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MolNFT v1 · #40987 · protein

2 ångström X-ray structure of the yeast escrt-I VPS28 C-terminus in complex with the nzf-N domain from escrt-II

2J9U · Vacuolar protein sorting-associated protein 28: “2 ångström X-ray structure of the yeast escrt-I VPS28 C-terminus in complex with the nzf-N domain from…”. X-ray diffraction, 1 ligand (ZN), 1 pocket (best druggability 0.56). MolNFT…

PDB
2J9U
Type
protein
Length
282 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vacuolar protein sorting-associated protein 28; Vacuolar protein sorting-associated…
UniProt
Q02767, Q06696
Ligands
ZN
Pockets
1 · best druggability 0.56

Structure

x-ray diffraction · 2 distinct chains · 55% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CVacuolar protein sorting-associated protein 28protein9474% helix, 2% strandQ02767
B, DVacuolar protein sorting-associated protein 36protein4715% helix, 23% strandQ06696

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains B, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13550.560.7537empty

Interfaces

3 interfaces between chains.

  • C–D · 517 Ų buried · 3 hydrogen bonds · protein-protein
  • A–B · 514 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 390 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 2J9U · 2 Angstrom X-ray structure of the yeast ESCRT-I Vps28 C-terminus in complex with the… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q02767 · AlphaFold monomer V2.0 prediction for vacuolar protein sorting- associated protein 28… · a predicted model of the same protein · chain A against A, TM-score 0.98
  • Q06696 · AlphaFold monomer V2.0 prediction for vacuolar protein-sorting- associated protein 36… · a predicted model of the same protein · chain B against A, TM-score 0.95

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