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MolNFT v1 · #121830 · protein

Crystal structure of staphylococcal nuclease variant DELTA+PHS A90E at cryogenic temperature

5I6Y · Thermonuclease: “Crystal structure of staphylococcal nuclease variant DELTA+PHS A90E at cryogenic temperature”. X-ray diffraction, 2 ligands (THP, CA), 1 pocket (best druggability 0.44). MolNFT v1 #121830 on GenesisL1: 3D structure…

PDB
5I6Y
Type
protein
Length
129 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Thermonuclease
EC
3.1.31.1
UniProt
P00644
Ligands
THP, CA
Pockets
1 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 29% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AThermonuclease (EC 3.1.31.1)protein12929% helix, 33% strandP00644

Ligands and binding sites

  • THP · Thymidine-3',5'-diphosphate · ligand · chains A
  • CA · Calcium 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1870.440.7915THP

Compared structures

  • 5I6Y · Crystal structure of Staphylococcal nuclease variant Delta+PHS A90E at cryogenic… · the same entry in another collection · chain A against A, TM-score 1.00

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