1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.92A 3ticA-1ms8A:
20.2
3ticA-1ms8A:
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.
3TIC_B_ZMRB1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.68A 3ticB-1ms8A:
20.0
3ticB-1ms8A:
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.
3TIC_B_ZMRB1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.94A 3ticB-1ms8A:
20.0
3ticB-1ms8A:
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.
3TIC_C_ZMRC1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.93A 3ticC-1ms8A:
20.1
3ticC-1ms8A:
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.
3TIC_D_ZMRD1002_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.92A 3ticD-1ms8A:
20.2
3ticD-1ms8A:
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.
4B7N_A_ZMRA601_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.95A 4b7nA-1ms8A:
11.2
4b7nA-1ms8A:
22.31
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.
4B7Q_A_ZMRA601_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.99A 4b7qA-1ms8A:
10.7
4b7qA-1ms8A:
22.41
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.
4B7Q_B_ZMRB601_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.74A 4b7qB-1ms8A:
20.3
4b7qB-1ms8A:
22.41
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.
4B7Q_C_ZMRC601_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.97A 4b7qC-1ms8A:
10.7
4b7qC-1ms8A:
22.41
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.
4B7Q_D_ZMRD601_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.74A 4b7qD-1ms8A:
10.6
4b7qD-1ms8A:
22.41
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.
4B7Q_D_ZMRD601_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.00A 4b7qD-1ms8A:
10.6
4b7qD-1ms8A:
22.41
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.
4CPN_A_ZMRA700_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
0.85A 4cpnA-1ms8A:
23.4
4cpnA-1ms8A:
21.20
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.
4CPN_A_ZMRA700_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.73A 4cpnA-1ms8A:
23.4
4cpnA-1ms8A:
21.20
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.
4CPN_B_ZMRB700_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
0.84A 4cpnB-1ms8A:
24.2
4cpnB-1ms8A:
21.20
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.
4CPN_B_ZMRB700_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.69A 4cpnB-1ms8A:
24.2
4cpnB-1ms8A:
21.20
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.
4CPZ_A_ZMRA1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.01A 4cpzA-1ms8A:
6.6
4cpzA-1ms8A:
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.
4CPZ_A_ZMRA1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
LEU A 176
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
None
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.41A 4cpzA-1ms8A:
6.6
4cpzA-1ms8A:
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.
4CPZ_B_ZMRB1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.97A 4cpzB-1ms8A:
23.7
4cpzB-1ms8A:
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.
4CPZ_B_ZMRB1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
LEU A 176
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
None
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.40A 4cpzB-1ms8A:
23.7
4cpzB-1ms8A:
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.
4CPZ_C_ZMRC1470_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.96A 4cpzC-1ms8A:
23.4
4cpzC-1ms8A:
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.
4CPZ_D_ZMRD1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.96A 4cpzD-1ms8A:
23.5
4cpzD-1ms8A:
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.
4CPZ_E_ZMRE1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.97A 4cpzE-1ms8A:
24.0
4cpzE-1ms8A:
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.
4CPZ_F_ZMRF1470_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.69A 4cpzF-1ms8A:
23.8
4cpzF-1ms8A:
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.
4CPZ_F_ZMRF1470_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.06A 4cpzF-1ms8A:
23.8
4cpzF-1ms8A:
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.
4CPZ_G_ZMRG1471_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.93A 4cpzG-1ms8A:
23.6
4cpzG-1ms8A:
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.
4CPZ_H_ZMRH1470_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.5A)
0.65A 4cpzH-1ms8A:
23.4
4cpzH-1ms8A:
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.
4FEU_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 7 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.91A 4feuB-1ms8A:
0.5
4feuB-1ms8A:
18.18
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.
4FEU_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.96A 4feuF-1ms8A:
0.4
4feuF-1ms8A:
18.18
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.
4FEV_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 7 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.96A 4fevD-1ms8A:
0.5
4fevD-1ms8A:
18.18
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.
4FEV_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 7 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.97A 4fevF-1ms8A:
0.0
4fevF-1ms8A:
18.18
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.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.95A 4fewD-1ms8A:
1.4
4fewD-1ms8A:
18.18
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.
4FEW_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.95A 4fewF-1ms8A:
undetectable
4fewF-1ms8A:
18.18
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.
4FEX_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 7 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.95A 4fexB-1ms8A:
0.7
4fexB-1ms8A:
18.18
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.
4GKH_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
1.03A 4gkhB-1ms8A:
0.0
4gkhB-1ms8A:
18.18
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.
4GKH_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.98A 4gkhF-1ms8A:
0.0
4gkhF-1ms8A:
18.18
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.
4GKH_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 7 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.97A 4gkhG-1ms8A:
undetectable
4gkhG-1ms8A:
18.18
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.
4GKH_K_KANK301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.99A 4gkhC-1ms8A:
0.4
4gkhK-1ms8A:
0.0
4gkhC-1ms8A:
18.18
4gkhK-1ms8A:
18.18
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.
4GKI_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.96A 4gkiA-1ms8A:
undetectable
4gkiA-1ms8A:
18.18
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.
4GKI_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 8 ASP A  59
ASP A  51
GLU A 357
ASP A  96
DAN  A 700 (-2.7A)
None
None
DAN  A 700 (-3.3A)
0.96A 4gkiE-1ms8A:
0.8
4gkiG-1ms8A:
undetectable
4gkiE-1ms8A:
18.18
4gkiG-1ms8A:
18.18
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.
4I00_A_ZMRA509_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.92A 4i00A-1ms8A:
2.3
4i00A-1ms8A:
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.
4IIL_A_RBFA401_1
(MEMBRANE LIPOPROTEIN
TPN38(B))
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 SER A 285
TYR A 342
ASP A  96
TYR A 119
GLY A 284
None
DAN  A 700 (-3.5A)
DAN  A 700 (-3.3A)
DAN  A 700 (-4.2A)
None
1.11A 4iilA-1ms8A:
undetectable
4iilA-1ms8A:
21.73
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.
4MWX_A_ZMRA513_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
1.01A 4mwxA-1ms8A:
19.9
4mwxA-1ms8A:
21.08
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.
4MX0_A_BCZA513_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
3 / 3 ARG A  35
ASP A  59
ARG A 314
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.0A)
0.78A 4mx0A-1ms8A:
19.9
4mx0A-1ms8A:
21.08
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.
4WA5_A_ZMRA501_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.99A 4wa5A-1ms8A:
8.1
4wa5A-1ms8A:
21.89
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.
5HFJ_G_SAMG301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
5 / 12 ALA A 341
ASP A  96
THR A  98
THR A  65
SER A 343
None
DAN  A 700 (-3.3A)
None
None
None
1.20A 5hfjG-1ms8A:
undetectable
5hfjG-1ms8A:
15.41
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.
5L17_A_ZMRA512_1
(NEURAMINIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ASP A  59
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-2.7A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.91A 5l17A-1ms8A:
20.2
5l17A-1ms8A:
21.81
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.
5X7P_A_ACRA1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 6 SER A 343
ARG A  35
GLU A 357
TYR A 342
None
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.5A)
1.23A 5x7pA-1ms8A:
7.0
5x7pA-1ms8A:
20.14
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.
5X7P_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 6 SER A 343
ARG A  35
GLU A 357
TYR A 342
None
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.5A)
1.29A 5x7pB-1ms8A:
5.6
5x7pB-1ms8A:
20.14
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.
5X7Q_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 6 SER A 343
ARG A  35
GLU A 357
TYR A 342
None
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.5A)
1.27A 5x7qB-1ms8A:
6.9
5x7qB-1ms8A:
20.14
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.
5X7R_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
4 / 6 SER A 343
ARG A  35
GLU A 357
TYR A 342
None
DAN  A 700 (-3.0A)
None
DAN  A 700 (-3.5A)
1.29A 5x7rB-1ms8A:
5.6
5x7rB-1ms8A:
20.14
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.
6EKU_A_ZMRA901_1
(SIALIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
6 / 12 ARG A  35
ARG A  53
ASP A  96
ARG A 245
ASP A 247
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
None
DAN  A 700 (-3.5A)
0.91A 6ekuA-1ms8A:
38.0
6ekuA-1ms8A:
22.19
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.
6EKU_A_ZMRA901_1
(SIALIDASE)
1ms8 TRANS-SIALIDASE
(Trypanosoma
cruzi)
7 / 12 ARG A  35
ARG A  53
ASP A  96
GLU A 230
ARG A 245
ARG A 314
TYR A 342
DAN  A 700 (-3.0A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.3A)
DAN  A 700 (-3.3A)
DAN  A 700 (-2.8A)
DAN  A 700 (-3.0A)
DAN  A 700 (-3.5A)
0.85A 6ekuA-1ms8A:
38.0
6ekuA-1ms8A:
22.19