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MolNFT v1 · #115371 · protein

Fab fragments of chikungunya virus neutralizing human monoclonal antibody 5M16

5CHN · Antibody 5M16 Fab heavy chain: “Fab fragments of chikungunya virus neutralizing human monoclonal antibody 5M16”. X-ray diffraction, 3 pockets (best druggability 0.75). MolNFT v1 #115371 on GenesisL1: 3D structure, binding sites and…

PDB
5CHN
Type
protein
Length
865 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Antibody 5M16 Fab heavy chain; Antibody 5M16 Fab light chain
Pockets
3 · best druggability 0.75

Structure

x-ray diffraction · 3 distinct chains · 8% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HAntibody 5M16 Fab heavy chainprotein21511% helix, 52% strand—
L, BAntibody 5M16 Fab light chainprotein2185% helix, 50% strand—
AAntibody 5M16 Fab heavy chainprotein2149% helix, 51% strand—

Pockets

3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19910.750.7897empty
22500.540.7735empty
33310.540.7443empty

Interfaces

4 interfaces between chains.

  • H–L · 1675 Ų buried · 17 hydrogen bonds · protein-protein
  • A–B · 1665 Ų buried · 16 hydrogen bonds · protein-protein
  • H–B · 327 Ų buried · 5 hydrogen bonds · protein-protein
  • L–B · 121 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 7 disulfide (disulfide).

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