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Mechanistic basis of plasmid-specific DNA binding of the F plasmid regulatory protein, tram

Analyse Mechanistic basis of plasmid-specific DNA binding of the F plasmid regulatory… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4QPQ
Type
protein + DNA
Length
465 residues
Chains
10
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Relaxosome protein tram; Sbma DNA1; Sbma DNA2
UniProt
P10026
Pockets
8 · best druggability 0.61

Structure

x-ray diffraction · 5 distinct chains · 67% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, E, GRelaxosome protein tramprotein5066% helix, 10% strandP10026
B, C, D, FRelaxosome protein tramprotein5267% helix, 10% strandP10026
HRelaxosome protein tramprotein5167% helix, 10% strandP10026
PSbma DNA1dna28——
QSbma DNA2dna28——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13550.610.7832empty
23180.540.7528empty
32820.520.7527empty
4770.390.7812empty
5650.390.7912empty

Interfaces

21 interfaces between chains.

  • B–C · 1477 Ų buried · 17 hydrogen bonds · protein-protein
  • F–G · 1473 Ų buried · 16 hydrogen bonds · protein-protein
  • A–D · 1469 Ų buried · 16 hydrogen bonds · protein-protein
  • E–H · 1468 Ų buried · 16 hydrogen bonds · protein-protein
  • P–Q · 1280 Ų buried · 125 hydrogen bonds · nucleic-nucleic

Compared structures

  • 4QPQ · Mechanistic basis of plasmid-specific DNA binding of the F plasmid regulatory protein… · the same entry in another collection · chain Q against Q, TM-score 1.00
  • P10026 · AlphaFold monomer V2.0 prediction for relaxosome protein tram (P10026) · a predicted model of the same protein · chain H against A, TM-score 0.93

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