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MolNFT v1 · #107455 · protein

Crystal structure of cbby (AT3G48420) from arabidobsis thaliana

4UAV · Haloacid dehalogenase-like hydrolase domain-containing…: “Crystal structure of cbby (AT3G48420) from arabidobsis thaliana”. X-ray diffraction, 1 ligand (MG), 1 pocket (best druggability 0.52). MolNFT v1 #107455 on GenesisL1: 3D…

PDB
4UAV
Type
protein
Length
246 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Haloacid dehalogenase-like hydrolase domain-containing protein AT3G48420
EC
3.1.3.-
UniProt
Q94K71
Ligands
MG
Pockets
1 · best druggability 0.52

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHaloacid dehalogenase-like hydrolase domain-containing protein AT3G48420 (EC 3.1.3.-)protein24648% helix, 12% strandQ94K71

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12590.520.7537MG

Compared structures

  • 4UAV · Crystal structure of CbbY (AT3G48420) from Arabidobsis thaliana · the same entry in another collection · chain A against A, TM-score 1.00
  • Q94K71 · AlphaFold monomer V2.0 prediction for cbby-like protein (Q94K71) · a predicted model of the same protein · chain A against A, TM-score 1.00

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