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Asymmetric DNA-bending in the cre-loxp site-specific recombination synapse

Analyse Asymmetric DNA-bending in the cre-loxp site-specific recombination synapse in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4CRX
Type
protein + DNA
Length
714 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (35 nucleotide cre recognition site); Protein (cre recombinase)
UniProt
P06956
Pockets
11 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 59% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
C, DDNA (35 nucleotide cre recognition site)dna35——
A, BProtein (cre recombinase)protein32259% helix, 5% strandP06956

Pockets

11 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17940.800.8484empty
28970.790.8297empty
33110.620.8029empty
43080.550.7629empty
51290.550.8325empty

Interfaces

6 interfaces between chains.

  • A–B · 1680 Ų buried · 23 hydrogen bonds · protein-protein
  • C–B · 1568 Ų buried · 32 hydrogen bonds · protein-nucleic
  • C–D · 1536 Ų buried · 115 hydrogen bonds · nucleic-nucleic
  • D–A · 1404 Ų buried · 30 hydrogen bonds · protein-nucleic
  • D–B · 1382 Ų buried · 29 hydrogen bonds · protein-nucleic

Compared structures

  • 4CRX · Asymmetric DNA-bending in the cre-loxp site-specific recombination synapse · the same entry in another collection · chain C against C, TM-score 1.00

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