SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qxi'

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.
3K13_C_THHC643_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		5 / 12 GLU A 134
GLY A 145
VAL A  82
GLY A  70
PHE A 130
 None
 1.18A 3k13C-3qxiA:
2.1		 3k13C-3qxiA:
22.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R9S_C_BEZC264_0
(CARNITINYL-COA
DEHYDRATASE)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		4 / 6 ALA A 103
ILE A  59
LEU A 189
ALA A 183
 None
 0.90A 3r9sC-3qxiA:
28.7		 3r9sC-3qxiA:
48.03
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.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		4 / 5 LEU A 161
LEU A 149
MET A 178
THR A 113
 None
 1.11A 4do3A-3qxiA:
undetectable		 4do3A-3qxiA:
18.29
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.
4DU2_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		4 / 7 ALA A 124
PHE A 130
ALA A 108
ALA A 102
 None
 0.80A 4du2A-3qxiA:
undetectable		 4du2A-3qxiA:
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.
4DU2_B_LDPB501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		4 / 7 ALA A 124
PHE A 130
ALA A 108
ALA A 102
 None
 0.80A 4du2B-3qxiA:
undetectable		 4du2B-3qxiA:
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.
5IL1_A_SAMA601_0
(METTL3)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		5 / 12 PRO A  96
LEU A 100
GLU A  93
PHE A  91
GLY A  90
 None
 1.19A 5il1A-3qxiA:
undetectable		 5il1A-3qxiA:
23.88
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.
5K7U_A_SAMA601_0
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		5 / 12 PRO A  96
LEU A 100
GLU A  93
PHE A  91
GLY A  90
 None
 1.20A 5k7uA-3qxiA:
undetectable		 5k7uA-3qxiA:
24.21
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.
5OM2_B_DXTB501_1
(ALPHA-1-ANTICHYMOTRY
PSIN)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		5 / 9 VAL A  12
LEU A  42
ALA A  43
VAL A  34
ILE A  25
 None
 1.20A 5om2A-3qxiA:
undetectable
5om2B-3qxiA:
undetectable		 5om2A-3qxiA:
13.43
5om2B-3qxiA:
10.20
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.
6EFN_A_SAMA501_0
(SPORULATION KILLING
FACTOR MATURATION
PROTEIN SKFB)		 3qxi ENOYL-COA HYDRATASE
ECHA1
(Mycobacterium
marinum) 		5 / 11 PHE A 130
SER A 128
ALA A 124
THR A  61
LEU A  60
 None
 1.41A 6efnA-3qxiA:
undetectable		 6efnA-3qxiA:
22.46