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Crystal structure of human RECQL5 helicase APO form in complex with engineered nanobody (Gluebody) G3-048

Analyse Crystal structure of human RECQL5 helicase APO form in complex with engineered… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7ZMN
Type
protein
Length
1,128 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.2
Source
Homo sapiens; Lama glama
Molecule
ATP-dependent DNA helicase Q5; Gluebody G3-048
EC
3.6.4.12
UniProt
O94762
Ligands
ZN, SO4
Pockets
7 · best druggability 0.68

Structure

x-ray diffraction · resolution 3.2 · 2 distinct chains · 38% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BATP-dependent DNA helicase Q5 (EC 3.6.4.12)protein44048% helix, 16% strandO94762
K, CGluebody G3-048protein1242% helix, 60% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 3 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16880.680.7670empty
27990.680.7590empty
31380.440.7627SO4
41180.400.7526SO4
5720.360.7714empty

Interfaces

3 interfaces between chains.

  • A–C · 796 Ų buried · 14 hydrogen bonds · protein-protein
  • B–K · 779 Ų buried · 14 hydrogen bonds · protein-protein
  • K–C · 623 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 7ZMN · Crystal structure of human RECQL5 helicase apo form in complex with engineered nanobody… · the same entry in another collection · chain A against A, TM-score 1.00
  • O94762 · AlphaFold monomer V2.0 prediction for ATP-dependent DNA helicase Q5 (O94762) · a predicted model of the same protein · chain A against A, TM-score 0.72

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