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Crystal Structure of Ribonuclease A in 70% Hexanediol

Analyse Crystal Structure of Ribonuclease A in 70% Hexanediol in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3EV1
Type
protein
Length
246 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2
Source
Bos taurus
Molecule
Ribonuclease pancreatic
EC
3.1.27.5
UniProt
P61823
Pockets
2 · best druggability 0.45

Structure

x-ray diffraction · resolution 2 · 2 distinct chains · 21% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibonuclease pancreatic (EC 3.1.27.5)protein12221% helix, 36% strandP61823
BRibonuclease pancreatic (EC 3.1.27.5)protein12421% helix, 34% strandP61823

Ligands and binding sites

  • HEZ · Hexane-1,6-diol · additive · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11830.450.7528empty
2580.390.8016empty

Interfaces

1 interface between chains.

  • A–B · 309 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 3EV1 · Crystal structure of ribonuclease a in 70% hexanediol · the same entry in another collection · chain A against A, TM-score 1.00

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