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Crystal structure of plant vegetative storage protein

Analyse Crystal structure of plant vegetative storage protein in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4FYP
Type
protein
Length
449 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vegetative storage protein 1
UniProt
O49195
Ligands
MG
Pockets
6 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 44% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVegetative storage protein 1protein22844% helix, 14% strandO49195
BVegetative storage protein 1protein22143% helix, 15% strandO49195

Ligands and binding sites

  • MG · Magnesium ion · metal · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13510.740.8536empty
23770.660.8036MG
33570.640.7936MG
41350.450.7728empty
5780.400.7819empty

Interfaces

1 interface between chains.

  • A–B · 1560 Ų buried · 27 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 4FYP · Crystal Structure of Plant Vegetative Storage Protein · the same entry in another collection · chain A against A, TM-score 1.00
  • O49195 · AlphaFold monomer V2.0 prediction for vegetative storage protein 1 (O49195) · a predicted model of the same protein · chain B against A, TM-score 0.99

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