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MolNFT v1 · #72999 · protein

Crystal structure of PD(ALLYL)/APO-E45C/C48A-rhlfr

3NP2 · Ferritin light chain: “Crystal structure of PD(ALLYL)/APO-E45C/C48A-rhlfr”. X-ray diffraction, 4 ligands (PLL, PD, CD), 2 pockets (best druggability 0.39). MolNFT v1 #72999 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
3NP2
Type
protein
Length
172 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ferritin light chain
UniProt
P02791
Ligands
PLL, PD, CD, SO4
Pockets
2 · best druggability 0.39

Structure

x-ray diffraction · 1 distinct chain · 73% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XFerritin light chainprotein17273% helix, 0% strandP02791

Ligands and binding sites

  • PLL · Palladium(II) allyl complex · ligand · 2 copies · chains X
  • PD · Palladium ion · metal · 2 copies · chains X
  • CD · Cadmium ion · metal · 2 copies · chains X
  • SO4 · Sulfate ion · ion
  • EDO · 1,2-ethanediol · additive · 8 copies · chains X

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1740.390.7816empty
2550.320.7718empty

Compared structures

  • 3NP2 · Crystal Structure of Pd(allyl)/apo-E45C/C48A-rHLFr · the same entry in another collection · chain X against X, TM-score 1.00
  • P02791 · AlphaFold monomer V2.0 prediction for ferritin light chain (P02791) · a predicted model of the same protein · chain X against A, TM-score 0.99

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