SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'CE6'


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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)
4xeb GLUCANASE
(Talaromyces
funiculosus)
12 / 12 ALA A 140
TYR A 142
TYR A 168
ASP A 170
SER A 171
GLN A 172
GLU A 209
ASP A 211
GLU A 214
THR A 243
ARG A 248
ASP A 373
CE6  A 505 ( 4.7A)
CE6  A 505 (-4.3A)
None
K  A 506 (-3.2A)
K  A 506 ( 4.8A)
CBI  A 504 (-4.4A)
K  A 506 (-2.6A)
K  A 506 ( 4.7A)
CBI  A 504 ( 4.4A)
CBI  A 504 (-3.1A)
CBI  A 504 (-2.8A)
None
0.30A 1dy4A-4xebA:
64.9
1dy4A-4xebA:
64.79
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.
2HA4_B_ACHB603_0
(ACETYLCHOLINESTERASE)
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca)
4 / 7 TYR A 300
GLU A 108
TYR A 385
GLY A 383
CE6  A 703 (-3.8A)
CE6  A 703 ( 4.5A)
None
None
1.21A 2ha4B-4jjjA:
undetectable
2ha4B-4jjjA:
23.26
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.
2PH9_A_GNTA301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca)
4 / 7 TYR A 105
GLN A 109
TYR A 115
ILE A 317
None
None
None
CE6  A 703 (-4.8A)
1.30A 2ph9A-4jjjA:
undetectable
2ph9B-4jjjA:
undetectable
2ph9A-4jjjA:
16.64
2ph9B-4jjjA:
16.64
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.
3JQA_A_DX4A270_0
(PTERIDINE REDUCTASE
1)
4xeb GLUCANASE
(Talaromyces
funiculosus)
4 / 6 SER A 369
ASP A 211
TYR A 142
PRO A 174
CE6  A 505 (-2.7A)
K  A 506 ( 4.7A)
CE6  A 505 (-4.3A)
None
1.48A 3jqaA-4xebA:
undetectable
3jqaA-4xebA:
21.30
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.
3JQA_B_DX4B270_0
(PTERIDINE REDUCTASE
1)
4xeb GLUCANASE
(Talaromyces
funiculosus)
4 / 6 SER A 369
ASP A 211
TYR A 142
PRO A 174
CE6  A 505 (-2.7A)
K  A 506 ( 4.7A)
CE6  A 505 (-4.3A)
None
1.46A 3jqaB-4xebA:
undetectable
3jqaB-4xebA:
21.30
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.
3JQA_D_DX4D270_0
(PTERIDINE REDUCTASE
1)
4xeb GLUCANASE
(Talaromyces
funiculosus)
4 / 6 SER A 369
ASP A 211
TYR A 142
PRO A 174
CE6  A 505 (-2.7A)
K  A 506 ( 4.7A)
CE6  A 505 (-4.3A)
None
1.46A 3jqaD-4xebA:
undetectable
3jqaD-4xebA:
21.30
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.
3TWP_D_SALD404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca)
4 / 5 ASN A 221
ALA A 222
PRO A 223
ALA A 227
None
CE6  A 703 ( 4.1A)
None
None
1.30A 3twpD-4jjjA:
undetectable
3twpD-4jjjA:
21.12
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.
3WIP_F_ACHF301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)
4xeb GLUCANASE
(Talaromyces
funiculosus)
4 / 7 TYR A 142
THR A 105
TYR A 168
TYR A 106
CE6  A 505 (-4.3A)
None
None
None
1.49A 3wipF-4xebA:
undetectable
3wipG-4xebA:
undetectable
3wipF-4xebA:
18.69
3wipG-4xebA:
18.69
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.
4E7C_A_ACTA504_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca)
3 / 3 ARG A 316
TRP A 315
GLY A 304
None
CE6  A 703 (-3.6A)
None
1.00A 4e7cA-4jjjA:
undetectable
4e7cA-4jjjA:
20.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4IPM_A_ACTA503_0
(GH7 FAMILY PROTEIN)
4xeb GLUCANASE
(Talaromyces
funiculosus)
9 / 9 ASN A 138
ALA A 140
TYR A 142
TYR A 168
ASP A 170
GLU A 209
ASP A 211
GLU A 214
TRP A 371
None
CE6  A 505 ( 4.7A)
CE6  A 505 (-4.3A)
None
K  A 506 (-3.2A)
K  A 506 (-2.6A)
K  A 506 ( 4.7A)
CBI  A 504 ( 4.4A)
CE6  A 505 (-3.7A)
0.49A 4ipmA-4xebA:
62.3
4ipmA-4xebA:
52.04
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.
4QTU_B_SAMB301_1
(PUTATIVE
METHYLTRANSFERASE
BUD23)
4xeb GLUCANASE
(Talaromyces
funiculosus)
4 / 5 TYR A 168
SER A 369
ASP A 211
ASP A 259
None
CE6  A 505 (-2.7A)
K  A 506 ( 4.7A)
CL  A 510 (-3.4A)
1.10A 4qtuB-4xebA:
undetectable
4qtuB-4xebA:
18.04
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.
5X66_C_MTXC402_1
(THYMIDYLATE SYNTHASE)
4xeb GLUCANASE
(Talaromyces
funiculosus)
5 / 9 ILE A  84
LEU A 370
GLY A 102
ASN A 100
ALA A 140
None
None
None
CE6  A 505 (-3.6A)
CE6  A 505 ( 4.7A)
1.37A 5x66C-4xebA:
undetectable
5x66C-4xebA:
18.37