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Semi-synthetic ribonuclease S: cyanylated homocysteine at position 13

Analyse Semi-synthetic ribonuclease S: cyanylated homocysteine at position 13 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3OR0
Type
protein
Length
233 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonuclease pancreatic
EC
3.1.27.5
UniProt
P61823
Pockets
1 · best druggability 0.48

Structure

x-ray diffraction · 3 distinct chains · 27% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
aRibonuclease pancreatic (EC 3.1.27.5)protein1464% helix, 7% strandP61823
A, BRibonuclease pancreatic (EC 3.1.27.5)protein10217% helix, 42% strandP61823
bRibonuclease pancreatic (EC 3.1.27.5)protein1560% helix, 7% strandP61823

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12200.480.7531empty

Interfaces

3 interfaces between chains.

  • b–B · 709 Ų buried · 13 hydrogen bonds · protein-protein
  • a–A · 694 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 15 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide, 2 modified (disulfide, nonstandard).

Compared structures

  • 3OR0 · Semi-synthetic ribonuclease S: cyanylated homocysteine at position 13 · the same entry in another collection · chain A against A, TM-score 1.00

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