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An enumerative algorithm for de novo design of proteins with diverse pocket structures

Analyse An enumerative algorithm for de novo design of proteins with diverse pocket… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6W3W
Type
protein
Length
107 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Denovo NTF2
Ligands
NO3

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADenovo NTF2protein10735% helix, 50% strand—

Ligands and binding sites

  • NO3 · Nitrate ion · ion · 2 copies · chains A

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

Compared structures

  • 6W3W · An enumerative algorithm for de novo design of proteins with diverse pocket structures · the same entry in another collection · chain A against A, TM-score 1.00

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