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Crystal structure of ancestral thioredoxin relative to last archaea common ancestor (laca) from the precambrian period

Analyse Crystal structure of ancestral thioredoxin relative to last archaea common… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2YNX
Type
protein
Length
210 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Laca thioredoxin
EC
1.8.1.9
Ligands
NA
Pockets
1 · best druggability 0.30

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BLaca thioredoxin (EC 1.8.1.9)protein10536% helix, 29% strand—

Ligands and binding sites

  • NA · Sodium ion · metal · chains B
  • ACT · Acetate ion · additive · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1710.300.7315ACT

Interfaces

1 interface between chains.

  • A–B · 468 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 2YNX · Crystal Structure of Ancestral Thioredoxin Relative to Last Archaea Common Ancestor… · the same entry in another collection · chain A against A, TM-score 1.00

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