SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5din'

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.
1EKJ_A_ACTA3001_0
(BETA-CARBONIC
ANHYDRASE)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		5 / 8 CYH A  95
ASP A 103
HIS A 113
CYH A 118
GLY A 120
 ZN  A 204 (-2.3A)
None
ZN  A 204 (-3.3A)
ZN  A 204 (-2.2A)
None
 0.80A 1ekjA-5dinA:
undetectable
1ekjB-5dinA:
undetectable		 1ekjA-5dinA:
20.62
1ekjB-5dinA:
20.62
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.
1EKJ_A_ACTA3003_0
(BETA-CARBONIC
ANHYDRASE)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 8 CYH A  95
ASP A 103
HIS A 113
CYH A 118
 ZN  A 204 (-2.3A)
None
ZN  A 204 (-3.3A)
ZN  A 204 (-2.2A)
 0.69A 1ekjA-5dinA:
undetectable
1ekjB-5dinA:
undetectable		 1ekjA-5dinA:
20.62
1ekjB-5dinA:
20.62
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.
1EKJ_E_ACTE3005_0
(BETA-CARBONIC
ANHYDRASE)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 7 CYH A  95
ASP A 103
HIS A 113
GLY A 120
 ZN  A 204 (-2.3A)
None
ZN  A 204 (-3.3A)
None
 0.76A 1ekjE-5dinA:
undetectable
1ekjF-5dinA:
undetectable		 1ekjE-5dinA:
20.62
1ekjF-5dinA:
20.62
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.
1EKJ_G_ACTG3002_0
(BETA-CARBONIC
ANHYDRASE)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		5 / 8 CYH A  95
ASP A 103
HIS A 113
CYH A 118
GLY A 120
 ZN  A 204 (-2.3A)
None
ZN  A 204 (-3.3A)
ZN  A 204 (-2.2A)
None
 0.82A 1ekjG-5dinA:
undetectable
1ekjH-5dinA:
undetectable		 1ekjG-5dinA:
20.62
1ekjH-5dinA:
20.62
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.
1EKJ_H_ACTH3006_0
(BETA-CARBONIC
ANHYDRASE)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 6 ASP A 103
VAL A 100
HIS A 113
CYH A 118
 None
None
ZN  A 204 (-3.3A)
ZN  A 204 (-2.2A)
 1.21A 1ekjG-5dinA:
undetectable
1ekjH-5dinA:
undetectable		 1ekjG-5dinA:
20.62
1ekjH-5dinA:
20.62
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.
1EKJ_H_ACTH3006_0
(BETA-CARBONIC
ANHYDRASE)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 6 CYH A  95
ASP A 103
HIS A 113
CYH A 118
 ZN  A 204 (-2.3A)
None
ZN  A 204 (-3.3A)
ZN  A 204 (-2.2A)
 0.74A 1ekjG-5dinA:
undetectable
1ekjH-5dinA:
undetectable		 1ekjG-5dinA:
20.62
1ekjH-5dinA:
20.62
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)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		3 / 3 CYH A  31
HIS A  32
PHE A  50
 ZN  A 201 (-2.3A)
None
None
 1.14A 3cr4X-5dinA:
undetectable		 3cr4X-5dinA:
17.19
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.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 6 VAL A  30
LEU A  88
LEU A  91
ARG A 107
 None
 1.02A 6e43A-5dinA:
undetectable		 6e43A-5dinA:
17.77
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.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 6 VAL A  30
LEU A  88
LEU A  91
ARG A 107
 None
 1.00A 6e43B-5dinA:
undetectable		 6e43B-5dinA:
17.77
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.
6E43_C_BEZC502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5din LIGAND OF NUMB
PROTEIN X 2
(Homo
sapiens) 		4 / 6 VAL A  30
LEU A  88
LEU A  91
ARG A 107
 None
 1.01A 6e43C-5dinA:
undetectable		 6e43C-5dinA:
17.77