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MolNFT v1 · #181039 · protein

Thermotoga maritima encapsulin nanocompartment pore mutant S1K

7LIJ · Maritimacin: “Thermotoga maritima encapsulin nanocompartment pore mutant S1K”. Electron microscopy, 1 ligand (RBF), 1 pocket (best druggability 0.37). MolNFT v1 #181039 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7LIJ
Type
protein
Length
265 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Maritimacin
EC
3.4.-.-
UniProt
Q9WZP2
Ligands
RBF
Pockets
1 · best druggability 0.37

Structure

electron microscopy · 1 distinct chain · 34% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMaritimacin (EC 3.4.-.-)protein26534% helix, 31% strandQ9WZP2

Ligands and binding sites

  • RBF · Riboflavin · ligand · 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
1960.370.7516empty

Compared structures

  • 7LIJ · Thermotoga maritima Encapsulin Nanocompartment Pore Mutant S1K · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9WZP2 · AlphaFold monomer V2.0 prediction for maritimacin (Q9WZP2) · a predicted model of the same protein · chain A against A, TM-score 0.91

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