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MolNFT v1 · #24690 · protein

DC26 mutant of vaccinia virus protein VP39 in complex with S- adenosylhomocysteine and M7G(5')PPPG

1V39: “DC26 mutant of vaccinia virus protein VP39 in complex with S- adenosylhomocysteine and M7G(5')PPPG”. X-ray diffraction, 2 ligands (SAH, M7G), 4 pockets (best druggability 0.50). MolNFT v1 #24690 on GenesisL1: 3D structure, binding…

PDB
1V39
Type
protein
Length
291 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
VP39
EC
2.7.7.19
UniProt
P07617
Ligands
SAH, M7G
Pockets
4 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVP39 (EC 2.7.7.19)protein29141% helix, 17% strandP07617

Ligands and binding sites

  • SAH · S-adenosyl-L-homocysteine · ligand · chains A
  • M7G · 7N-methyl-8-hydroguanosine-5'-diphosphate · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12010.500.7637M7G
2840.380.7720empty
3800.340.7513empty
4670.310.7523SAH

Compared structures

  • 1V39 · DC26 mutant of vaccinia virus protein VP39 in complex with S-adenosylhomocysteine and… · the same entry in another collection · chain A against A, TM-score 1.00

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