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Crystal structure of FMNH2-dependent monooxygenase from agrobacterium tumefaciens for oxidative desulfurization of sulfoquinovose

Analyse Crystal structure of FMNH2-dependent monooxygenase from agrobacterium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7OLF
Type
protein
Length
738 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methanesulfonate sulfonatase
UniProt
A9CEY7
Pockets
9 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 38% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMethanesulfonate sulfonataseprotein37238% helix, 17% strandA9CEY7
BMethanesulfonate sulfonataseprotein36638% helix, 17% strandA9CEY7

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1960.770.9724empty
2530.710.9818empty
33450.610.7748empty
43340.570.7643empty
52010.500.7628empty

Interfaces

1 interface between chains.

  • A–B · 2361 Ų buried · 40 hydrogen bonds · protein-protein

Compared structures

  • 7OLF · Crystal structure of FMNH2-dependent monooxygenase from Agrobacterium tumefaciens for… · the same entry in another collection · chain A against A, TM-score 1.00

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