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MolNFT v1 · #90978 · protein

Crystal structure of the substrate binding domain of E.COLI dnak in complex with pr-bombesin in space group I222

4EZU · Chaperone protein dnak: “Crystal structure of the substrate binding domain of E.COLI dnak in complex with pr-bombesin in space group…”. X-ray diffraction, 3 pockets (best druggability 0.52). MolNFT v1 #90978 on GenesisL1: 3D…

PDB
4EZU
Type
protein
Length
229 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chaperone protein dnak; Proline rich bombesin-related protein
UniProt
P0A6Y8, Q8QFP2
Pockets
3 · best druggability 0.52

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChaperone protein dnakprotein21642% helix, 27% strandP0A6Y8
BProline rich bombesin-related proteinprotein130% helix, 15% strandQ8QFP2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11190.520.8220empty
2530.310.7713empty
3540.300.7515empty

Interfaces

1 interface between chains.

  • A–B · 837 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 4EZU · Crystal structure of the substrate binding domain of E.coli DnaK in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P0A6Y8 · AlphaFold monomer V2.0 prediction for chaperone protein dnak (P0A6Y8) · a predicted model of the same protein · chain A against A, TM-score 0.46

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