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Murine core lysosomal multienzyme complex (lmc) composed of acid beta- galactosidase (GLB1) and protective protein cathepsin a (ppca, ctsa)

Analyse Murine core lysosomal multienzyme complex (lmc) composed of acid beta… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7KDV
Type
protein
Length
6,312 residues
Chains
12
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-galactosidase; Lysosomal protective protein
EC
3.2.1.23, 3.4.16.5
UniProt
P23780, P16675
Ligands
NAG, BMA
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 2 distinct chains · 27% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, G, I, KBeta-galactosidase (EC 3.2.1.23)protein60023% helix, 28% strandP23780
B, D, F, H, J, LLysosomal protective protein (EC 3.4.16.5)protein45232% helix, 22% strandP16675

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 66 copies · chains A, B, C, D, E, F, G, H, I, J, K, L
  • BMA · beta-D-mannopyranose · sugar · 6 copies · chains A

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

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18300.790.8285empty
28140.770.8173empty
35580.760.8350empty
45660.750.8255empty
55750.750.8253empty

Interfaces

12 interfaces between chains.

  • H–J · 1966 Ų buried · 13 hydrogen bonds · protein-protein
  • D–F · 1960 Ų buried · 15 hydrogen bonds · protein-protein
  • B–L · 1951 Ų buried · 13 hydrogen bonds · protein-protein
  • A–C · 900 Ų buried · 0 hydrogen bonds · protein-protein
  • E–G · 897 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 48 glycan, 36 disulfide (N-glycosylation, disulfide).

Compared structures

  • 7KDV · Murine core lysosomal multienzyme complex (LMC) composed of acid beta-galactosidase… · the same entry in another collection · chain L against L, TM-score 1.00

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