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Crystal structure of active ribosome inactivating protein from maize (b-32)

Analyse Crystal structure of active ribosome inactivating protein from maize (b-32) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2PQI
Type
protein
Length
700 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.5
Source
Zea mays
Molecule
Ribosome-inactivating protein 3
EC
3.2.2.22
UniProt
P25891
Pockets
4 · best druggability 0.76

Structure

x-ray diffraction · resolution 2.5 · 3 distinct chains · 39% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibosome-inactivating protein 3 (EC 3.2.2.22)protein23839% helix, 16% strandP25891
BRibosome-inactivating protein 3 (EC 3.2.2.22)protein23538% helix, 15% strandP25891
CRibosome-inactivating protein 3 (EC 3.2.2.22)protein22739% helix, 15% strandP25891

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19280.760.7979empty
210350.710.7568empty
31140.450.7822empty
4660.290.7417empty

Interfaces

3 interfaces between chains.

  • B–C · 477 Ų buried · 2 hydrogen bonds · protein-protein
  • A–C · 123 Ų buried · 3 hydrogen bonds · protein-protein
  • A–B · 99 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2PQI · Crystal structure of active ribosome inactivating protein from maize (B-32) · the same entry in another collection · chain A against A, TM-score 1.00
  • P25891 · AlphaFold monomer V2.0 prediction for ribosome-inactivating protein 3 (P25891) · a predicted model of the same protein · chain B against A, TM-score 0.99

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