SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ess'

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.
2FN1_A_SALA506_1
(SALICYLATE
SYNTHETASE, IRP9)		 4ess OR187
(synthetic
construct) 		5 / 11 THR A  63
HIS A  75
LEU A  38
GLY A  66
GLU A  48
 None
 1.33A 2fn1A-4essA:
undetectable		 2fn1A-4essA:
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.
2IDW_B_017B401_1
(PROTEASE)		 4ess OR187
(synthetic
construct) 		5 / 11 ALA A  18
VAL A  62
GLY A 104
ALA A  96
ILE A  74
 None
 1.05A 2idwA-4essA:
undetectable		 2idwA-4essA:
20.37
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.
3B0W_A_DGXA1_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 4ess OR187
(synthetic
construct) 		5 / 12 LEU A 103
LEU A 105
CYH A  49
ALA A  60
ALA A  18
 None
 1.25A 3b0wA-4essA:
undetectable		 3b0wA-4essA:
18.94
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.
3EKT_B_017B200_2
(PROTEASE)		 4ess OR187
(synthetic
construct) 		5 / 9 ALA A  18
VAL A  62
GLY A 104
ALA A  96
ILE A  74
 None
 0.97A 3ektB-4essA:
undetectable		 3ektB-4essA:
19.76
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 4ess OR187
(synthetic
construct) 		5 / 10 ALA A 152
ALA A 115
VAL A  89
VAL A 128
THR A  93
 None
 1.31A 3r9cA-4essA:
undetectable		 3r9cA-4essA:
20.28
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.
4LJ0_A_ACTA505_0
(NAB2)		 4ess OR187
(synthetic
construct) 		3 / 3 LEU A  97
LYS A  94
THR A  93
 None
 0.53A 4lj0A-4essA:
undetectable		 4lj0A-4essA:
17.20
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.
5KBW_A_RBFA201_1
(RIBOFLAVIN
TRANSPORTER RIBU)		 4ess OR187
(synthetic
construct) 		5 / 12 LYS A  54
ASP A  81
GLY A  80
ASN A  24
ALA A  92
 None
 1.34A 5kbwA-4essA:
undetectable		 5kbwA-4essA:
22.51