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Structure of lpmo domain of colonization factor gbpa from vibrio cholerae in the presence of calcium

Analyse Structure of lpmo domain of colonization factor gbpa from vibrio cholerae in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7PB7
Type
protein
Length
360 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glcnac-binding protein a
UniProt
Q9KLD5
Ligands
CU, CA
Pockets
1 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 12% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGlcnac-binding protein aprotein18012% helix, 37% strandQ9KLD5

Ligands and binding sites

  • CU · Copper (II) ion · metal · 2 copies · chains A, B
  • CA · Calcium ion · metal · 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
13800.710.8347empty

Interfaces

1 interface between chains.

  • A–B · 334 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7PB7 · Structure of LPMO domain of colonization factor GbpA from Vibrio cholerae in the presence… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9KLD5 · AlphaFold monomer V2.0 prediction for glcnac-binding protein a (Q9KLD5) · a predicted model of the same protein · chain A against A, TM-score 0.99

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