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MolNFT v1 · #90906 · protein

Crystal structure of a putative lipoprotein (CD1622) from clostridium difficile 630 at 1.85 a resolution

4EXR: “Crystal structure of a putative lipoprotein (CD1622) from clostridium difficile 630 at 1.85 a resolution”. X-ray diffraction, 2 ligands (NA, PO4), 1 pocket (best druggability 0.33). MolNFT v1 #90906 on GenesisL1: 3D structure…

PDB
4EXR
Type
protein
Length
152 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative lipoprotein
UniProt
Q186H8
Ligands
NA, PO4
Pockets
1 · best druggability 0.33

Structure

x-ray diffraction · 1 distinct chain · 21% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative lipoproteinprotein15221% helix, 45% strandQ186H8

Ligands and binding sites

  • NA · Sodium ion · metal · chains A
  • PO4 · Phosphate ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1620.330.7614empty

Modifications

Observed in the structure: 4 modified (engineered).

Compared structures

  • 4EXR · Crystal structure of a putative lipoprotein (CD1622) from Clostridium difficile 630 at… · the same entry in another collection · chain A against A, TM-score 1.00

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