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Complex between the leucine zipper (lz) and centrosomin-motif 2 (CM2) domains of drosophila melanogaster centrosomin (cnn)

Analyse Complex between the leucine zipper (lz) and centrosomin-motif 2 (CM2) domains… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5MVW
Type
protein
Length
206 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Centrosomin
UniProt
P54623
Ligands
ZN, CL
Pockets
2 · best druggability 0.53

Structure

x-ray diffraction · 4 distinct chains · 91% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACentrosominprotein6093% helix, 0% strandP54623
CCentrosominprotein3784% helix, 0% strandP54623
DCentrosominprotein4892% helix, 0% strandP54623
BCentrosominprotein6192% helix, 0% strandP54623

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A, B
  • CL · Chloride ion · ion · chains D, B
  • EDO · 1,2-ethanediol · additive · 3 copies · chains D, B

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
11270.530.8120empty
21000.370.7522empty

Interfaces

6 interfaces between chains.

  • A–B · 954 Ų buried · 11 hydrogen bonds · protein-protein
  • C–D · 795 Ų buried · 3 hydrogen bonds · protein-protein
  • D–B · 415 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 399 Ų buried · 4 hydrogen bonds · protein-protein
  • C–B · 391 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 5MVW · Complex between the Leucine Zipper (LZ) and Centrosomin-motif 2 (CM2) domains of… · the same entry in another collection · chain B against B, TM-score 1.00
  • P54623 · AlphaFold monomer V2.0 prediction for centrosomin (P54623) · a predicted model of the same protein · chain D against A, TM-score 0.94

Analyse

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