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Crystal structure of CFL1-D123S from burkholderia cenocepacia

Analyse Crystal structure of CFL1-D123S from burkholderia cenocepacia in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7JQY
Type
protein
Length
2,348 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cif-like 1
UniProt
B4EJL9
Pockets
20 · best druggability 0.83

Structure

x-ray diffraction · 3 distinct chains · 45% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, F, GCif-like 1protein29345% helix, 18% strandB4EJL9
B, D, E, HCif-like 1protein29445% helix, 18% strandB4EJL9
CCif-like 1protein29346% helix, 17% strandB4EJL9

Pockets

20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111660.830.84120empty
21560.720.9025empty
31650.700.8826empty
41800.700.8830empty
52950.690.8429empty

Interfaces

11 interfaces between chains.

  • C–F · 800 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 655 Ų buried · 6 hydrogen bonds · protein-protein
  • C–D · 552 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 537 Ų buried · 9 hydrogen bonds · protein-protein
  • C–H · 503 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 7JQY · Crystal structure of Cfl1-D123S from Burkholderia cenocepacia · the same entry in another collection · chain A against A, TM-score 1.00

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