SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3l3s'

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.
1QKU_A_ESTA600_1
(ESTRADIOL RECEPTOR)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 10 GLU A  12
LEU A  10
ARG A  45
ILE A  36
LEU A 123
 None
 1.32A 1qkuA-3l3sA:
undetectable		 1qkuA-3l3sA:
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.
1QKU_B_ESTB600_1
(ESTRADIOL RECEPTOR)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 10 GLU A  12
LEU A  10
ARG A  45
ILE A  36
LEU A 123
 None
 1.33A 1qkuB-3l3sA:
undetectable		 1qkuB-3l3sA:
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.
1QKU_C_ESTC600_1
(ESTRADIOL RECEPTOR)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 10 GLU A  12
LEU A  10
ARG A  45
ILE A  36
LEU A 123
 None
 1.32A 1qkuC-3l3sA:
undetectable		 1qkuC-3l3sA:
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.
2B25_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 12 GLY A 114
GLY A  59
ARG A 137
ASP A 178
ILE A 189
 None
 1.07A 2b25B-3l3sA:
undetectable		 2b25B-3l3sA:
21.74
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.
3CR4_X_PNTX101_0
(PROTEIN S100-B)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		3 / 3 CYH A  65
HIS A  29
PHE A  64
 None
 1.21A 3cr4X-3l3sA:
undetectable		 3cr4X-3l3sA:
15.21
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.
3NVK_I_SAMI228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 12 GLY A 114
ALA A 135
ILE A 115
ALA A 116
VAL A 112
 None
 1.10A 3nvkI-3l3sA:
undetectable		 3nvkI-3l3sA:
19.05
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 10 ALA A  42
LEU A  21
LEU A  23
ILE A  57
ALA A 110
 None
 1.43A 3r9cA-3l3sA:
undetectable		 3r9cA-3l3sA:
22.09
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.
4OK1_A_198A1001_2
(ANDROGEN RECEPTOR)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		4 / 8 LEU A  10
MET A  98
LEU A 123
ILE A  63
 None
 1.07A 4ok1A-3l3sA:
undetectable		 4ok1A-3l3sA:
18.49
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.
5HPU_C_IPHC101_0
(INSULIN, CHAIN A
INSULIN, CHAIN B)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		4 / 6 CYH A  65
LEU A 123
HIS A  58
LEU A  23
 None
 1.16A 5hpuC-3l3sA:
undetectable
5hpuD-3l3sA:
undetectable		 5hpuC-3l3sA:
9.63
5hpuD-3l3sA:
17.48
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.
5X23_A_LSNA502_1
(CYTOCHROME P450 2C9)		 3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Ruegeria
pomeroyi) 		5 / 12 LEU A  23
VAL A 112
GLY A 120
ALA A 119
LEU A  97
 None
 1.17A 5x23A-3l3sA:
undetectable		 5x23A-3l3sA:
20.37