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Crystal structure of the master-rep protein nuclease domain from the faba bean necrotic yellows virus

Analyse Crystal structure of the master-rep protein nuclease domain from the faba bean… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H8O
Type
protein
Length
190 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Replication-associated protein
UniProt
A0A2D0XNJ4
Ligands
SO4
Pockets
3 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 15% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BReplication-associated proteinprotein9515% helix, 48% strandA0A2D0XNJ4

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 8 copies · chains A, 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15610.660.7764SO4
2500.370.8017empty
3640.360.7815empty

Interfaces

1 interface between chains.

  • A–B · 618 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 6H8O · Crystal structure of the Master-Rep protein nuclease domain from the Faba Bean Necrotic… · the same entry in another collection · chain A against A, TM-score 1.00

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