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Crystal structure of ribonuclease a in complex with 5'- phospho-2'-deoxyuridine-3'-pyrophosphate adenosine-3'- phosphate

Analyse Crystal structure of ribonuclease a in complex with 5'… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1QHC
Type
protein
Length
248 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (ribonuclease a)
EC
3.1.27.5
UniProt
P61823
Ligands
PUA
Pockets
2 · best druggability 0.47

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProtein (ribonuclease a) (EC 3.1.27.5)protein12421% helix, 35% strandP61823

Ligands and binding sites

  • PUA · Adenylate-3'-phosphate-[[2'-deoxy-uridine-5'-phosphate]-3'-phosphate] · ligand · 2 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
11580.470.7729empty
2500.320.7717empty

Interfaces

1 interface between chains.

  • A–B · 340 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 1QHC · Crystal structure of ribonuclease a in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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