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MolNFT v1 · #122806 · protein

De novo design of protein homo-oligomers with modular hydrogen bond network-mediated specificity

5J0J · Designed protein 2L6HC3_6: “De novo design of protein homo-oligomers with modular hydrogen bond network-mediated specificity”. X-ray diffraction, 1 pocket (best druggability 0.29). MolNFT v1 #122806 on GenesisL1: 3D structure…

PDB
5J0J
Type
protein
Length
210 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Designed protein 2L6HC3_6
Pockets
1 · best druggability 0.29

Structure

x-ray diffraction · 3 distinct chains · 88% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADesigned protein 2L6HC3_6protein7083% helix, 0% strand—
BDesigned protein 2L6HC3_6protein6990% helix, 0% strand—
CDesigned protein 2L6HC3_6protein7192% helix, 0% strand—

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1520.290.7511empty

Interfaces

3 interfaces between chains.

  • A–C · 1074 Ų buried · 7 hydrogen bonds · protein-protein
  • A–B · 989 Ų buried · 8 hydrogen bonds · protein-protein
  • B–C · 948 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 5J0J · De novo design of protein homo-oligomers with modular hydrogen bond network-mediated… · the same entry in another collection · chain A against A, TM-score 1.00

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