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MolNFT v1 · #178287 · protein

SARS-cov-2 spike protein in closed state

7FB0 · Spike glycoprotein: “SARS-cov-2 spike protein in closed state”. Electron microscopy, 20 pockets (best druggability 0.86). MolNFT v1 #178287 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7FB0
Type
protein
Length
2,926 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Spike glycoprotein
UniProt
P0DTC2
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 2 distinct chains · 22% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASpike glycoproteinprotein97623% helix, 25% strandP0DTC2
B, CSpike glycoproteinprotein97522% helix, 26% strandP0DTC2

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19280.860.88118empty
25340.840.9060empty
39240.800.8275empty
49360.790.8176empty
54660.790.8765empty

Interfaces

3 interfaces between chains.

  • A–C · 4544 Ų buried · 34 hydrogen bonds · protein-protein
  • B–C · 4525 Ų buried · 34 hydrogen bonds · protein-protein
  • A–B · 4485 Ų buried · 33 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 36 disulfide (disulfide).

Compared structures

  • 7FB0 · SARS-CoV-2 spike protein in closed state · the same entry in another collection · chain A against A, TM-score 1.00

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