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MolNFT v1 · #27122 · protein

Crystal structure of the human BETA2-chimaerin

1XA6: “Crystal structure of the human BETA2-chimaerin”. X-ray diffraction, 1 ligand (ZN), 4 pockets (best druggability 0.73). MolNFT v1 #27122 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1XA6
Type
protein
Length
399 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
BETA2-chimaerin
UniProt
P52757
Ligands
ZN
Pockets
4 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABETA2-chimaerinprotein39936% helix, 8% strandP52757

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15840.730.8078empty
2580.540.8816empty
31600.470.7723empty
4990.380.7521empty

Compared structures

  • 1XA6 · Crystal Structure of the Human Beta2-Chimaerin · the same entry in another collection · chain A against A, TM-score 1.00
  • P52757 · AlphaFold monomer V2.0 prediction for beta-chimaerin (P52757) · a predicted model of the same protein · chain A against A, TM-score 0.54

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