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Rice IMPORTIN_ALPHA : VIRD2NLS complex

Analyse Rice IMPORTIN_ALPHA : VIRD2NLS complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4BQK
Type
protein
Length
872 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Importin subunit alpha-1A; T-DNA border endonuclease VIRD2
EC
3.1.-.-
UniProt
Q71VM4, P18592
Pockets
4 · best druggability 0.53

Structure

x-ray diffraction · 4 distinct chains · 72% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AImportin subunit alpha-1Aprotein42474% helix, 0% strandQ71VM4
BImportin subunit alpha-1Aprotein42275% helix, 0% strandQ71VM4
CT-DNA border endonuclease VIRD2 (EC 3.1.-.-)protein120% helix, 0% strandP18592
DT-DNA border endonuclease VIRD2 (EC 3.1.-.-)protein140% helix, 0% strandP18592

Ligands and binding sites

  • PEG · Di(hydroxyethyl)ether · additive · 9 copies · chains A, B, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11540.530.8023empty
21770.440.7428PEG
3550.310.7614empty
4550.280.7414PEG

Interfaces

3 interfaces between chains.

  • A–D · 1393 Ų buried · 45 hydrogen bonds · protein-protein
  • B–C · 1243 Ų buried · 39 hydrogen bonds · protein-protein
  • A–B · 655 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 4BQK · rice importin_alpha : VirD2NLS complex · the same entry in another collection · chain D against D, TM-score 1.00
  • Q71VM4 · AlphaFold monomer V2.0 prediction for importin subunit alpha-1A (Q71VM4) · a predicted model of the same protein · chain A against A, TM-score 1.00
  • P18592 · AlphaFold monomer V2.0 prediction for T-DNA border endonuclease VIRD2 (P18592) · a predicted model of the same protein · chain C against A, TM-score 0.33

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