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MolNFT v1 · #70719 · protein + DNA

Crystal structure of dest in complex with duplex DNA

3LSR: “Crystal structure of dest in complex with duplex DNA”. X-ray diffraction, 1 ligand (SO4), 1 pocket (best druggability 0.78). MolNFT v1 #70719 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3LSR
Type
protein + DNA
Length
219 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dest; DNA (27-mer)
UniProt
Q9HUS3
Ligands
SO4
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 77% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADestprotein19277% helix, 0% strandQ9HUS3
BDNA (27-mer)dna27——

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · 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
13290.780.8835SO4

Interfaces

1 interface between chains.

  • A–B · 435 Ų buried · 12 hydrogen bonds · protein-nucleic

Compared structures

  • 3LSR · Crystal structure of DesT in complex with duplex DNA · the same entry in another collection · chain A against A, TM-score 1.00

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