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MolNFT v1 · #8657 · protein

The crystal structure of diferric porcine serum transferrin

1H76 · Serotransferrin: “The crystal structure of diferric porcine serum transferrin”. X-ray diffraction, 3 ligands (NAG, FE, CO3), 9 pockets (best druggability 0.73). MolNFT v1 #8657 on GenesisL1: 3D structure, binding sites and pockets…

PDB
1H76
Type
protein
Length
677 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Serotransferrin
UniProt
P09571
Ligands
NAG, FE, CO3
Pockets
9 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASerotransferrinprotein67736% helix, 19% strandP09571

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A
  • FE · Fe (III) ion · metal · 2 copies · chains A
  • CO3 · Carbonate ion · ion · 2 copies · chains A

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

Pockets

9 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11650.730.9136empty
22910.720.8637empty
32780.560.7734empty
41110.550.8324empty
51500.520.7919empty

Modifications

Observed in the structure: 18 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 1H76 · The crystal structure of diferric porcine serum transferrin · the same entry in another collection · chain A against A, TM-score 1.00
  • P09571 · AlphaFold monomer V2.0 prediction for serotransferrin (P09571) · a predicted model of the same protein · chain A against A, TM-score 0.98

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