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MolNFT v1 · #177110 · protein

Wt transporter STATE1

7E7S · SARCOPLASMIC/ENDOPLASMIC reticulum calcium ATPase 2: “Wt transporter STATE1”. Electron microscopy, 1 ligand (CA), 15 pockets (best druggability 0.79). MolNFT v1 #177110 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7E7S
Type
protein
Length
1,020 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SARCOPLASMIC/ENDOPLASMIC reticulum calcium ATPase 2
EC
7.2.2.10
UniProt
P16615
Ligands
CA
Pockets
15 · best druggability 0.79

Structure

electron microscopy · 1 distinct chain · 48% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASARCOPLASMIC/ENDOPLASMIC reticulum calcium ATPase 2 (EC 7.2.2.10)protein102048% helix, 15% strandP16615

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · 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
111630.790.81103empty
25230.710.8155empty
35080.700.8059empty
45570.670.7743empty
52900.620.8039empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7E7S · WT transporter state1 · the same entry in another collection · chain A against A, TM-score 1.00
  • P16615 · AlphaFold monomer V2.0 prediction for SARCOPLASMIC/ENDOPLASMIC reticulum calcium ATPase 2… · a predicted model of the same protein · chain A against A, TM-score 0.71

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