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Crystal structure of cysteine desulfurase from legionella pneumophila philadelphia 1

Analyse Crystal structure of cysteine desulfurase from legionella pneumophila… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6C9E
Type
protein
Length
811 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cysteine desulfurase
EC
2.8.1.7
UniProt
Q5ZXX6
Ligands
ZN
Pockets
3 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACysteine desulfurase (EC 2.8.1.7)protein40545% helix, 19% strandQ5ZXX6
BCysteine desulfurase (EC 2.8.1.7)protein40645% helix, 19% strandQ5ZXX6

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14000.660.7943empty
2580.610.9317EDO
3540.340.7810empty

Interfaces

1 interface between chains.

  • A–B · 3433 Ų buried · 62 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (cofactor).

Compared structures

  • 6C9E · Crystal structure of Cysteine desulfurase from Legionella pneumophila Philadelphia 1 · the same entry in another collection · chain A against A, TM-score 1.00

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