GL1X · GenesisL1 explorer

MolNFT v1 · #187139 · protein

M. xanthus encapsulin enca bound to encb targeting peptide

7S2T: “M. xanthus encapsulin enca bound to encb targeting peptide”. Electron microscopy, 12 pockets (best druggability 0.77). MolNFT v1 #187139 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7S2T
Type
protein
Length
850 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Enca; Encb targeting peptide
UniProt
Q1D6H4
Pockets
12 · best druggability 0.77

Structure

electron microscopy · 4 distinct chains · 26% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEncaprotein27527% helix, 14% strandQ1D6H4
C, BEncaprotein27028% helix, 20% strandQ1D6H4
F, GEncb targeting peptideprotein120% helix, 0% strand—
HEncb targeting peptideprotein110% helix, 0% strand—

Pockets

12 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11110.770.9625empty
2840.700.9429empty
3640.650.9325empty
41200.580.8422empty
51550.520.7924empty

Interfaces

7 interfaces between chains.

  • A–F · 677 Ų buried · 9 hydrogen bonds · protein-protein
  • C–H · 652 Ų buried · 12 hydrogen bonds · protein-protein
  • B–G · 629 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 594 Ų buried · 4 hydrogen bonds · protein-protein
  • C–B · 233 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7S2T · M. xanthus encapsulin EncA bound to EncB targeting peptide · the same entry in another collection · chain A against A, TM-score 1.00

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