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MolNFT v1 · #136959 · protein

Pekin duck egg lysozyme isoform III (del-III), cubic form

5V94: “Pekin duck egg lysozyme isoform III (del-III), cubic form”. X-ray diffraction, 1 ligand (PO4), 2 pockets (best druggability 0.54). MolNFT v1 #136959 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5V94
Type
protein
Length
258 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysozyme isoform III
EC
3.2.1.18
UniProt
U3J0P1
Ligands
PO4
Pockets
2 · best druggability 0.54

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BLysozyme isoform III (EC 3.2.1.18)protein12942% helix, 11% strandU3J0P1

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 7 copies · chains A, B
  • MRD · (4R)-2-methylpentane-2,4-diol · additive · chains A
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12450.540.7623empty
2560.300.7513TRS

Interfaces

1 interface between chains.

  • A–B · 290 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 5V94 · Pekin duck egg lysozyme isoform III (DEL-III), cubic form · the same entry in another collection · chain A against A, TM-score 1.00

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