SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4jyl'

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.
1EIZ_A_SAMA301_0
(FTSJ)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 12 ALA A 111
GLY A 140
GLY A 105
GLY A 107
LEU A 156
 None
None
CL  A 301 (-3.6A)
None
None
 0.96A 1eizA-4jylA:
undetectable		 1eizA-4jylA:
19.62
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.
1EJ0_A_SAMA301_0
(FTSJ)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 12 ALA A 111
GLY A 140
GLY A 105
GLY A 107
LEU A 156
 None
None
CL  A 301 (-3.6A)
None
None
 0.96A 1ej0A-4jylA:
undetectable		 1ej0A-4jylA:
19.62
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.
2BR4_D_SAMD301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		3 / 3 LYS A 194
ASP A 180
ASP A 190
 None
 0.87A 2br4D-4jylA:
undetectable		 2br4D-4jylA:
24.40
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.
2F7A_B_BEZB1002_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 9 LEU A  27
LEU A  30
ILE A  25
PHE A  77
LEU A  66
 None
 1.21A 2f7aB-4jylA:
undetectable		 2f7aB-4jylA:
20.88
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.
2JFA_B_RALB600_1
(ESTROGEN RECEPTOR)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		6 / 12 ALA A 168
GLU A 167
LEU A 171
LEU A 163
GLY A 105
LEU A 108
 None
None
None
None
CL  A 301 (-3.6A)
None
 1.35A 2jfaB-4jylA:
undetectable		 2jfaB-4jylA:
23.55
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.
2OPX_A_DXCA1003_0
(ALDEHYDE
DEHYDROGENASE A)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		4 / 5 ILE A  84
LEU A  33
ALA A  85
PHE A  57
 None
 0.97A 2opxA-4jylA:
undetectable		 2opxA-4jylA:
20.47
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.
2ZIF_A_SAMA298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 12 ALA A  61
SER A 130
PRO A 128
GLY A 140
GLU A 109
 CL  A 301 (-3.8A)
None
None
None
None
 1.13A 2zifA-4jylA:
undetectable		 2zifA-4jylA:
21.36
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.
3A50_D_VD3D2001_1
(VITAMIN D
HYDROXYLASE)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 12 MET A  65
LEU A  30
ILE A  25
ALA A  24
LEU A   2
 None
 1.04A 3a50D-4jylA:
undetectable		 3a50D-4jylA:
20.62
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.
3TEG_A_DAHA416_1
(PHENYLALANYL-TRNA
SYNTHETASE,
MITOCHONDRIAL)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 12 GLN A 127
GLU A 129
GLY A 107
ALA A  61
GLY A 105
 None
CL  A 301 ( 4.2A)
None
CL  A 301 (-3.8A)
CL  A 301 (-3.6A)
 0.98A 3tegA-4jylA:
undetectable		 3tegA-4jylA:
19.19
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.
3VRM_A_VD3A502_1
(VITAMIN D(3)
25-HYDROXYLASE)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		5 / 12 MET A  65
LEU A  30
ILE A  25
ALA A  24
LEU A   2
 None
 0.99A 3vrmA-4jylA:
undetectable		 3vrmA-4jylA:
20.54
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.
5N5D_A_SAMA306_1
(METHYLTRANSFERASE)		 4jyl ENOYL-COA HYDRATASE
(Thermoplasma
volcanium) 		4 / 7 ILE A   5
GLU A   4
ASP A  32
ASN A  -5
 None
 0.86A 5n5dA-4jylA:
undetectable		 5n5dA-4jylA:
23.37