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MolNFT v1 · #186032 · protein

Structural basis on the interaction of scribble PDZ domains with the tick born encephalitis virus (tbev) NS5 protein

7QSA · Protein scribble homolog: “Structural basis on the interaction of scribble PDZ domains with the tick born encephalitis virus (tbev) NS5…”. X-ray diffraction, 1 pocket (best druggability 0.67). MolNFT v1 #186032 on GenesisL1: 3D…

PDB
7QSA
Type
protein
Length
169 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein scribble homolog; RNA-directed RNA polymerase NS5
EC
2.1.1.56, 2.1.1.57, 2.7.7.48
UniProt
Q14160, Q01299
Pockets
1 · best druggability 0.67

Structure

x-ray diffraction · 3 distinct chains · 13% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein scribble homologprotein8516% helix, 35% strandQ14160
BProtein scribble homologprotein7810% helix, 38% strandQ14160
CRNA-directed RNA polymerase NS5 (EC 2.1.1.56, 2.1.1.57, 2.7.7.48)protein60% helix, 67% strandQ01299

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11650.670.8726empty

Interfaces

3 interfaces between chains.

  • A–B · 505 Ų buried · 1 hydrogen bond · protein-protein
  • A–C · 440 Ų buried · 11 hydrogen bonds · protein-protein
  • B–C · 386 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 7QSA · Structural basis on the interaction of Scribble PDZ domains with the Tick Born… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q14160 · AlphaFold monomer V2.0 prediction for protein scribble homolog (Q14160) · a predicted model of the same protein · chain A against A, TM-score 0.91

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