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Crystal structure of an engineered helicase domain construct for human bloom syndrome protein (blm)

Analyse Crystal structure of an engineered helicase domain construct for human bloom… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7AUC
Type
protein
Length
493 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bloom syndrome PROTEIN,BLOOM syndrome protein
EC
3.6.4.12
UniProt
P54132
Ligands
ADP, MG, CA, ZN
Pockets
4 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABloom syndrome PROTEIN,BLOOM syndrome protein (EC 3.6.4.12)protein49350% helix, 13% strandP54132

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · 2 copies · chains A
  • CA · Calcium ion · metal · 2 copies · chains A
  • ZN · Zinc ion · metal · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A
  • ACT · Acetate ion · additive · 4 copies · chains A
  • PG4 · Tetraethylene glycol · additive · 2 copies · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16640.830.8776EDO, GOL, ADP, MG, CA
22280.530.7727empty
32080.510.7630empty
4650.320.7618ACT

Compared structures

  • 7AUC · Crystal structure of an engineered helicase domain construct for human Bloom syndrome… · the same entry in another collection · chain A against A, TM-score 1.00
  • P54132 · AlphaFold monomer V2.0 prediction for bloom syndrome protein (P54132) · a predicted model of the same protein · chain A against A, TM-score 0.94

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