SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3jwi'

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.
3QEL_B_QELB1_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
EPSILON-2)		 3jwi METHYLTRANSFERASE
TYPE 12
(Ruminiclostridiu
m
thermocellum) 		5 / 11 THR A  57
LEU A  43
ALA A 105
PHE A 100
THR A  20
 None
 1.48A 3qelA-3jwiA:
4.1
3qelB-3jwiA:
4.7		 3qelA-3jwiA:
19.84
3qelB-3jwiA:
20.23
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 3jwi METHYLTRANSFERASE
TYPE 12
(Ruminiclostridiu
m
thermocellum) 		5 / 11 ASP A  35
GLY A  37
GLY A  39
ILE A 109
ASP A  60
 None
 0.82A 4dcmA-3jwiA:
11.7		 4dcmA-3jwiA:
21.29
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.
4EIL_E_FOLE703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3jwi METHYLTRANSFERASE
TYPE 12
(Ruminiclostridiu
m
thermocellum) 		5 / 11 VAL A  28
ALA A 105
MET A 204
PHE A 188
VAL A  24
 None
 1.44A 4eilE-3jwiA:
2.5		 4eilE-3jwiA:
17.08
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.
5DPD_B_SAMB601_0
(PROTEIN LYSINE
METHYLTRANSFERASE 1)		 3jwi METHYLTRANSFERASE
TYPE 12
(Ruminiclostridiu
m
thermocellum) 		5 / 12 GLY A  37
ASP A  60
SER A  62
SER A  91
VAL A 111
 None
 1.06A 5dpdB-3jwiA:
14.5		 5dpdB-3jwiA:
17.21
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.
5DPD_B_SAMB601_0
(PROTEIN LYSINE
METHYLTRANSFERASE 1)		 3jwi METHYLTRANSFERASE
TYPE 12
(Ruminiclostridiu
m
thermocellum) 		5 / 12 GLY A  37
ASP A  60
SER A  62
SER A  92
VAL A 111
 None
 0.73A 5dpdB-3jwiA:
14.5		 5dpdB-3jwiA:
17.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5WY0_A_SAMA800_0
(SMALL RNA
2'-O-METHYLTRANSFERA
SE)		 3jwi METHYLTRANSFERASE
TYPE 12
(Ruminiclostridiu
m
thermocellum) 		6 / 12 GLY A  37
GLY A  39
ASP A  60
ILE A 109
HIS A 114
LEU A 115
 None
 0.46A 5wy0A-3jwiA:
24.3		 5wy0A-3jwiA:
36.25