SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4iqe'

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.
1HBP_A_RTLA184_0
(RETINOL BINDING
PROTEIN)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 11 LEU A  14
PHE A  97
ALA A  75
VAL A  82
GLN A  11
 None
 1.20A 1hbpA-4iqeA:
undetectable		 1hbpA-4iqeA:
20.47
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.
1J7K_A_ACTA701_0
(HOLLIDAY JUNCTION
DNA HELICASE RUVB)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		4 / 4 GLY A 170
LEU A 171
GLY A 167
ARG A 166
 None
 1.24A 1j7kA-4iqeA:
undetectable		 1j7kA-4iqeA:
22.13
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.
2QEU_B_ACTB141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		3 / 3 PRO A 240
ASN A 214
ARG A 162
 None
 1.01A 2qeuB-4iqeA:
undetectable		 2qeuB-4iqeA:
21.26
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.
3N8Y_B_DIFB585_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 12 VAL A  74
SER A  60
GLY A  32
ALA A  33
LEU A  81
 None
 0.98A 3n8yB-4iqeA:
undetectable		 3n8yB-4iqeA:
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.
4EM2_A_SALA504_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR SAR2349)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		4 / 8 GLY A  96
ILE A  93
ILE A 150
THR A 106
 None
 0.83A 4em2A-4iqeA:
undetectable		 4em2A-4iqeA:
20.38
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.
4L1A_A_AB1A101_1
(MDR769 HIV-1
PROTEASE)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 11 GLY A 185
ALA A 186
ASP A 187
ILE A  93
THR A 163
 None
 0.86A 4l1aA-4iqeA:
undetectable		 4l1aA-4iqeA:
17.65
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.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		3 / 3 GLU A 192
LYS A 220
ASN A 214
 None
 0.93A 4y1dA-4iqeA:
undetectable
4y1dD-4iqeA:
undetectable		 4y1dA-4iqeA:
20.33
4y1dD-4iqeA:
2.01
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.
5EHI_A_SAMA4001_0
(NS5
METHYLTRANSFERASE
DENGUE VIRUS)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 12 GLY A  67
GLY A  96
GLY A  98
ASP A  94
ILE A 120
 None
 1.00A 5ehiA-4iqeA:
undetectable		 5ehiA-4iqeA:
21.14
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.
5EHI_C_SAMC4000_0
(NS5
METHYLTRANSFERASE
DENGUE VIRUS)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 12 GLY A  67
GLY A  96
GLY A  98
ASP A  94
ILE A 120
 None
 1.02A 5ehiC-4iqeA:
undetectable		 5ehiC-4iqeA:
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.
5EIW_A_SAMA301_0
(NS5
METHYLTRANSFERASE)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 12 GLY A  67
GLY A  96
GLY A  98
ASP A  94
ILE A 120
 None
 1.00A 5eiwA-4iqeA:
undetectable		 5eiwA-4iqeA:
21.14
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.
5EKX_A_SAMA301_0
(NS5
METHYLTRANSFERASE)		 4iqe CARBOXYVINYL-CARBOXY
PHOSPHONATE
PHOSPHORYLMUTASE
(Bacillus
anthracis) 		5 / 12 GLY A  67
GLY A  96
GLY A  98
ASP A  94
ILE A 120
 None
 1.00A 5ekxA-4iqeA:
undetectable		 5ekxA-4iqeA:
undetectable