GL1X · GenesisL1 explorer

MolNFT v1 · #187677 · protein

Nucleotide-free GET3 in two open forms

7SPZ · ATPase ASNA1 homolog: “Nucleotide-free GET3 in two open forms”. X-ray diffraction, 1 ligand (ZN), 7 pockets (best druggability 0.50). MolNFT v1 #187677 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7SPZ
Type
protein
Length
641 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ATPase ASNA1 homolog
EC
3.6.-.-
UniProt
A8B3G9
Ligands
ZN
Pockets
7 · best druggability 0.50

Structure

x-ray diffraction · 2 distinct chains · 49% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AATPase ASNA1 homolog (EC 3.6.-.-)protein32849% helix, 15% strandA8B3G9
BATPase ASNA1 homolog (EC 3.6.-.-)protein31350% helix, 13% strandA8B3G9

Ligands and binding sites

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

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11720.500.7732empty
21480.470.7725empty
31210.460.7824empty
41750.450.7516empty
5660.430.8214empty

Interfaces

1 interface between chains.

  • A–B · 75 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7SPZ · Nucleotide-free Get3 in two open forms · the same entry in another collection · chain A against A, TM-score 1.00
  • A8B3G9 · AlphaFold monomer V2.0 prediction for ATPase ASNA1 homolog (A8B3G9) · a predicted model of the same protein · chain B against A, TM-score 0.90

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