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The structure of sterol carrier protein 2 from the yeast yarrowia lipolytica

Analyse The structure of sterol carrier protein 2 from the yeast yarrowia lipolytica in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4JGX
Type
protein
Length
247 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fatty acid-binding protein
UniProt
P80547
Ligands
PLM
Pockets
2 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 42% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFatty acid-binding proteinprotein11941% helix, 26% strandP80547
BFatty acid-binding proteinprotein12843% helix, 24% strandP80547

Ligands and binding sites

  • PLM · Palmitic acid · ligand · 2 copies · chains A, B
  • CIT · Citric acid · additive · 2 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11960.740.8930PLM
23190.660.8133PLM

Interfaces

1 interface between chains.

  • A–B · 737 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 4JGX · The Structure of Sterol Carrier Protein 2 from the Yeast Yarrowia Lipolytica · the same entry in another collection · chain A against A, TM-score 1.00
  • P80547 · AlphaFold monomer V2.0 prediction for fatty acid-binding protein (P80547) · a predicted model of the same protein · chain A against A, TM-score 0.99

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