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MolNFT v1 · #143481 · protein

Capsid protein and C-terminal part of scaffolding protein in the staphylococcus aureus phage 80ALPHA procapsid

6B0X · Major head protein: “Capsid protein and C-terminal part of scaffolding protein in the staphylococcus aureus phage 80ALPHA procapsid”. Electron microscopy, 20 pockets (best druggability 0.85). MolNFT v1 #143481 on GenesisL1: 3D…

PDB
6B0X
Type
protein
Length
2,097 residues
Chains
14
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Major head protein; Scaffold protein
UniProt
A4ZFB3, A4ZFB2
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 4 distinct chains · 30% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, GMajor head proteinprotein28426% helix, 14% strandA4ZFB3
aScaffold proteinprotein1450% helix, 0% strandA4ZFB2
b, d, e, f, gScaffold proteinprotein1656% helix, 0% strandA4ZFB2
cScaffold proteinprotein1553% helix, 0% strandA4ZFB2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18820.850.8781empty
211050.830.8497empty
310830.770.80121empty
4720.730.9723empty
57370.650.7456empty

Interfaces

21 interfaces between chains.

  • F–G · 1775 Ų buried · 18 hydrogen bonds · protein-protein
  • B–G · 1768 Ų buried · 22 hydrogen bonds · protein-protein
  • D–E · 1765 Ų buried · 21 hydrogen bonds · protein-protein
  • C–D · 1601 Ų buried · 18 hydrogen bonds · protein-protein
  • E–F · 1540 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 6B0X · Capsid protein and C-terminal part of scaffolding protein in the Staphylococcus aureus… · the same entry in another collection · chain A against A, TM-score 1.00

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