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Crystal structure of the viral otu domain protease from taggert virus

Analyse Crystal structure of the viral otu domain protease from taggert virus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6DX3
Type
protein
Length
652 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA-dependent RNA polymerase
UniProt
A0A142J8F6
Ligands
MG
Pockets
7 · best druggability 0.81

Structure

x-ray diffraction · 4 distinct chains · 37% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARNA-dependent RNA polymeraseprotein16137% helix, 27% strandA0A142J8F6
BRNA-dependent RNA polymeraseprotein16436% helix, 26% strandA0A142J8F6
CRNA-dependent RNA polymeraseprotein16336% helix, 26% strandA0A142J8F6
DRNA-dependent RNA polymeraseprotein16437% helix, 26% strandA0A142J8F6

Ligands and binding sites

  • MG · Magnesium ion · metal · 2 copies · chains D

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

Pockets

7 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19020.810.8491empty
27780.800.8376empty
31000.360.7520empty
4740.330.7620empty
5580.310.7513empty

Interfaces

5 interfaces between chains.

  • B–D · 900 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 869 Ų buried · 9 hydrogen bonds · protein-protein
  • A–B · 484 Ų buried · 3 hydrogen bonds · protein-protein
  • B–C · 80 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 79 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6DX3 · Crystal structure of the viral OTU domain protease from Taggert virus · the same entry in another collection · chain D against D, TM-score 1.00

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