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1.25 a structure of lysozyme crystallized with (rs)-2-methyl-2,4- pentanediol

Analyse 1.25 a structure of lysozyme crystallized with (rs)-2-methyl-2,4- pentanediol in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4B4J
Type
protein
Length
129 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysozyme C
EC
3.2.1.17
UniProt
P00698
Ligands
CL
Pockets
1 · best druggability 0.37

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALysozyme C (EC 3.2.1.17)protein12941% helix, 11% strandP00698

Ligands and binding sites

  • CL · Chloride ion · ion · 2 copies · chains A
  • MRD · (4R)-2-methylpentane-2,4-diol · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1930.370.7516MRD

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 4B4J · 1.25 A Structure of Lysozyme Crystallized with (RS)-2-methyl-2,4- pentanediol · the same entry in another collection · chain A against A, TM-score 1.00

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