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Crystal structure of the cytosolic domain of human atlastin-1 in complex with GDP, hexagonal form

Analyse Crystal structure of the cytosolic domain of human atlastin-1 in complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3QNU
Type
protein
Length
395 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Atlastin-1
EC
3.6.5.-
UniProt
Q8WXF7
Ligands
GDP, MG
Pockets
6 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAtlastin-1 (EC 3.6.5.-)protein39543% helix, 18% strandQ8WXF7

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12840.630.8134GDP, MG
2800.520.8516empty
3600.430.8216empty
4800.400.7816empty
5670.300.7418empty

Compared structures

  • 3QNU · Crystal structure of the cytosolic domain of human atlastin-1 in complex with GDP… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8WXF7 · AlphaFold monomer V2.0 prediction for atlastin-1 (Q8WXF7) · a predicted model of the same protein · chain A against A, TM-score 0.84

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