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ARA7-GDP/ATVPS9A

Analyse ARA7-GDP/ATVPS9A in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2EFC
Type
protein
Length
822 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Similarity to vacuolar protein sorting-associated protein VPS9; Small GTP-binding…
UniProt
Q9LT31, Q9SN68
Ligands
GDP
Pockets
8 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 58% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CSimilarity to vacuolar protein sorting-associated protein VPS9protein24674% helix, 0% strandQ9LT31
B, DSmall GTP-binding protein-likeprotein16535% helix, 24% strandQ9SN68

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · 2 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19980.780.8078empty
22320.520.7634empty
31640.510.7933GDP
41530.490.7832GDP
5730.400.7921empty

Interfaces

5 interfaces between chains.

  • C–D · 1210 Ų buried · 22 hydrogen bonds · protein-protein
  • A–B · 1203 Ų buried · 20 hydrogen bonds · protein-protein
  • A–C · 554 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 307 Ų buried · 3 hydrogen bonds · protein-protein
  • A–D · 282 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 2EFC · Ara7-GDP/AtVps9a · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9LT31 · AlphaFold monomer V2.0 prediction for vacuolar protein sorting- associated protein 9A… · a predicted model of the same protein · chain A against A, TM-score 0.99
  • Q9SN68 · AlphaFold monomer V2.0 prediction for RAS-related protein RABF2B (Q9SN68) · a predicted model of the same protein · chain B against A, TM-score 0.93

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