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MolNFT v1 · #65681 · protein

Crystal structure of a NLPC/P60 family protein (BCE_2878) from bacillus cereus atcc 10987 at 1.79 a resolution

3H41 · NLP/P60 family protein: “Crystal structure of a NLPC/P60 family protein (BCE_2878) from bacillus cereus atcc 10987 at 1.79 a resolution”. X-ray diffraction, 1 ligand (PO4), 3 pockets (best druggability 0.62). MolNFT v1 #65681 on…

PDB
3H41
Type
protein
Length
307 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
NLP/P60 family protein
UniProt
Q736M3
Ligands
PO4
Pockets
3 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 23% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANLP/P60 family proteinprotein30723% helix, 36% strandQ736M3

Ligands and binding sites

  • PO4 · Phosphate ion · ion · chains A
  • PG4 · Tetraethylene glycol · additive · 6 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12420.620.8132empty
2990.400.7619empty
3690.380.7815PG4

Modifications

Observed in the structure: 6 modified, 1 d-amino (engineered, D-amino acid, oxidation).

Compared structures

  • 3H41 · Crystal structure of a NLPC/P60 family protein (BCE_2878) from bacillus cereus atcc 10987… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q736M3 · AlphaFold monomer V2.0 prediction for gamma-D-glutamyl-L-lysine dipeptidyl-peptidase… · a predicted model of the same protein · chain A against A, TM-score 0.99

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