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MolNFT v1 · #12212 · protein

The papase HAL2P complexed with a sodium ion and the reaction product AMP

1KA0 · Halotolerance protein HAL2: “The papase HAL2P complexed with a sodium ion and the reaction product AMP”. X-ray diffraction, 2 ligands (AMP, NA), 1 pocket (best druggability 0.70). MolNFT v1 #12212 on GenesisL1: 3D structure, binding…

PDB
1KA0
Type
protein
Length
353 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Halotolerance protein HAL2
EC
3.1.3.7
UniProt
P32179
Ligands
AMP, NA
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHalotolerance protein HAL2 (EC 3.1.3.7)protein35339% helix, 20% strandP32179

Ligands and binding sites

  • AMP · Adenosine monophosphate · ligand · chains A
  • NA · Sodium 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
12950.700.8438AMP

Compared structures

  • 1KA0 · The PAPase Hal2p complexed with a sodium ion and the reaction product AMP · the same entry in another collection · chain A against A, TM-score 1.00
  • P32179 · AlphaFold monomer V2.0 prediction for 3'(2'),5'-bisphosphate nucleotidase (P32179) · a predicted model of the same protein · chain A against A, TM-score 0.99

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