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MolNFT v1 · #31720 · protein

Truncated S. aureus lytm, P 32 2 1 crystal form

2B44 · Glycyl-glycine endopeptidase lytm: “Truncated S. aureus lytm, P 32 2 1 crystal form”. X-ray diffraction, 2 ligands (ZN, PO4), 3 pockets (best druggability 0.44). MolNFT v1 #31720 on GenesisL1: 3D structure, binding sites and pockets…

PDB
2B44
Type
protein
Length
258 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycyl-glycine endopeptidase lytm
EC
3.4.24.75
UniProt
O33599
Ligands
ZN, PO4
Pockets
3 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 9% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGlycyl-glycine endopeptidase lytm (EC 3.4.24.75)protein1299% helix, 43% strandO33599

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • PO4 · Phosphate ion · ion · 3 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11100.440.7828empty
2800.430.8023PO4
3880.380.7720PO4

Interfaces

1 interface between chains.

  • A–B · 445 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 2B44 · Truncated S. aureus LytM, P 32 2 1 crystal form · the same entry in another collection · chain A against A, TM-score 1.00
  • O33599 · AlphaFold monomer V2.0 prediction for glycyl-glycine endopeptidase lytm (O33599) · a predicted model of the same protein · chain A against A, TM-score 0.96

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