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MolNFT v1 · #168824 · protein

Crystal structure of eutv from enterococcus faecalis

6WSH · Response regulator: “Crystal structure of eutv from enterococcus faecalis”. X-ray diffraction, 2 ligands (NA, MG), 3 pockets (best druggability 0.57). MolNFT v1 #168824 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6WSH
Type
protein
Length
380 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Response regulator
UniProt
A0A1Q1FU69
Ligands
NA, MG
Pockets
3 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 62% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BResponse regulatorprotein19062% helix, 13% strandA0A1Q1FU69

Ligands and binding sites

  • NA · Sodium ion · metal · 11 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B
  • GOL · Glycerol · additive · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1990.570.8622NA
22020.500.7623NA
3850.490.8218GOL

Interfaces

1 interface between chains.

  • A–B · 1967 Ų buried · 19 hydrogen bonds · protein-protein

Compared structures

  • 6WSH · Crystal structure of EutV from Enterococcus faecalis · the same entry in another collection · chain A against A, TM-score 1.00

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