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Crystal structure of staphylococcal nuclease variant DELTA+NVIAGLA V23E/L36E at cryogenic temperature

Analyse Crystal structure of staphylococcal nuclease variant DELTA+NVIAGLA V23E/L36E at… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3TP5
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
Pockets
2 · best druggability 0.65

Structure

x-ray diffraction · 1 distinct chain · 28% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AThermonuclease (EC 3.1.31.1)protein12928% helix, 29% strandP00644

Ligands and binding sites

  • THP · Thymidine-3',5'-diphosphate · ligand · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 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
13460.650.7928MPD
2870.440.8016THP

Compared structures

  • 3TP5 · Crystal structure of Staphylococcal nuclease variant Delta+NVIAGLA V23E/L36E at cryogenic… · the same entry in another collection · chain A against A, TM-score 1.00

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