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MolNFT v1 · #94319 · protein

The structure of the karrikin insensitive (KAI2) protein in arabidopsis thaliana

4HTA · Hydrolase, ALPHA/BETA fold family protein: “The structure of the karrikin insensitive (KAI2) protein in arabidopsis thaliana”. X-ray diffraction, 1 ligand (PO4), 2 pockets (best druggability 0.68). MolNFT v1 #94319 on GenesisL1: 3D…

PDB
4HTA
Type
protein
Length
271 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hydrolase, ALPHA/BETA fold family protein
UniProt
Q9SZU7
Ligands
PO4
Pockets
2 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHydrolase, ALPHA/BETA fold family proteinprotein27147% helix, 18% strandQ9SZU7

Ligands and binding sites

  • PO4 · Phosphate ion · ion · chains A
  • GOL · Glycerol · additive · 5 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11050.680.9126GOL
2570.320.7614empty

Compared structures

  • 4HTA · The structure of the karrikin insensitive (KAI2) protein in Arabidopsis thaliana · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9SZU7 · AlphaFold monomer V2.0 prediction for probable esterase KAI2 (Q9SZU7) · a predicted model of the same protein · chain A against A, TM-score 0.98

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