SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ne2'

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.
2HA4_B_ACTB601_0
(ACETYLCHOLINESTERASE)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		5 / 7 GLY A  23
GLY A  25
ALA A  27
ALA A  26
PHE A 119
 None
 1.46A 2ha4B-3ne2A:
undetectable		 2ha4B-3ne2A:
18.78
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.
2NNH_B_9CRB501_1
(CYTOCHROME P450 2C8)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		5 / 9 ARG A  95
GLY A  94
SER A  92
VAL A 167
ILE A 162
 None
 1.20A 2nnhB-3ne2A:
undetectable		 2nnhB-3ne2A:
20.08
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.
3EKP_C_478C200_2
(PROTEASE)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		5 / 10 GLY A 232
ALA A 233
VAL A  86
ILE A 162
ILE A 187
 None
 0.84A 3ekpD-3ne2A:
undetectable		 3ekpD-3ne2A:
20.24
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.
3NXU_A_RITA600_1
(CYTOCHROME P450 3A4)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		5 / 12 LEU A 158
PHE A 139
ILE A  67
ALA A  58
GLY A 192
 None
 1.02A 3nxuA-3ne2A:
2.6		 3nxuA-3ne2A:
20.67
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.
5ECN_D_LEUD602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		4 / 8 ILE A 180
ALA A  66
VAL A  70
VAL A 184
 None
 0.85A 5ecnD-3ne2A:
undetectable		 5ecnD-3ne2A:
17.40
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.
5MLM_A_STRA401_1
(-)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		5 / 12 ILE A 105
ALA A 233
VAL A  86
ILE A  88
PRO A 201
 None
 1.42A 5mlmA-3ne2A:
undetectable		 5mlmA-3ne2A:
19.34
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.
5VCE_A_RITA602_1
(CYTOCHROME P450 3A4)		 3ne2 PROBABLE AQUAPORIN
AQPM
(Archaeoglobus
fulgidus) 		5 / 12 PHE A 109
ILE A 105
ILE A  88
ALA A 233
THR A 155
 None
 1.08A 5vceA-3ne2A:
undetectable		 5vceA-3ne2A:
20.58