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Structure of no-DNA factor

Analyse Structure of no-DNA factor in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4GCL
Type
protein + DNA
Length
1,580 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nucleoid occlusion factor slma; DNA (5'-D(*AP*GP*TP*GP*AP*GP*TP*AP*CP*TP*CP*AP*CP*T)-3')
UniProt
Q1R4V1
Pockets
19 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, G, HNucleoid occlusion factor slmaprotein19075% helix, 0% strandQ1R4V1
BNucleoid occlusion factor slmaprotein19675% helix, 0% strandQ1R4V1
D, FNucleoid occlusion factor slmaprotein18973% helix, 0% strandQ1R4V1
W, Z, R, TDNA (5'-D(*AP*GP*TP*GP*AP*GP*TP*AP*CP*TP*CP*AP*CP*T)-3')dna14——

Ligands and binding sites

  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · 4 copies · chains A, C, E, F

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

Pockets

19 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18220.720.7871empty
22050.680.8637empty
3850.560.8721empty
43760.560.7536empty
53560.550.7530empty

Interfaces

29 interfaces between chains.

  • A–B · 1789 Ų buried · 33 hydrogen bonds · protein-protein
  • G–H · 1745 Ų buried · 34 hydrogen bonds · protein-protein
  • C–D · 1742 Ų buried · 31 hydrogen bonds · protein-protein
  • E–F · 1713 Ų buried · 32 hydrogen bonds · protein-protein
  • R–T · 625 Ų buried · 53 hydrogen bonds · nucleic-nucleic

Compared structures

  • 4GCL · structure of no-dna factor · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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