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MolNFT v1 · #51329 · protein

Crystal structure of rseb: a sensor for periplasmic stress response in E. COLI

2V43 · Sigma-E factor regulatory protein rseb: “Crystal structure of rseb: a sensor for periplasmic stress response in E. COLI”. X-ray diffraction, 1 ligand (CYS), 3 pockets (best druggability 0.75). MolNFT v1 #51329 on GenesisL1: 3D…

PDB
2V43
Type
protein
Length
813 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sigma-E factor regulatory protein rseb
UniProt
P0AFX9
Ligands
CYS
Pockets
3 · best druggability 0.75

Structure

x-ray diffraction · 3 distinct chains · 14% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASigma-E factor regulatory protein rsebprotein26115% helix, 49% strandP0AFX9
BSigma-E factor regulatory protein rsebprotein27614% helix, 50% strandP0AFX9
CSigma-E factor regulatory protein rsebprotein27613% helix, 51% strandP0AFX9

Ligands and binding sites

  • CYS · Cysteine · ligand · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111820.750.78109CYS
22560.570.7843empty
32010.550.7939empty

Interfaces

2 interfaces between chains.

  • A–B · 896 Ų buried · 29 hydrogen bonds · protein-protein
  • A–C · 528 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 2V43 · Crystal structure of RseB: a sensor for periplasmic stress response in E. coli · the same entry in another collection · chain B against B, TM-score 1.00
  • P0AFX9 · AlphaFold monomer V2.0 prediction for sigma-E factor regulatory protein rseb (P0AFX9) · a predicted model of the same protein · chain B against A, TM-score 0.97

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