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MolNFT v1 · #32214 · protein

Structure of recombinant human lactoferrin produced in the milk of transgenic cows

2BJJ · Lactotransferrin: “Structure of recombinant human lactoferrin produced in the milk of transgenic cows”. X-ray diffraction, 3 ligands (NAG, FE, CO3), 9 pockets (best druggability 0.77). MolNFT v1 #32214 on GenesisL1: 3D structure…

PDB
2BJJ
Type
protein
Length
692 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lactotransferrin
UniProt
P02788
Ligands
NAG, FE, CO3
Pockets
9 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XLactotransferrinprotein69235% helix, 18% strandP02788

Ligands and binding sites

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

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12910.770.8937empty
22410.740.8939empty
32560.580.7926empty
41890.540.7931empty
51950.510.7729empty

Modifications

Observed in the structure: 16 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 2BJJ · Structure of recombinant human lactoferrin produced in the milk of transgenic cows · the same entry in another collection · chain X against X, TM-score 1.00
  • P02788 · AlphaFold monomer V2.0 prediction for lactotransferrin (P02788) · a predicted model of the same protein · chain X against A, TM-score 1.00

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