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MolNFT v1 · #153008 · protein

Cryo-EM structure of an extracellular contractile injection system, pvc SHEATH/TUBE terminator in extended state

6J0F · PVC16: “Cryo-EM structure of an extracellular contractile injection system, pvc SHEATH/TUBE terminator in extended…”. Electron microscopy, 20 pockets (best druggability 0.74). MolNFT v1 #153008 on GenesisL1: 3D structure, binding…

PDB
6J0F
Type
protein
Length
2,472 residues
Chains
12
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PVC16; PVC1
UniProt
B6VNM9, B6VNP4
Pockets
20 · best druggability 0.74

Structure

electron microscopy · 2 distinct chains · 18% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, FPVC16protein27225% helix, 24% strandB6VNM9
a, b, c, d, e, fPVC1protein1404% helix, 49% strandB6VNP4

Pockets

20 pockets found on a 1 Å grid, 18 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13650.740.8542empty
23660.740.8542empty
34140.730.8452empty
43710.730.8542empty
53460.730.8545empty

Interfaces

36 interfaces between chains.

  • A–B · 1762 Ų buried · 10 hydrogen bonds · protein-protein
  • A–F · 1756 Ų buried · 10 hydrogen bonds · protein-protein
  • D–E · 1755 Ų buried · 10 hydrogen bonds · protein-protein
  • C–D · 1755 Ų buried · 10 hydrogen bonds · protein-protein
  • B–C · 1755 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 6J0F · Cryo-EM Structure of an Extracellular Contractile Injection System, PVC sheath/tube… · the same entry in another collection · chain D against D, TM-score 1.00

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