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MolNFT v1 · #109424 · protein

Clostridium difficile fic PROTEIN_0569 mutant S31A, E35A

4X2C · Fic family protein putative filamentation induced by camp…: “Clostridium difficile fic PROTEIN_0569 mutant S31A, E35A”. X-ray diffraction, 1 ligand (PO4), 5 pockets (best druggability 0.46). MolNFT v1 #109424 on GenesisL1: 3D…

PDB
4X2C
Type
protein
Length
410 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fic family protein putative filamentation induced by camp protein
UniProt
C9YJ22
Ligands
PO4
Pockets
5 · best druggability 0.46

Structure

x-ray diffraction · 2 distinct chains · 65% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFic family protein putative filamentation induced by camp proteinprotein20764% helix, 4% strandC9YJ22
BFic family protein putative filamentation induced by camp proteinprotein20366% helix, 4% strandC9YJ22

Ligands and binding sites

  • PO4 · Phosphate ion · ion · chains A
  • GOL · Glycerol · additive · 5 copies · chains A, B
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains A

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

Pockets

5 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11110.460.7927empty
21270.430.7623empty
31000.390.7621GOL
4660.320.7512empty
5630.270.7216PO4

Interfaces

1 interface between chains.

  • A–B · 666 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 4X2C · Clostridium difficile Fic protein_0569 mutant S31A, E35A · the same entry in another collection · chain A against A, TM-score 1.00

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