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MolNFT v1 · #63597 · protein

Crystal structure of full length centaurin alpha-1

3FEH · Centaurin-alpha-1: “Crystal structure of full length centaurin alpha-1”. X-ray diffraction, 2 ligands (ZN, UNX), 3 pockets (best druggability 0.39). MolNFT v1 #63597 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3FEH
Type
protein
Length
357 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Centaurin-alpha-1
UniProt
O75689
Ligands
ZN, UNX
Pockets
3 · best druggability 0.39

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACentaurin-alpha-1protein35734% helix, 27% strandO75689

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • UNX · Unknown atom or ion · ion · 2 copies · chains A

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11120.390.7523empty
2550.360.7916empty
3500.260.7416empty

Compared structures

  • 3FEH · Crystal structure of full length centaurin alpha-1 · the same entry in another collection · chain A against A, TM-score 1.00
  • O75689 · AlphaFold monomer V2.0 prediction for arf-gap with dual pH domain- containing protein 1… · a predicted model of the same protein · chain A against A, TM-score 0.96

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