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MolNFT v2 · #66026 · protein

Crystal Structure of Response regulator receiver domain from Rhodospirillum rubrum

3HEB · Response regulator receiver domain protein (CheY): “Crystal Structure of Response regulator receiver domain from Rhodospirillum rubrum”. X-ray diffraction at 2.4, 1 ligand (PO4), 1 pocket (best druggability 0.52). MolNFT v2 #66026…

PDB
3HEB
Type
protein
Length
284 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.4
Source
Rhodospirillum rubrum
Molecule
Response regulator receiver domain protein (CheY)
UniProt
Q2RWM6
Ligands
PO4
Pockets
1 · best druggability 0.52

Structure

x-ray diffraction · resolution 2.4 · 1 distinct chain · 42% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BResponse regulator receiver domain protein (CheY)protein14242% helix, 19% strandQ2RWM6

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11750.520.7920empty

Interfaces

1 interface between chains.

  • A–B · 1226 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 modified (engineered).

Compared structures

  • 3HEB · Crystal structure of response regulator receiver domain from rhodospirillum rubrum · the same entry in another collection · chain A against A, TM-score 1.00

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