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Crystal structure of Chaetomium thermophilum Nup170 NTD-Nup53 complex

Analyse Crystal structure of Chaetomium thermophilum Nup170 NTD-Nup53 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5HAX
Type
protein
Length
712 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.1
Source
Chaetomium thermophilum (strain DSM 1495 / CBS 144.50 / IMI 039719); SYNTHETIC…
Molecule
Nucleoporin NUP170; Nucleoporin NUP53
UniProt
G0S7B6, G0S156
Ligands
PO4
Pockets
13 · best druggability 0.78

Structure

x-ray diffraction · resolution 2.1 · 2 distinct chains · 30% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANucleoporin NUP170protein69830% helix, 28% strandG0S7B6
BNucleoporin NUP53protein1429% helix, 29% strandG0S156

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 4 copies · chains A
  • EDO · 1,2-ethanediol · additive · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

13 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19870.780.8057empty
2870.680.9331empty
32360.520.7639empty
4690.360.7817empty
5810.330.7518empty

Interfaces

1 interface between chains.

  • A–B · 753 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 5HAX · Crystal structure of chaetomium thermophilum NUP170 ntd-NUP53 complex · the same entry in another collection · chain A against A, TM-score 1.00
  • G0S7B6 · AlphaFold monomer V2.0 prediction for nucleoporin NUP170 (G0S7B6) · a predicted model of the same protein · chain A against A, TM-score 1.00
  • G0S156 · AlphaFold monomer V2.0 prediction for nucleoporin NUP53 (G0S156) · a predicted model of the same protein · chain B against A, TM-score 0.39

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