MolNFT v1 · #117789 · protein
Co-crystal structure of EIF4E with nucleotide mimetic inhibitor.
5EIR · Eukaryotic translation initiation factor 4E: “Co-crystal structure of EIF4E with nucleotide mimetic inhibitor.”. X-ray diffraction, 2 ligands (5O8, SO4), 1 pocket (best druggability 0.46). MolNFT v1 #117789 on GenesisL1: 3D…
- PDB
- 5EIR
- Type
- protein
- Length
- 199 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Eukaryotic translation initiation factor 4E; Eukaryotic translation initiation factor 4…
- UniProt
- P06730
- Ligands
- 5O8, SO4
- Pockets
- 1 · best druggability 0.46
Structure
x-ray diffraction · 2 distinct chains · 34% helix, 27% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Eukaryotic translation initiation factor 4E | protein | 185 | 32% helix, 29% strand | P06730 |
| B | Eukaryotic translation initiation factor 4 gamma 1 | protein | 14 | 50% helix, 0% strand | — |
Ligands and binding sites
- 5O8 · ~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[2-azanyl-6-oxidanylidene-7-(phenylmethyl)-1~{H}-purin-7-ium-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-1,1,1-tris(fluoranyl)methanesulfonamide · ligand · chains A
- SO4 · Sulfate ion · ion · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 129 | 0.46 | 0.77 | 17 | 5O8, SO4 |
Interfaces
1 interface between chains.
- A–B · 709 Ų buried · 9 hydrogen bonds · protein-protein
Compared structures
- 5EIR · Co-crystal structure of eIF4E with nucleotide mimetic inhibitor. · the same entry in another collection · chain A against A, TM-score 1.00
- P06730 · AlphaFold monomer V2.0 prediction for eukaryotic translation initiation factor 4E (P06730) · a predicted model of the same protein · chain A against A, TM-score 0.97
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P06730
- Elsewhere: RCSB PDB 5EIR · PDBe 5EIR · UniProt P06730
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