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Structure of CLR2 bound to the CLR1 C-terminus

Analyse Structure of CLR2 bound to the CLR1 C-terminus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5IKJ
Type
protein
Length
514 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cryptic loci regulator 2; Cryptic loci regulator protein 1
UniProt
O13881, O74808
Ligands
ZN, CL
Pockets
5 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 30% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACryptic loci regulator 2protein44831% helix, 28% strandO13881
BCryptic loci regulator protein 1protein6626% helix, 15% strandO74808

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • CL · Chloride ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15740.730.8176empty
24310.720.8274empty
31880.510.7824empty
4900.360.7520empty
5520.320.7713empty

Interfaces

1 interface between chains.

  • A–B · 3660 Ų buried · 55 hydrogen bonds · protein-protein

Compared structures

  • 5IKJ · Structure of Clr2 bound to the Clr1 C-terminus · the same entry in another collection · chain A against A, TM-score 1.00
  • O13881 · AlphaFold monomer V2.0 prediction for cryptic loci regulator 2 (O13881) · a predicted model of the same protein · chain A against A, TM-score 0.84
  • O74808 · AlphaFold monomer V2.0 prediction for cryptic loci regulator protein 1 (O74808) · a predicted model of the same protein · chain B against A, TM-score 0.38

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