SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3BG'


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.
1EII_A_RTLA135_1
(CELLULAR
RETINOL-BINDING
PROTEIN II)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		4 / 7 TYR A 123
THR A 133
SER A 128
TRP A 237
 None
3BG  A 601 (-3.7A)
None
None
 1.41A 1eiiA-4qreA:
undetectable		 1eiiA-4qreA:
10.99
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.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		5 / 11 HIS A  20
GLY A  22
HIS A  23
ILE A 273
HIS A 299
 ATP  A 602 (-4.5A)
ATP  A 602 (-3.6A)
ATP  A 602 (-3.9A)
3BG  A 601 ( 3.9A)
ATP  A 602 (-4.6A)
 0.52A 1pg2A-4qreA:
38.6		 1pg2A-4qreA:
28.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		5 / 11 HIS A  20
GLY A  22
HIS A  23
ILE A 273
HIS A 299
 ATP  A 602 (-4.5A)
ATP  A 602 (-3.6A)
ATP  A 602 (-3.9A)
3BG  A 601 ( 3.9A)
ATP  A 602 (-4.6A)
 0.47A 2x1lA-4qreA:
42.8		 2x1lA-4qreA:
43.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X1L_B_ADNB601_1
(METHIONYL-TRNA
SYNTHETASE)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		5 / 12 HIS A  20
GLY A  22
HIS A  23
ILE A 273
HIS A 299
 ATP  A 602 (-4.5A)
ATP  A 602 (-3.6A)
ATP  A 602 (-3.9A)
3BG  A 601 ( 3.9A)
ATP  A 602 (-4.6A)
 0.44A 2x1lB-4qreA:
45.5		 2x1lB-4qreA:
43.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		5 / 11 HIS A  20
GLY A  22
HIS A  23
ILE A 273
HIS A 299
 ATP  A 602 (-4.5A)
ATP  A 602 (-3.6A)
ATP  A 602 (-3.9A)
3BG  A 601 ( 3.9A)
ATP  A 602 (-4.6A)
 0.49A 2x1lC-4qreA:
45.2		 2x1lC-4qreA:
43.06
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.
5HWA_A_GCSA302_1
(CHITOSANASE)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		4 / 7 THR A  96
ASP A  51
ASP A 239
GLY A  54
 None
3BG  A 601 (-2.8A)
3BG  A 601 (-4.3A)
3BG  A 601 (-3.5A)
 0.94A 5hwaA-4qreA:
undetectable		 5hwaA-4qreA:
18.46
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.
5IGY_A_ERYA403_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4qre METHIONYL-TRNA
SYNTHETASE
(Staphylococcus
aureus) 		4 / 6 TYR A 127
ARG A 217
TYR A 235
TYR A  14
 None
None
3BG  A 601 (-4.7A)
3BG  A 601 (-3.5A)
 1.40A 5igyA-4qreA:
undetectable		 5igyA-4qreA:
21.17