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MolNFT v1 · #174570 · protein

Crystal structure of ferredoxin: thioredoxin reductase and thioredoxin Y1 complex

7BZK · Ferredoxin-thioredoxin reductase catalytic chain…: “Crystal structure of ferredoxin: thioredoxin reductase and thioredoxin Y1 complex”. X-ray diffraction, 1 ligand (SF4), 1 pocket (best druggability 0.33). MolNFT v1 #174570 on…

PDB
7BZK
Type
protein
Length
214 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ferredoxin-thioredoxin reductase catalytic chain, chloroplastic; Thioredoxin Y1…
EC
1.8.7.2
UniProt
Q9SJ89, Q6NPF9
Ligands
SF4
Pockets
1 · best druggability 0.33

Structure

x-ray diffraction · 2 distinct chains · 47% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFerredoxin-thioredoxin reductase catalytic chain, chloroplastic (EC 1.8.7.2)protein11250% helix, 6% strandQ9SJ89
BThioredoxin Y1, chloroplasticprotein10243% helix, 25% strandQ6NPF9

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1650.330.7614empty

Interfaces

1 interface between chains.

  • A–B · 852 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7BZK · Crystal structure of ferredoxin: thioredoxin reductase and thioredoxin y1 complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9SJ89 · AlphaFold monomer V2.0 prediction for ferredoxin-thioredoxin reductase catalytic chain… · a predicted model of the same protein · chain A against A, TM-score 0.99
  • Q6NPF9 · AlphaFold monomer V2.0 prediction for thioredoxin Y1, chloroplastic (Q6NPF9) · a predicted model of the same protein · chain B against A, TM-score 0.95

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