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Lysozyme 056 from deep neural language modeling

Analyse Lysozyme 056 from deep neural language modeling in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7RGR
Type
protein
Length
333 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Artificial protein L056
EC
3.2.1.17
Ligands
CL
Pockets
5 · best druggability 0.60

Structure

x-ray diffraction · 2 distinct chains · 60% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BArtificial protein L056 (EC 3.2.1.17)protein16759% helix, 10% strand—
AArtificial protein L056 (EC 3.2.1.17)protein16661% helix, 10% strand—

Ligands and binding sites

  • CL · Chloride ion · ion · chains B, A
  • NHE · 2-[N-cyclohexylamino]ethane sulfonic acid · additive · chains B, A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12800.600.7921empty
21120.400.7516empty
3780.370.7719empty
41100.340.7215empty
5560.240.7115empty

Interfaces

1 interface between chains.

  • B–A · 931 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 7RGR · Lysozyme 056 from Deep neural language modeling · the same entry in another collection · chain B against B, TM-score 1.00

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