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Crystal structure of haloalkane dehalogenase linb I253M mutant from sphingobium sp. MI1205

Analyse Crystal structure of haloalkane dehalogenase linb I253M mutant from sphingobium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4H7K
Type
protein
Length
294 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Haloalkane dehalogenase
UniProt
A4PEU6
Ligands
CA, CL
Pockets
2 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHaloalkane dehalogenaseprotein29443% helix, 20% strandA4PEU6

Ligands and binding sites

  • CA · Calcium ion · metal · chains A
  • CL · Chloride ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1700.750.9818CL
2580.330.7715empty

Compared structures

  • 4H7K · Crystal structure of haloalkane dehalogenase LinB I253M mutant from Sphingobium sp. MI1205 · the same entry in another collection · chain A against A, TM-score 1.00

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