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Crystal structure of human serum albumin in the presence of 0.5 mm zinc at pH 9.0

Analyse Crystal structure of human serum albumin in the presence of 0.5 mm zinc at pH… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5IJF
Type
protein
Length
572 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Serum albumin
UniProt
P02768
Ligands
UNL, ZN
Pockets
7 · best druggability 0.86

Structure

x-ray diffraction · 1 distinct chain · 72% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASerum albuminprotein57272% helix, 0% strandP02768

Ligands and binding sites

  • UNL · Unknown ligand · ligand · 2 copies · chains A
  • ZN · Zinc ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110460.860.87106UNL
21010.650.8921UNL
31450.630.8522empty
41680.490.7620empty
52130.480.7536empty

Modifications

Observed in the structure: 17 disulfide (disulfide).

Compared structures

  • 5IJF · Crystal structure of Human Serum Albumin in the presence of 0.5 mM zinc at pH 9.0 · the same entry in another collection · chain A against A, TM-score 1.00
  • P02768 · AlphaFold monomer V2.0 prediction for albumin (P02768) · a predicted model of the same protein · chain A against A, TM-score 0.98

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