Skip to content
Protein sites · the orbital layer on a motif or a bound ligand, in the protein's own frame

Orbitals at a protein site

Load a structure, select a site or ligand, then inspect the local chemistry in place.

Structure

MolNFT collections: PDB Bank (v2, BinaryCIF on chain), PDB (v1) and AlphaFold (v1). AlphaFold models have no metals; the zinc is then placed from the motif.

Occurrences
Load a structure.
Or a ligand in the file
Load a structure.
Find structures by ligand · GL1X ligand index
Search the ligands of every MolNFT record.

The index and the records are GL1X's; this page reads them in your browser. A binding site opens its record here, on that ligand.

Load a structure to begin.
0.050 a.u.
Mol* not loadedR · awaiting a site
ψ > 0ψ < 0

Site report

Compute a site to see its geometry, protonation and metal bonds, or pick a ligand to see what molecule it is.