MolNFT v1 · #96699 · protein
Structure of cockroach allergen bla G 1 tandem repeat as a egfp fusion
4JRB · Green fluorescent protein: “Structure of cockroach allergen bla G 1 tandem repeat as a egfp fusion”. X-ray diffraction, 4 ligands (D12, CR2, PGT), 3 pockets (best druggability 0.74). MolNFT v1 #96699 on GenesisL1: 3D structure…
- PDB
- 4JRB
- Type
- protein
- Length
- 398 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Green fluorescent protein
- UniProt
- P42212, Q9UAM5
- Ligands
- D12, CR2, PGT, CL
- Pockets
- 3 · best druggability 0.74
Structure
x-ray diffraction · 1 distinct chain · 39% helix, 29% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Green fluorescent protein | protein | 398 | 39% helix, 29% strand | P42212, Q9UAM5 |
Ligands and binding sites
- D12 · Dodecane · ligand · 6 copies · chains A
- CR2 · {(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid · ligand · chains A
- PGT · (1S)-2-{[{[(2R)-2,3-dihydroxypropyl]oxy}(hydroxy) phosphoryl]oxy}-1-[(palmitoyloxy)methyl]ethyl stearate · ligand · chains A
- CL · Chloride ion · ion · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 74 | 0.74 | 0.98 | 25 | CR2 |
| 2 | 613 | 0.63 | 0.73 | 58 | PGT, D12 |
| 3 | 67 | 0.43 | 0.81 | 18 | empty |
Modifications
Observed in the structure: 2 cofactor (chromophore).
Compared structures
- 4JRB · Structure of Cockroach Allergen Bla g 1 Tandem Repeat as a EGFP fusion · the same entry in another collection · chain A against A, TM-score 1.00
- P42212 · AlphaFold monomer V2.0 prediction for green fluorescent protein (P42212) · a predicted model of the same protein · chain A against A, TM-score 0.57
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 P42212
- Every structure of UniProt Q9UAM5
- Elsewhere: RCSB PDB 4JRB · PDBe 4JRB · UniProt P42212 · UniProt Q9UAM5
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