MolNFT v1 · #30992 · protein
Crystal structure of P-bromo-L-phenylalanine-tRNA sythetase in complex with P-bromo-L-phenylalanine
2AG6 · Tyrosyl-tRNA synthetase: “Crystal structure of P-bromo-L-phenylalanine-tRNA sythetase in complex with P-bromo-L-phenylalanine”. X-ray diffraction, 1 ligand (4BF), 2 pockets (best druggability 0.77). MolNFT v1 #30992 on GenesisL1: 3D…
- PDB
- 2AG6
- Type
- protein
- Length
- 307 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Tyrosyl-tRNA synthetase
- EC
- 6.1.1.1
- UniProt
- Q57834
- Ligands
- 4BF
- Pockets
- 2 · best druggability 0.77
Structure
x-ray diffraction · 1 distinct chain · 51% helix, 13% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Tyrosyl-tRNA synthetase (EC 6.1.1.1) | protein | 307 | 51% helix, 13% strand | Q57834 |
Ligands and binding sites
- 4BF · 4-bromo-L-phenylalanine · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 444 | 0.77 | 0.86 | 47 | 4BF |
| 2 | 57 | 0.32 | 0.76 | 16 | empty |
Compared structures
- 2AG6 · Crystal structure of p-bromo-l-phenylalanine-tRNA sythetase in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
- Q57834 · AlphaFold monomer V2.0 prediction for tyrosine--tRNA ligase (Q57834) · a predicted model of the same protein · chain A against A, TM-score 0.98
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 Q57834
- Elsewhere: RCSB PDB 2AG6 · PDBe 2AG6 · UniProt Q57834
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