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MolNFT v1 · #161902 · protein

Crystal structure of the hybrid bioinorganic complex of PIZZA6S linked by the 1:2 ce-substituted keggin

6QSH: “Crystal structure of the hybrid bioinorganic complex of PIZZA6S linked by the 1:2 ce-substituted keggin”. X-ray diffraction, 1 ligand (JGH), 1 pocket (best druggability 0.73). MolNFT v1 #161902 on GenesisL1: 3D structure, binding…

PDB
6QSH
Type
protein
Length
246 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PIZZA6S
Ligands
JGH
Pockets
1 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 1% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APIZZA6Sprotein2461% helix, 39% strand—

Ligands and binding sites

  • JGH · 1:2 Ce-substituted Keggin · ligand · 2 copies · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16060.730.8159empty

Compared structures

  • 6QSH · Crystal structure of the hybrid bioinorganic complex of Pizza6S linked by the 1:2… · the same entry in another collection · chain A against A, TM-score 1.00

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