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MolNFT v1 · #135272 · protein

Structure of a na+-selective mutant of two-pore channel from arabidopsis thaliana ATTPC1

5TUA · Two pore calcium channel protein 1: “Structure of a na+-selective mutant of two-pore channel from arabidopsis thaliana ATTPC1”. X-ray diffraction, 3 ligands (BA, CA, NA), 12 pockets (best druggability 0.71). MolNFT v1 #135272 on…

PDB
5TUA
Type
protein
Length
627 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Two pore calcium channel protein 1
UniProt
Q94KI8
Ligands
BA, CA, NA
Pockets
12 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 76% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATwo pore calcium channel protein 1protein62776% helix, 1% strandQ94KI8

Ligands and binding sites

  • BA · Barium ion · metal · 9 copies · chains A
  • CA · Calcium ion · metal · 2 copies · chains A
  • NA · Sodium ion · metal · chains A

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

Pockets

12 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17130.710.7763empty
2670.690.9518empty
3620.660.9413empty
42170.540.7733empty
51640.500.7728empty

Compared structures

  • 5TUA · structure of a Na+-selective mutant of two-pore channel from Arabidopsis thaliana AtTPC1 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q94KI8 · AlphaFold monomer V2.0 prediction for two pore calcium channel protein 1 (Q94KI8) · a predicted model of the same protein · chain A against A, TM-score 0.93

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