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Lanthanide-dependent methanol dehydrogenase xoxf from methylobacterium extorquens, in complex with lanthanum and pyrroloquinoline quinone

Analyse Lanthanide-dependent methanol dehydrogenase xoxf from methylobacterium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6OC6
Type
protein
Length
1,158 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lanthanide-dependent methanol dehydrogenase xoxf
UniProt
C5B120
Ligands
PQQ, LA
Pockets
10 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 9% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BLanthanide-dependent methanol dehydrogenase xoxfprotein5799% helix, 37% strandC5B120

Ligands and binding sites

  • PQQ · Pyrroloquinoline quinone · ligand · 2 copies · chains A, B
  • LA · Lanthanum (III) ion · metal · 2 copies · chains A, B

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

Pockets

10 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1900.770.9829LA, PQQ
21920.660.8543PQQ
31380.460.7728empty
41340.460.7729empty
51880.450.7427empty

Interfaces

1 interface between chains.

  • A–B · 1193 Ų buried · 20 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 6OC6 · Lanthanide-dependent methanol dehydrogenase XoxF from Methylobacterium extorquens, in… · the same entry in another collection · chain A against A, TM-score 1.00

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