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MolNFT v1 · #106492 · protein

Wild type T4 lysozyme structure

4S0W: “Wild type T4 lysozyme structure”. X-ray diffraction, 2 ligands (SO4, CL), 1 pocket (best druggability 0.79). MolNFT v1 #106492 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4S0W
Type
protein
Length
324 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysozyme
EC
3.2.1.17
UniProt
D9IEF7
Ligands
SO4, CL
Pockets
1 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 62% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BLysozyme (EC 3.2.1.17)protein16262% helix, 9% strandD9IEF7

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A, B
  • CL · Chloride ion · ion · 3 copies · chains A, B
  • GOL · Glycerol · additive · 3 copies · chains A, B
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111180.790.8180EPE, CL

Interfaces

1 interface between chains.

  • A–B · 803 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 4S0W · Wild type T4 lysozyme structure · the same entry in another collection · chain A against A, TM-score 1.00

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