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Otu protease of crimean congo hemorrhagic fever virus bound to ubiquitin variant CC.4

Analyse Otu protease of crimean congo hemorrhagic fever virus bound to ubiquitin… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5V5G
Type
protein
Length
490 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA-directed RNA polymerase L; Ubiquitin variant CC.4
EC
3.4.19.12, 2.7.7.48
UniProt
Q6TQR6
Ligands
NA
Pockets
3 · best druggability 0.77

Structure

x-ray diffraction · 3 distinct chains · 30% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CRNA-directed RNA polymerase L (EC 3.4.19.12, 2.7.7.48)protein16539% helix, 24% strandQ6TQR6
BUbiquitin variant CC.4protein8023% helix, 35% strand—
DUbiquitin variant CC.4protein8019% helix, 35% strand—

Ligands and binding sites

  • NA · Sodium ion · metal · 3 copies · chains A, C
  • EDO · 1,2-ethanediol · additive · 4 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111040.770.7977empty
2640.410.8116EDO
3840.400.7822empty

Interfaces

5 interfaces between chains.

  • C–D · 1036 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 988 Ų buried · 15 hydrogen bonds · protein-protein
  • A–C · 329 Ų buried · 8 hydrogen bonds · protein-protein
  • A–D · 95 Ų buried · 1 hydrogen bond · protein-protein
  • B–D · 49 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (oxidation).

Compared structures

  • 5V5G · OTU protease of Crimean Congo Hemorrhagic Fever Virus bound to ubiquitin variant CC.4 · the same entry in another collection · chain A against A, TM-score 1.00

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