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MolNFT v1 · #152679 · protein

Non-native ferritin 8-mer mutant-C90A/C102A/C130A/D144C

6IPP · Ferritin heavy chain: “Non-native ferritin 8-mer mutant-C90A/C102A/C130A/D144C”. X-ray diffraction, 1 ligand (FE), 2 pockets (best druggability 0.74). MolNFT v1 #152679 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6IPP
Type
protein
Length
303 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ferritin heavy chain
EC
1.16.3.1
UniProt
P02794
Ligands
FE
Pockets
2 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 69% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFerritin heavy chain (EC 1.16.3.1)protein16269% helix, 1% strandP02794
BFerritin heavy chain (EC 1.16.3.1)protein14169% helix, 1% strandP02794

Ligands and binding sites

  • FE · Fe (III) ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1650.740.9813empty
2910.460.8117FE

Interfaces

1 interface between chains.

  • A–B · 1528 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 6IPP · Non-native ferritin 8-mer mutant-C90A/C102A/C130A/D144C · the same entry in another collection · chain A against A, TM-score 1.00
  • P02794 · AlphaFold monomer V2.0 prediction for ferritin heavy chain (P02794) · a predicted model of the same protein · chain A against A, TM-score 0.96

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