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Crystal structure of reduced methylosinus trichosporium OB3B soluble methane monooxygenase hydroxylase

Analyse Crystal structure of reduced methylosinus trichosporium OB3B soluble methane… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6VK7
Type
protein
Length
1,070 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methane monooxygenase component a alpha chain; Methane monooxygenase
UniProt
A0A2D2D5X0, A0A2D2D5X7, A0A2D2D0T0
Ligands
FE
Pockets
9 · best druggability 0.78

Structure

x-ray diffraction · 3 distinct chains · 63% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMethane monooxygenase component a alpha chainprotein51561% helix, 4% strandA0A2D2D5X0
BMethane monooxygenaseprotein38767% helix, 1% strandA0A2D2D5X7
CMethane monooxygenaseprotein16863% helix, 4% strandA0A2D2D0T0

Ligands and binding sites

  • FE · Fe (III) ion · metal · 2 copies · chains A

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

Pockets

9 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1910.780.9931empty
2940.770.9823empty
3660.730.9818empty
41210.510.8122empty
51370.490.7927empty

Interfaces

3 interfaces between chains.

  • A–B · 5350 Ų buried · 90 hydrogen bonds · protein-protein
  • A–C · 2200 Ų buried · 36 hydrogen bonds · protein-protein
  • B–C · 1408 Ų buried · 21 hydrogen bonds · protein-protein

Compared structures

  • 6VK7 · Crystal Structure of reduced Methylosinus trichosporium OB3b Soluble Methane… · the same entry in another collection · chain C against C, TM-score 1.00

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