SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2e21'

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.
1IGX_A_EPAA700_2
(PROSTAGLANDIN
ENDOPEROXIDE H
SYNTHASE-1)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 8 VAL A  35
VAL A  39
ILE A   8
LEU A 169
 None
 0.89A 1igxA-2e21A:
undetectable		 1igxA-2e21A:
20.58
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.
1TLM_A_MILA128_1
(TRANSTHYRETIN)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		3 / 3 LEU A 152
LEU A 155
SER A 142
 None
 0.68A 1tlmA-2e21A:
undetectable		 1tlmA-2e21A:
17.04
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.
2Y01_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 12 LEU A 169
VAL A 172
THR A  41
ASP A  42
TYR A 180
 None
 1.46A 2y01B-2e21A:
undetectable		 2y01B-2e21A:
22.62
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.
3GYQ_B_SAMB270_0
(RRNA
(ADENOSINE-2'-O-)-ME
THYLTRANSFERASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 11 LEU A  58
ALA A  30
ILE A  29
LEU A  40
VAL A  38
 None
ANP  A 500 (-3.0A)
None
None
None
 1.10A 3gyqB-2e21A:
undetectable		 3gyqB-2e21A:
20.77
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.
3N8W_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 12 VAL A 227
LEU A 230
GLY A 154
SER A 142
LEU A 138
 None
 1.02A 3n8wA-2e21A:
undetectable		 3n8wA-2e21A:
21.47
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.
3TPX_E_ACTE204_0
(E3 UBIQUITIN-PROTEIN
LIGASE MDM2)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		3 / 3 LYS A 262
PRO A 263
LEU A 266
 None
 0.66A 3tpxE-2e21A:
undetectable		 3tpxE-2e21A:
13.38
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.
4F8Y_D_VK3D202_1
(NADPH QUINONE
OXIDOREDUCTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 5 ARG A 231
TYR A 171
TYR A 170
LEU A  14
 None
 1.31A 4f8yC-2e21A:
undetectable
4f8yD-2e21A:
0.0		 4f8yC-2e21A:
19.57
4f8yD-2e21A:
19.57
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.
5A06_A_SORA1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 7 ARG A 113
PHE A 158
ASP A 137
TYR A 114
 ANP  A 500 (-3.0A)
None
None
None
 1.42A 5a06A-2e21A:
undetectable		 5a06A-2e21A:
21.04
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.
5A06_C_SORC1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 7 ARG A 113
PHE A 158
ASP A 137
TYR A 114
 ANP  A 500 (-3.0A)
None
None
None
 1.41A 5a06C-2e21A:
2.2		 5a06C-2e21A:
21.04
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.
5A06_D_SORD1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 7 ARG A 113
PHE A 158
ASP A 137
TYR A 114
 ANP  A 500 (-3.0A)
None
None
None
 1.43A 5a06D-2e21A:
undetectable		 5a06D-2e21A:
21.04
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.
5A06_E_SORE1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 7 ARG A 113
PHE A 158
ASP A 137
TYR A 114
 ANP  A 500 (-3.0A)
None
None
None
 1.43A 5a06E-2e21A:
undetectable		 5a06E-2e21A:
21.04
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.
5A06_F_SORF1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		4 / 7 ARG A 113
PHE A 158
ASP A 137
TYR A 114
 ANP  A 500 (-3.0A)
None
None
None
 1.41A 5a06F-2e21A:
undetectable		 5a06F-2e21A:
21.04
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.
5CYM_A_T27A601_1
(HIV-1 REVERSE
TRANSCRIPTASE, P66
SUBUNIT)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 12 LEU A  40
VAL A  11
VAL A 172
PHE A  51
LEU A  44
 None
 1.44A 5cymA-2e21A:
undetectable		 5cymA-2e21A:
20.57
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.
5CYQ_A_T27A601_1
(HIV-1 REVERSE
TRANSCRIPTASE, P66
SUBUNIT)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 12 LEU A  40
VAL A  11
VAL A 172
PHE A  51
LEU A  44
 None
 1.41A 5cyqA-2e21A:
1.3		 5cyqA-2e21A:
20.57
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.
6BXN_A_SAMA901_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 12 LEU A 112
HIS A  63
VAL A 164
ARG A 113
ILE A 129
 None
ANP  A 500 ( 4.5A)
None
ANP  A 500 (-3.0A)
None
 1.25A 6bxnA-2e21A:
3.1		 6bxnA-2e21A:
23.01
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.
6ELI_A_T27A701_1
(REVERSE
TRANSCRIPTASE)		 2e21 TRNA(ILE)-LYSIDINE
SYNTHASE
(Aquifex
aeolicus) 		5 / 12 LEU A  40
VAL A  11
VAL A 172
PHE A  51
LEU A  44
 None
 1.40A 6eliA-2e21A:
undetectable		 6eliA-2e21A:
14.05