SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'TUX'


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.
1HRK_A_CHDA1501_0
(FERROCHELATASE)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		5 / 12 LEU A  62
PHE A  39
LEU A 249
HIS A 265
LEU A 243
 None
None
None
TUX  A 901 (-4.1A)
None
 1.17A 1hrkA-2go4A:
undetectable		 1hrkA-2go4A:
21.21
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.
1J96_B_TESB904_1
(3ALPHA-HYDROXYSTEROI
D DEHYDROGENASE TYPE
3)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		4 / 7 VAL A  96
ILE A  94
GLU A  78
LEU A 249
 None
None
TUX  A 901 (-3.6A)
None
 0.95A 1j96B-2go4A:
undetectable		 1j96B-2go4A:
24.48
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.
5IGV_A_ZITA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		5 / 12 ILE A  18
GLY A 210
ASP A 242
HIS A  79
ARG A 190
 TUX  A 901 ( 4.9A)
TUX  A 901 ( 3.9A)
ZN  A 601 ( 2.2A)
ZN  A 601 ( 3.3A)
None
 1.12A 5igvA-2go4A:
undetectable		 5igvA-2go4A:
25.30
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.
5IGW_A_CTYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		5 / 12 ILE A  18
GLY A 210
ASP A 242
HIS A  79
ARG A 190
 TUX  A 901 ( 4.9A)
TUX  A 901 ( 3.9A)
ZN  A 601 ( 2.2A)
ZN  A 601 ( 3.3A)
None
 1.19A 5igwA-2go4A:
undetectable		 5igwA-2go4A:
25.30
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.
5LG3_I_Z80I401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		4 / 9 ILE A 201
THR A 191
ASN A 214
ILE A  18
 TUX  A 901 (-4.7A)
TUX  A 901 (-2.9A)
None
TUX  A 901 ( 4.9A)
 0.98A 5lg3I-2go4A:
undetectable		 5lg3I-2go4A:
23.92
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.
5VEU_A_RITA602_1
(CYTOCHROME P450 3A5)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		5 / 12 LEU A 229
PHE A 167
PHE A 194
ALA A 193
GLY A 159
 None
None
None
TUX  A 901 ( 3.9A)
None
 1.00A 5veuA-2go4A:
undetectable		 5veuA-2go4A:
20.25
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.
5VEU_B_RITB602_1
(CYTOCHROME P450 3A5)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		5 / 12 LEU A 229
PHE A 167
PHE A 194
ALA A 193
GLY A 159
 None
None
None
TUX  A 901 ( 3.9A)
None
 1.01A 5veuB-2go4A:
undetectable		 5veuB-2go4A:
20.25
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)		 2go4 UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Aquifex
aeolicus) 		5 / 12 LEU A 229
PHE A 167
PHE A 194
ALA A 193
GLY A 159
 None
None
None
TUX  A 901 ( 3.9A)
None
 1.00A 5veuH-2go4A:
undetectable		 5veuH-2go4A:
20.25