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MolNFT v1 · #106406 · protein

C-terminal mutant (W550A) of HCV/J4 RNA polymerase

4RY6 · HCV J4 RNA polymerase (NS5B): “C-terminal mutant (W550A) of HCV/J4 RNA polymerase”. X-ray diffraction, 12 pockets (best druggability 0.81). MolNFT v1 #106406 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4RY6
Type
protein
Length
1,129 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HCV J4 RNA polymerase (NS5B)
EC
2.7.7.48
UniProt
O92972
Pockets
12 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 48% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHCV J4 RNA polymerase (NS5B) (EC 2.7.7.48)protein56548% helix, 14% strandO92972
BHCV J4 RNA polymerase (NS5B) (EC 2.7.7.48)protein56448% helix, 15% strandO92972

Pockets

12 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110580.810.8275empty
210020.800.8185empty
34640.630.7648empty
41430.600.8424empty
53830.580.7537empty

Interfaces

1 interface between chains.

  • A–B · 309 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4RY6 · C-terminal mutant (W550A) of HCV/J4 RNA polymerase · the same entry in another collection · chain A against A, TM-score 1.00

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