GL1X · GenesisL1 explorer

MolNFT v1 · #162134 · protein

Getah virus macro domain

6QZU · Non-structural polyprotein: “Getah virus macro domain”. X-ray diffraction, 3 pockets (best druggability 0.57). MolNFT v1 #162134 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6QZU
Type
protein
Length
320 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Non-structural polyprotein
UniProt
A0A143SL92
Pockets
3 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BNon-structural polyproteinprotein16039% helix, 21% strandA0A143SL92

Ligands and binding sites

  • PEG · Di(hydroxyethyl)ether · additive · chains A
  • EDO · 1,2-ethanediol · additive · chains B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11700.570.8126empty
22090.570.7928empty
31940.540.7829empty

Interfaces

1 interface between chains.

  • A–B · 404 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 6QZU · Getah virus macro domain · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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