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MolNFT v1 · #115958 · protein

Crystal structure of myxoma virus M64

5CZ3 · M64R: “Crystal structure of myxoma virus M64”. X-ray diffraction, 3 pockets (best druggability 0.59). MolNFT v1 #115958 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5CZ3
Type
protein
Length
299 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
M64R
UniProt
Q9Q8N4
Pockets
3 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 7% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AM64Rprotein1517% helix, 46% strandQ9Q8N4
BM64Rprotein1487% helix, 46% strandQ9Q8N4

Ligands and binding sites

  • BME · Beta-mercaptoethanol · additive · 2 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
13640.590.7541empty
22100.470.7419empty
3560.260.7313empty

Interfaces

1 interface between chains.

  • A–B · 445 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (additive adduct).

Compared structures

  • 5CZ3 · Crystal Structure of Myxoma Virus M64 · the same entry in another collection · chain A against A, TM-score 1.00

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