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MolNFT v1 · #51910 · protein

Crystal structure of a repair endonuclease from pyrococcus abyssi

2VLD · Endonuclease nucs: “Crystal structure of a repair endonuclease from pyrococcus abyssi”. X-ray diffraction, 8 pockets (best druggability 0.49). MolNFT v1 #51910 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2VLD
Type
protein
Length
454 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Endonuclease nucs
EC
3.1.-.-
UniProt
Q9V2E8
Pockets
8 · best druggability 0.49

Structure

x-ray diffraction · 2 distinct chains · 24% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEndonuclease nucs (EC 3.1.-.-)protein22824% helix, 43% strandQ9V2E8
BEndonuclease nucs (EC 3.1.-.-)protein22624% helix, 44% strandQ9V2E8

Pockets

8 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11200.490.8021empty
21170.490.8021empty
31110.480.8018empty
41150.470.7919empty
5840.380.7717empty

Interfaces

1 interface between chains.

  • A–B · 3001 Ų buried · 50 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 9 modified (engineered).

Compared structures

  • 2VLD · crystal structure of a repair endonuclease from Pyrococcus abyssi · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9V2E8 · AlphaFold monomer V2.0 prediction for endonuclease nucs (Q9V2E8) · a predicted model of the same protein · chain B against A, TM-score 0.55

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