SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4j2k'

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.
1JG4_A_SAMA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		4 / 8 GLU A 112
SER A  91
ILE A 106
LEU A  93
 None
 0.90A 1jg4A-4j2kA:
undetectable		 1jg4A-4j2kA:
24.58
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.
1M8E_B_H4BB903_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		3 / 3 ARG A  64
ILE A  58
TRP A  60
 None
 1.17A 1m8eB-4j2kA:
undetectable		 1m8eB-4j2kA:
20.68
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.
3E68_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		3 / 3 ARG A  64
ILE A  58
TRP A  60
 None
 1.18A 3e68A-4j2kA:
undetectable		 3e68A-4j2kA:
20.57
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.
3E6T_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		3 / 3 ARG A  64
ILE A  58
TRP A  60
 None
 1.20A 3e6tB-4j2kA:
undetectable		 3e6tB-4j2kA:
20.57
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.
3LN1_C_CELC682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		4 / 7 LEU A   3
ARG A 168
ILE A  19
PHE A 169
 None
GOL  A 202 (-3.7A)
None
None
 1.06A 3ln1C-4j2kA:
undetectable		 3ln1C-4j2kA:
13.87
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.
3LN1_D_CELD682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		4 / 5 LEU A   3
ARG A 168
ILE A  19
PHE A 169
 None
GOL  A 202 (-3.7A)
None
None
 1.06A 3ln1D-4j2kA:
undetectable		 3ln1D-4j2kA:
13.87
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.
4YIA_B_IMNB401_2
(THYROXINE-BINDING
GLOBULIN)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		3 / 3 LEU A  23
ARG A  24
ARG A 168
 None
None
GOL  A 202 (-3.7A)
 0.81A 4yiaB-4j2kA:
undetectable		 4yiaB-4j2kA:
11.05
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.
5X23_A_LSNA504_1
(CYTOCHROME P450 2C9)		 4j2k TRYPSIN INHIBITOR
(Enterolobium
contortisiliquum) 		4 / 8 PHE A  78
ILE A 106
THR A  35
PRO A  41
 None
 1.07A 5x23A-4j2kA:
undetectable		 5x23A-4j2kA:
17.72