SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2ae8'

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.
1EE2_A_CHDA1150_0
(ALCOHOL
DEHYDROGENASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 11 LEU A  76
LEU A  14
LEU A  49
VAL A 139
ILE A  68
 None
 1.15A 1ee2A-2ae8A:
undetectable		 1ee2A-2ae8A:
18.60
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.
1EE2_B_CHDB1250_1
(ALCOHOL
DEHYDROGENASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 11 LEU A  76
LEU A  14
LEU A  49
VAL A 139
ILE A  68
 None
 1.20A 1ee2B-2ae8A:
undetectable		 1ee2B-2ae8A:
18.60
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.
1KYV_A_RBFA501_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 GLY A  30
LEU A  34
ILE A  68
LEU A  14
HIS A  63
 None
 1.25A 1kyvA-2ae8A:
undetectable
1kyvE-2ae8A:
undetectable		 1kyvA-2ae8A:
22.17
1kyvE-2ae8A:
22.17
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.
1KYV_C_RBFC503_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 LEU A  14
HIS A  63
GLY A  30
LEU A  34
ILE A  68
 None
 1.27A 1kyvB-2ae8A:
undetectable
1kyvC-2ae8A:
undetectable		 1kyvB-2ae8A:
22.17
1kyvC-2ae8A:
22.17
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.
1KYV_D_RBFD504_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 LEU A  14
HIS A  63
GLY A  30
LEU A  34
ILE A  68
 None
 1.24A 1kyvC-2ae8A:
undetectable
1kyvD-2ae8A:
undetectable		 1kyvC-2ae8A:
22.17
1kyvD-2ae8A:
22.17
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.
1KYV_E_RBFE505_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 LEU A  14
HIS A  63
GLY A  30
LEU A  34
ILE A  68
 None
 1.25A 1kyvD-2ae8A:
undetectable
1kyvE-2ae8A:
undetectable		 1kyvD-2ae8A:
22.17
1kyvE-2ae8A:
22.17
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.
1LQT_A_ACTA1871_0
(FPRA)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		4 / 7 PHE A 135
PHE A 165
PHE A 168
SER A 169
 None
 1.04A 1lqtA-2ae8A:
undetectable		 1lqtA-2ae8A:
20.09
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.
1LQU_A_ACTA1428_0
(FPRA)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		4 / 7 PHE A 135
PHE A 165
PHE A 168
SER A 169
 None
 1.03A 1lquA-2ae8A:
undetectable		 1lquA-2ae8A:
20.09
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.
1NT2_A_SAMA301_1
(FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		3 / 3 THR A  42
GLU A 162
ASP A  97
 None
MG  A1001 ( 2.6A)
None
 0.81A 1nt2A-2ae8A:
undetectable		 1nt2A-2ae8A:
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.
1RB3_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 ILE A  16
SER A  45
LEU A  76
ILE A  18
THR A  29
 None
 0.89A 1rb3B-2ae8A:
undetectable		 1rb3B-2ae8A:
20.52
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.
1Y0X_X_T44X500_1
(THYROID HORMONE
RECEPTOR BETA-1)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 ILE A  72
LEU A 176
ILE A  80
PHE A  41
PHE A 168
 None
 1.43A 1y0xX-2ae8A:
undetectable		 1y0xX-2ae8A:
25.34
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.
3KO0_B_TFPB201_1
(PROTEIN S100-A4)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		4 / 8 GLY A  73
ILE A  51
PHE A 127
PHE A 135
 None
 0.84A 3ko0B-2ae8A:
undetectable
3ko0J-2ae8A:
1.4		 3ko0B-2ae8A:
14.68
3ko0J-2ae8A:
14.68
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.
3KO0_K_TFPK201_1
(PROTEIN S100-A4)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		4 / 8 GLY A  73
ILE A  51
PHE A 127
PHE A 135
 None
 0.95A 3ko0K-2ae8A:
1.4
3ko0S-2ae8A:
1.3		 3ko0K-2ae8A:
14.68
3ko0S-2ae8A:
14.68
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.
3LM8_D_VIBD223_1
(THIAMINE
PYROPHOSPHOKINASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		4 / 8 ASP A  20
LEU A  76
LEU A  47
SER A  17
 None
 1.01A 3lm8B-2ae8A:
undetectable
3lm8D-2ae8A:
undetectable		 3lm8B-2ae8A:
19.11
3lm8D-2ae8A:
19.11
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.
3O02_B_JN3B1_1
(CELL INVASION
PROTEIN SIPD)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 10 ILE A  80
ALA A 175
LEU A  76
LEU A 172
VAL A 105
 None
 1.20A 3o02A-2ae8A:
undetectable
3o02B-2ae8A:
undetectable		 3o02A-2ae8A:
22.43
3o02B-2ae8A:
22.43
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.
5CSW_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		3 / 3 PHE A 135
ILE A  68
ASP A  60
 None
 0.66A 5cswA-2ae8A:
undetectable		 5cswA-2ae8A:
22.58
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.
5CSW_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		3 / 3 PHE A 135
ILE A  68
ASP A  60
 None
 0.55A 5cswB-2ae8A:
undetectable		 5cswB-2ae8A:
22.58
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.
5TIW_B_OAQB302_0
(SULFOTRANSFERASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 LEU A 131
ILE A 149
PHE A 165
LEU A 145
THR A 147
 None
 1.31A 5tiwB-2ae8A:
undetectable		 5tiwB-2ae8A:
20.97
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.
6AYB_A_KKKA508_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE
(Staphylococcus
aureus) 		5 / 12 PHE A 135
PHE A 168
ALA A  53
ILE A  18
LEU A  38
 None
 1.08A 6aybA-2ae8A:
undetectable		 6aybA-2ae8A:
18.88