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MolNFT v1 · #127649 · protein + DNA

Mobm relaxase domain (mobv; MOB_PRE) bound to 26NT PMV158 orit DNA

5N2Q · Plasmid recombination enzyme: “Mobm relaxase domain (mobv; MOB_PRE) bound to 26NT PMV158 orit DNA”. X-ray diffraction, 3 ligands (MG, NA, CL), 2 pockets (best druggability 0.67). MolNFT v1 #127649 on GenesisL1: 3D structure, binding…

PDB
5N2Q
Type
protein + DNA
Length
200 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Plasmid recombination enzyme; DNA (26-mer)
UniProt
P13925
Ligands
MG, NA, CL
Pockets
2 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APlasmid recombination enzymeprotein17441% helix, 20% strandP13925
BDNA (26-mer)dna26——

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A
  • NA · Sodium ion · metal · chains B
  • CL · Chloride ion · ion · chains A
  • GOL · Glycerol · additive · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11410.670.8819empty
21900.480.7621GOL

Interfaces

1 interface between chains.

  • A–B · 1676 Ų buried · 44 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 7 modified (engineered).

Compared structures

  • 5N2Q · MobM Relaxase Domain (MOBV; Mob_Pre) bound to 26nt pMV158 oriT DNA · the same entry in another collection · chain A against A, TM-score 1.00
  • P13925 · AlphaFold monomer V2.0 prediction for plasmid recombination enzyme (P13925) · a predicted model of the same protein · chain A against A, TM-score 0.98

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