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Caspase-3 specific unnatural amino acid peptides

Analyse Caspase-3 specific unnatural amino acid peptides in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4JJE
Type
protein
Length
245 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.481
Source
Homo sapiens; SYNTHETIC CONSTRUCT
Molecule
Caspase-3; Caspase inhibitor
EC
3.4.22.56
UniProt
P42574

Structure

x-ray diffraction · resolution 1.481 · 2 distinct chains · 28% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACaspase-3 (EC 3.4.22.56)protein24029% helix, 25% strandP42574
BCaspase inhibitorprotein50% helix, 60% strand—

Interfaces

1 interface between chains.

  • A–B · 526 Ų buried · 18 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 modified (nonstandard).

Compared structures

  • 4JJE · Caspase-3 specific unnatural amino acid peptides · the same entry in another collection · chain A against A, TM-score 1.00
  • P42574 · AlphaFold monomer V2.0 prediction for caspase-3 (P42574) · a predicted model of the same protein · chain A against A, TM-score 0.98

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