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Crystal structure of R.NGOAVII restriction endonuclease B3 domain with cognate DNA

Analyse Crystal structure of R.NGOAVII restriction endonuclease B3 domain with cognate… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4RD5
Type
protein + DNA
Length
379 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Restriction endonuclease R.NGOVII; DNA (5'-D(*CP*CP*CP*TP*AP*AP*GP*CP*GP*GP*CP*AP*AP*TP*CP…
EC
3.1.21.4
UniProt
Q5F9M9
Pockets
5 · best druggability 0.50

Structure

x-ray diffraction · 4 distinct chains · 27% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARestriction endonuclease R.NGOVII (EC 3.1.21.4)protein16026% helix, 26% strandQ5F9M9
BRestriction endonuclease R.NGOVII (EC 3.1.21.4)protein15928% helix, 26% strandQ5F9M9
C, EDNA (5'-D(*CP*CP*CP*TP*AP*AP*GP*CP*GP*GP*CP*AP*AP*TP*CP*C)- 3')dna15——
D, FDNA (5'-D(*GP*GP*GP*AP*TP*TP*GP*CP*CP*GP*CP*TP*TP*AP*GP*G)- 3')dna15——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12200.500.7628empty
21490.440.7620empty
31630.420.7519empty
41010.400.7715empty
5670.360.7813empty

Interfaces

7 interfaces between chains.

  • B–F · 762 Ų buried · 18 hydrogen bonds · protein-nucleic
  • A–D · 696 Ų buried · 16 hydrogen bonds · protein-nucleic
  • C–D · 653 Ų buried · 75 hydrogen bonds · nucleic-nucleic
  • E–F · 649 Ų buried · 76 hydrogen bonds · nucleic-nucleic
  • A–C · 581 Ų buried · 14 hydrogen bonds · protein-nucleic

Compared structures

  • 4RD5 · Crystal structure of R.NgoAVII restriction endonuclease B3 domain with cognate DNA · the same entry in another collection · chain A against A, TM-score 1.00

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