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The X-ray structure of a dimeric variant of human pancreatic ribonuclease with high cytotoxic and antitumor activities

Analyse The X-ray structure of a dimeric variant of human pancreatic ribonuclease with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3F8G
Type
protein
Length
250 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonuclease pancreatic
EC
3.1.27.5
UniProt
P07998
Ligands
SO4
Pockets
1 · best druggability 0.58

Structure

x-ray diffraction · 1 distinct chain · 21% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BRibonuclease pancreatic (EC 3.1.27.5)protein12521% helix, 35% strandP07998

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 5 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
14550.580.7447empty

Interfaces

1 interface between chains.

  • A–B · 325 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 3F8G · The X-ray structure of a dimeric variant of human pancreatic ribonuclease with high… · the same entry in another collection · chain A against A, TM-score 1.00
  • P07998 · AlphaFold monomer V2.0 prediction for ribonuclease pancreatic (P07998) · a predicted model of the same protein · chain A against A, TM-score 0.96

Analyse

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