SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5gwt'

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.
1MRL_A_DOLA300_1
(STREPTOGRAMIN A
ACETYLTRANSFERASE)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		5 / 11 ILE A  56
LEU A  81
LEU A  71
ASN A 134
VAL A 175
 None
 1.43A 1mrlA-5gwtA:
undetectable
1mrlB-5gwtA:
undetectable		 1mrlA-5gwtA:
20.96
1mrlB-5gwtA:
20.96
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.
2DRD_A_MIYA2001_1
(ACRB)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		5 / 9 GLY A  11
ILE A  21
ALA A  33
VAL A  31
PHE A  24
 NAD  A 301 (-3.4A)
None
None
None
None
 1.22A 2drdA-5gwtA:
undetectable		 2drdA-5gwtA:
14.62
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.
2KUH_A_HLTA150_1
(CALMODULIN)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		4 / 6 LEU A  81
MET A   8
LEU A  34
GLU A 118
 None
 1.29A 2kuhA-5gwtA:
undetectable		 2kuhA-5gwtA:
14.88
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.
2XZ5_C_ACHC1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		4 / 8 ILE A 178
VAL A 237
TYR A 222
CYH A 219
 None
 1.30A 2xz5A-5gwtA:
undetectable
2xz5C-5gwtA:
undetectable		 2xz5A-5gwtA:
21.83
2xz5C-5gwtA:
21.83
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.
2ZW9_B_SAMB801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		4 / 8 ILE A 135
ASN A 108
SER A 153
SER A 137
 NAD  A 301 (-4.3A)
None
None
SIN  A 302 ( 2.4A)
 1.14A 2zw9B-5gwtA:
5.5		 2zw9B-5gwtA:
18.05
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.
3F78_A_ICFA1_1
(INTEGRIN ALPHA-L)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		5 / 9 ILE A   6
ILE A  32
LYS A  52
LEU A  71
GLU A  74
 None
 1.14A 3f78A-5gwtA:
3.6		 3f78A-5gwtA:
21.00
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.
3F78_B_ICFB2_1
(INTEGRIN ALPHA-L)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		5 / 9 ILE A   6
ILE A  32
LYS A  52
LEU A  71
GLU A  74
 None
 1.08A 3f78B-5gwtA:
3.1		 3f78B-5gwtA:
21.00
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.
3LN1_C_CELC682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		4 / 7 ARG A 117
SER A  61
LEU A  81
ILE A  56
 None
 0.95A 3ln1C-5gwtA:
undetectable		 3ln1C-5gwtA:
19.06
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.
4XI3_C_29SC601_2
(ESTROGEN RECEPTOR)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		4 / 6 LEU A  67
ASP A  72
GLU A  74
ILE A   9
 None
 1.06A 4xi3C-5gwtA:
undetectable		 4xi3C-5gwtA:
23.03
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.
5M0O_A_EPAA502_1
(TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE)		 5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE
(Bacillus
thuringiensis) 		5 / 10 LEU A  67
ILE A  64
PHE A  68
ALA A 111
VAL A 119
 None
 1.36A 5m0oA-5gwtA:
undetectable		 5m0oA-5gwtA:
21.65