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MolNFT v1 · #20463 · protein

Crystal structure of 2FE2S ferredoxin from thermophilic cyanobacterium mastigocladus laminosus

1RFK: “Crystal structure of 2FE2S ferredoxin from thermophilic cyanobacterium mastigocladus laminosus”. X-ray diffraction, 1 ligand (FES), 1 pocket (best druggability 0.58). MolNFT v1 #20463 on GenesisL1: 3D structure, binding sites and…

PDB
1RFK
Type
protein
Length
192 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ferredoxin
UniProt
P00248
Ligands
FES
Pockets
1 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 21% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFerredoxinprotein9520% helix, 33% strandP00248
BFerredoxinprotein9723% helix, 34% strandP00248

Ligands and binding sites

  • FES · Fe2/s2 (inorganic) cluster · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13800.580.7637empty

Interfaces

1 interface between chains.

  • A–B · 187 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 1RFK · Crystal Structure of 2Fe2S Ferredoxin from Thermophilic Cyanobacterium Mastigocladus… · the same entry in another collection · chain A against A, TM-score 1.00
  • P00248 · AlphaFold monomer V2.0 prediction for ferredoxin (P00248) · a predicted model of the same protein · chain A against A, TM-score 0.99

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