Structure of PDB 1l8b Chain B Binding Site BS01
Receptor Information
>1l8b Chain B (length=190) Species:
10090
(Mus musculus) [
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VANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYN
HIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLD
RFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENRDAVT
HIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV
Ligand information
Ligand ID
MGP
InChI
InChI=1S/C11H18N5O14P3/c1-15-3-16(8-5(15)9(19)14-11(12)13-8)10-7(18)6(17)4(28-10)2-27-32(23,24)30-33(25,26)29-31(20,21)22/h3-4,6-7,10,17-18H,2H2,1H3,(H6-,12,13,14,19,20,21,22,23,24,25,26)/p+1/t4-,6-,7-,10-/m1/s1
InChIKey
DKVRNHPCAOHRSI-KQYNXXCUSA-O
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
C[n+]1cn(c2c1C(=O)NC(=N2)N)[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@@](=O)(O)O[P@@](=O)(O)OP(=O)(O)O)O)O
CACTVS 3.341
C[n+]1cn([C@@H]2O[C@H](CO[P@](O)(=O)O[P@](O)(=O)O[P](O)(O)=O)[C@@H](O)[C@H]2O)c3N=C(N)NC(=O)c13
OpenEye OEToolkits 1.5.0
C[n+]1cn(c2c1C(=O)NC(=N2)N)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O
ACDLabs 10.04
O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n2c[n+](c1c2N=C(N)NC1=O)C)C(O)C3O
CACTVS 3.341
C[n+]1cn([CH]2O[CH](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)[CH](O)[CH]2O)c3N=C(N)NC(=O)c13
Formula
C11 H19 N5 O14 P3
Name
7-METHYL-GUANOSINE-5'-TRIPHOSPHATE
ChEMBL
CHEMBL1234303
DrugBank
DB02716
ZINC
ZINC000015601432
PDB chain
1l8b Chain B Residue 2000 [
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Receptor-Ligand Complex Structure
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PDB
1l8b
Biophysical studies of eIF4E cap-binding protein: recognition of mRNA 5' cap structure and synthetic fragments of eIF4G and 4E-BP1 proteins.
Resolution
1.8 Å
Binding residue
(original residue number in PDB)
W56 M101 W102 E103 R157 K162
Binding residue
(residue number reindexed from 1)
W29 M74 W75 E76 R130 K135
Annotation score
1
Binding affinity
MOAD
: Kd=0.14uM
BindingDB: Kd=10nM
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0003723
RNA binding
GO:0003743
translation initiation factor activity
Biological Process
GO:0006413
translational initiation
Cellular Component
GO:0005737
cytoplasm
View graph for
Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:1l8b
,
PDBe:1l8b
,
PDBj:1l8b
PDBsum
1l8b
PubMed
12054859
UniProt
P63073
|IF4E_MOUSE Eukaryotic translation initiation factor 4E (Gene Name=Eif4e)
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