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Structure of ATP7B in state 1

Analyse Structure of ATP7B in state 1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7SI6
Type
protein
Length
873 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
P-type cu(+) transporter
EC
7.2.2.8
UniProt
A0A6I8R0A5
Ligands
ALF, MG
Pockets
10 · best druggability 0.75

Structure

electron microscopy · 1 distinct chain · 49% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AP-type cu(+) transporter (EC 7.2.2.8)protein87349% helix, 18% strandA0A6I8R0A5

Ligands and binding sites

  • ALF · Tetrafluoroaluminate ion · 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15370.750.8253empty
29270.730.7793MG
34050.600.7643empty
42230.490.7526empty
5560.480.8520empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7SI6 · Structure of ATP7B in state 1 · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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