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MolNFT v1 · #184402 · protein

Cryo-EM structure of P5B-ATPase E2PIALF/SPM

7OP1 · Cation-transporting ATPase: “Cryo-EM structure of P5B-ATPase E2PIALF/SPM”. Electron microscopy, 3 ligands (ALF, SPM, MG), 15 pockets (best druggability 0.80). MolNFT v1 #184402 on GenesisL1: 3D structure, binding sites and pockets…

PDB
7OP1
Type
protein
Length
1,098 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cation-transporting ATPase
EC
7.2.2.-
UniProt
G0S7G9
Ligands
ALF, SPM, MG
Pockets
15 · best druggability 0.80

Structure

electron microscopy · 1 distinct chain · 42% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACation-transporting ATPase (EC 7.2.2.-)protein109842% helix, 16% strandG0S7G9

Ligands and binding sites

  • ALF · Tetrafluoroaluminate ion · ligand · chains A
  • SPM · Spermine · 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18740.800.8286empty
27730.730.7880empty
31920.680.8626SPM
43590.640.7930empty
51100.570.8524empty

Compared structures

  • 7OP1 · Cryo-EM structure of P5B-ATPase E2PiAlF/SPM · the same entry in another collection · chain A against A, TM-score 1.00

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