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A pre-transition state eco ri ENDONUCLEASE/COGNATE DNA (tcgcgapttcgcg) complex with DNA base analog purine (P)

Analyse A pre-transition state eco ri ENDONUCLEASE/COGNATE DNA (tcgcgapttcgcg) complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1CL8
Type
protein + DNA
Length
274 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*TP*CP*GP*CP*GP*AP*(PRN) P*TP*TP*CP*GP*CP*G)-3'); Protein (endonuclease)
UniProt
P00642
Pockets
3 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 35% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BDNA (5'-D(*TP*CP*GP*CP*GP*AP*(PRN) P*TP*TP*CP*GP*CP*G)-3')dna13——
AProtein (endonuclease)protein26135% helix, 20% strandP00642

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11140.390.7417empty
2670.320.7515empty
3620.300.7517empty

Interfaces

1 interface between chains.

  • B–A · 796 Ų buried · 18 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 1CL8 · A pre-transition state eco ri ENDONUCLEASE/COGNATE DNA (tcgcgapttcgcg) complex with DNA… · the same entry in another collection · chain B against B, TM-score 1.00
  • P00642 · AlphaFold monomer V2.0 prediction for type-2 restriction enzyme ecori (P00642) · a predicted model of the same protein · chain A against A, TM-score 0.99

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