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3-methylbenzylazide in complex with T4 L99A/M102Q

Analyse 3-methylbenzylazide in complex with T4 L99A/M102Q in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2RBQ
Type
protein
Length
162 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysozyme
EC
3.2.1.17
UniProt
P00720
Ligands
263, PO4
Pockets
2 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 62% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALysozyme (EC 3.2.1.17)protein16262% helix, 8% strandP00720

Ligands and binding sites

  • 263 · 1-(azidomethyl)-3-methylbenzene · ligand · chains A
  • PO4 · Phosphate ion · ion · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1640.730.9815263
22570.540.7631empty

Compared structures

  • 2RBQ · 3-methylbenzylazide in complex with T4 L99A/M102Q · the same entry in another collection · chain A against A, TM-score 1.00

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