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MolNFT v1 · #147930 · protein

The crystal structure of mouse chloride intracellular channel protein 6

6ERZ: “The crystal structure of mouse chloride intracellular channel protein 6”. X-ray diffraction, 1 ligand (SO4), 5 pockets (best druggability 0.72). MolNFT v1 #147930 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6ERZ
Type
protein
Length
450 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chloride intracellular channel protein 6
UniProt
Q8BHB9
Ligands
SO4
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 48% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChloride intracellular channel protein 6protein22348% helix, 10% strandQ8BHB9
BChloride intracellular channel protein 6protein22748% helix, 9% strandQ8BHB9

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 5 copies · chains A, B
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1920.720.9418TRS
22120.480.7529SO4
31540.430.7525empty
41370.390.7323empty
5610.340.7719empty

Interfaces

1 interface between chains.

  • A–B · 526 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 6ERZ · The crystal structure of mouse chloride intracellular channel protein 6 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8BHB9 · AlphaFold monomer V2.0 prediction for chloride intracellular channel protein 6 (Q8BHB9) · a predicted model of the same protein · chain A against A, TM-score 0.98

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