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Binding of N,N'-diacetylchitobiose to hew lysozyme: a powder diffraction study

Analyse Binding of N,N'-diacetylchitobiose to hew lysozyme: a powder diffraction study in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1SF4
Type
protein
Length
129 residues
Chains
1
Method
powder diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysozyme
EC
3.2.1.17
UniProt
P00698
Ligands
NAG
Pockets
3 · best druggability 0.79

Structure

powder diffraction · 1 distinct chain · 28% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALysozyme (EC 3.2.1.17)protein12928% helix, 6% strandP00698

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12230.790.9228empty
2510.500.8718empty
3700.390.7911NAG

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1SF4 · Binding of N,N'-diacetylchitobiose to hew lysozyme: a powder diffraction study · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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