SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4r1n'

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.
1CET_A_CLQA1001_0
(PROTEIN (L-LACTATE
DEHYDROGENASE))		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		5 / 9 GLY A   8
ASP A  31
ILE A  32
ALA A  88
ILE A  89
 None
 1.19A 1cetA-4r1nA:
11.2		 1cetA-4r1nA:
21.69
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.
1O86_A_LPRA702_2
(ANGIOTENSIN
CONVERTING ENZYME)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		4 / 4 SER A 169
VAL A 177
PHE A 139
VAL A  85
 None
 1.48A 1o86A-4r1nA:
undetectable		 1o86A-4r1nA:
18.41
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.
1YC2_A_NCAA506_0
(NAD-DEPENDENT
DEACETYLASE 2)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		4 / 6 ALA A 256
SER A 257
ASN A 196
ILE A 195
 None
 0.95A 1yc2A-4r1nA:
5.8		 1yc2A-4r1nA:
23.76
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.
2I30_A_SALA1200_1
(SERUM ALBUMIN)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		4 / 4 LEU A 260
ILE A 192
ILE A 241
ALA A 240
 None
 0.70A 2i30A-4r1nA:
undetectable		 2i30A-4r1nA:
19.31
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.
2V0Z_O_C41O1327_1
(RENIN)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		5 / 12 VAL A   6
GLY A  10
ALA A  21
VAL A  29
GLY A  13
 None
 0.89A 2v0zO-4r1nA:
undetectable		 2v0zO-4r1nA:
22.10
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.
3FRE_X_TOPX300_1
(DIHYDROFOLATE
REDUCTASE)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		5 / 9 LEU A  83
VAL A  85
SER A 171
ILE A 172
PHE A 139
 None
 1.28A 3freX-4r1nA:
undetectable		 3freX-4r1nA:
20.07
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.
3OU6_C_SAMC300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		3 / 3 TYR A 263
GLY A 276
ASP A 231
 None
 0.65A 3ou6C-4r1nA:
5.8		 3ou6C-4r1nA:
20.83
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.
4ZJ8_A_SUVA2001_2
(HUMAN OX1R FUSION
PROTEIN TO P.ABYSII
GLYCOGEN SYNTHASE)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		4 / 6 ILE A  89
HIS A 138
ILE A  16
VAL A   6
 None
 1.00A 4zj8A-4r1nA:
4.9		 4zj8A-4r1nA:
19.53
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.
5C0O_F_SAMF301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		5 / 12 GLY A  15
GLY A  13
GLY A  10
ALA A  22
LEU A  48
 None
 0.99A 5c0oF-4r1nA:
7.5		 5c0oF-4r1nA:
undetectable
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.
5GSN_A_MMZA503_1
(FLAVIN-CONTAINING
MONOOXYGENASE)		 4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE
(Clostridium
butyricum) 		3 / 3 ASN A 188
SER A 117
SER A 118
 None
 0.55A 5gsnA-4r1nA:
3.7		 5gsnA-4r1nA:
21.90