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MolNFT v1 · #159011 · protein + DNA

Structure of a DNA-bound dimer extracted from filamentous sgrai endonuclease in its activated form

6OBJ · Sgrair restriction enzyme: “Structure of a DNA-bound dimer extracted from filamentous sgrai endonuclease in its activated form”. Electron microscopy, 1 ligand (MG), 8 pockets (best druggability 0.71). MolNFT v1 #159011 on GenesisL1…

PDB
6OBJ
Type
protein + DNA
Length
728 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sgrair restriction enzyme; DNA (26-mer)
EC
3.1.21.-
UniProt
Q9F6L0
Ligands
MG
Pockets
8 · best druggability 0.71

Structure

electron microscopy · 2 distinct chains · 39% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BSgrair restriction enzyme (EC 3.1.21.-)protein33839% helix, 11% strandQ9F6L0
C, DDNA (26-mer)dna26——

Ligands and binding sites

  • MG · Magnesium ion · metal · 2 copies · chains A, C, B, D

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

Pockets

8 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12820.710.8635empty
23100.710.8539empty
33650.580.7635empty
43040.570.7733empty
51640.430.7520empty

Interfaces

6 interfaces between chains.

  • A–B · 1622 Ų buried · 22 hydrogen bonds · protein-protein
  • C–D · 1256 Ų buried · 117 hydrogen bonds · nucleic-nucleic
  • C–B · 968 Ų buried · 16 hydrogen bonds · protein-nucleic
  • A–D · 968 Ų buried · 17 hydrogen bonds · protein-nucleic
  • B–D · 798 Ų buried · 16 hydrogen bonds · protein-nucleic

Compared structures

  • 6OBJ · Structure of a DNA-bound dimer extracted from filamentous SgrAI endonuclease in its… · the same entry in another collection · chain A against A, TM-score 1.00

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