SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3u0a'

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.
2BDM_A_TMIA501_1
(CYTOCHROME P450 2B4)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		4 / 7 MET A 102
PHE A 100
GLY A  35
ILE A   3
 None
 1.00A 2bdmA-3u0aA:
undetectable		 2bdmA-3u0aA:
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.
3EL1_A_DR7A100_2
(PROTEASE)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		6 / 12 ARG A  78
GLY A 103
ALA A 104
VAL A  55
ILE A 186
VAL A  49
 SO4  A 283 (-3.5A)
None
None
None
None
NA  A 286 (-4.1A)
 1.37A 3el1B-3u0aA:
undetectable		 3el1B-3u0aA:
15.58
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.
3SP9_B_IL2B901_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		5 / 12 VAL A 183
CYH A 187
LEU A  58
VAL A  55
HIS A  36
 None
 1.12A 3sp9B-3u0aA:
undetectable		 3sp9B-3u0aA:
24.62
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.
3UJ7_A_SAMA301_1
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		3 / 3 SER A 166
ASP A 236
ASP A 117
 None
 0.80A 3uj7A-3u0aA:
undetectable		 3uj7A-3u0aA:
20.39
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.
4MWZ_A_SAMA301_1
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		3 / 3 SER A 166
ASP A 236
ASP A 117
 None
 0.76A 4mwzA-3u0aA:
undetectable		 4mwzA-3u0aA:
20.50
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.
4ZE1_A_X2NA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		5 / 12 TYR A  61
GLY A  60
MET A 102
LEU A 248
MET A 265
 None
 1.34A 4ze1A-3u0aA:
0.6		 4ze1A-3u0aA:
20.26
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.
5L5Z_H_BO2H301_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-3)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		5 / 12 THR A 270
ALA A 247
GLY A 268
THR A 249
ASP A 194
 None
 1.37A 5l5zH-3u0aA:
undetectable
5l5zI-3u0aA:
undetectable		 5l5zH-3u0aA:
19.38
5l5zI-3u0aA:
25.24
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.
5L5Z_V_BO2V301_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-3)		 3u0a ACYL-COA
THIOESTERASE II
TESB2
(Mycobacterium
marinum) 		5 / 12 THR A 270
ALA A 247
GLY A 268
THR A 249
ASP A 194
 None
 1.36A 5l5zV-3u0aA:
undetectable
5l5zW-3u0aA:
undetectable		 5l5zV-3u0aA:
19.38
5l5zW-3u0aA:
25.24