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MolNFT v1 · #126168 · protein

Structures of dhbn domain of human blm helicase

5LUP · Blm protein: “Structures of dhbn domain of human blm helicase”. X-ray diffraction, 2 ligands (K, PO4), 6 pockets (best druggability 0.77). MolNFT v1 #126168 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5LUP
Type
protein
Length
617 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Blm protein
UniProt
Q3B7X0
Ligands
K, PO4
Pockets
6 · best druggability 0.77

Structure

x-ray diffraction · 8 distinct chains · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, K, LBlm proteinprotein5076% helix, 0% strandQ3B7X0
BBlm proteinprotein5176% helix, 0% strandQ3B7X0
CBlm proteinprotein5470% helix, 0% strandQ3B7X0
D, EBlm proteinprotein5370% helix, 0% strandQ3B7X0
F, GBlm proteinprotein5273% helix, 0% strandQ3B7X0
HBlm proteinprotein5281% helix, 0% strandQ3B7X0
IBlm proteinprotein5173% helix, 0% strandQ3B7X0
JBlm proteinprotein4973% helix, 0% strandQ3B7X0

Ligands and binding sites

  • K · Potassium ion · metal · 2 copies · chains B, D
  • PO4 · Phosphate ion · ion · 2 copies · chains A, F, I, J

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111850.770.79103empty
22640.560.7741empty
31470.540.8124empty
42730.540.7537empty
5660.300.7418empty

Interfaces

26 interfaces between chains.

  • C–D · 1480 Ų buried · 4 hydrogen bonds · protein-protein
  • E–F · 1388 Ų buried · 4 hydrogen bonds · protein-protein
  • G–H · 1352 Ų buried · 4 hydrogen bonds · protein-protein
  • K–L · 1317 Ų buried · 1 hydrogen bond · protein-protein
  • I–J · 1306 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 5LUP · Structures of DHBN domain of human BLM helicase · the same entry in another collection · chain A against A, TM-score 1.00

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